#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2t h HIS 30 N 0.00 -0.36 -0.60 -0.67 2.76 -2.06 -1.90 115.15 112.32 1h2t h HIS 30 Ca 0.00 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.14 1h2t h HIS 30 Cb 0.00 0.12 -0.03 0.00 1.55 0.00 0.00 27.41 29.05 1h2t h HIS 30 CO 0.00 -0.06 0.30 -0.07 -1.30 0.00 0.00 177.93 176.81 1h2t h LEU 31 N -0.66 0.75 -0.74 0.26 4.07 -2.02 -1.69 115.31 115.29 1h2t h LEU 31 Ca -0.04 -0.07 -0.08 0.00 0.08 0.00 0.00 57.88 57.77 1h2t h LEU 31 Cb 0.46 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.99 1h2t h LEU 31 CO 0.06 0.63 0.04 -0.08 -1.08 0.00 0.00 178.44 178.01 1h2t h GLU 32 N 0.84 1.00 -0.52 1.13 4.81 -1.96 -2.09 114.58 117.79 1h2t h GLU 32 Ca 0.21 -0.28 -0.11 0.00 -0.13 0.00 0.00 59.36 59.05 1h2t h GLU 32 Cb 0.06 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 1h2t h GLU 32 CO -0.03 0.96 -0.09 1.03 -0.73 0.00 0.00 179.01 180.14 1h2t h SER 33 N 0.92 0.98 0.18 1.04 0.87 -0.78 -1.84 113.55 114.92 1h2t h SER 33 Ca 0.17 -0.35 -0.01 0.00 -1.23 0.00 0.00 61.79 60.38 1h2t h SER 33 Cb 0.49 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 1h2t h SER 33 CO 0.02 1.10 -0.09 -0.07 -0.53 0.00 0.00 176.83 177.26 1h2t h LEU 34 N 0.84 -0.21 -0.80 2.23 3.38 -1.08 -0.84 115.31 118.83 1h2t h LEU 34 Ca 0.13 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1h2t h LEU 34 Cb 0.65 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 1h2t h LEU 34 CO 0.05 -0.09 0.48 0.40 0.09 0.00 0.00 178.44 179.36 1h2t h ILE 35 N -0.30 1.22 0.00 1.22 2.04 -1.38 -2.41 117.51 117.90 1h2t h ILE 35 Ca -0.02 -0.49 -0.07 0.00 1.00 0.00 0.00 64.86 65.27 1h2t h ILE 35 Cb 0.24 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 1h2t h ILE 35 CO 0.04 0.23 -0.33 0.00 0.00 0.00 0.00 178.15 178.10 1h2t h LYS 37 N 0.00 0.00 -6.44 0.00 1.57 -0.88 -3.47 116.57 107.36 1h2t h LYS 37 Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.20 1h2t h LYS 37 Cb 0.89 0.00 0.04 0.00 0.08 0.00 0.00 32.23 33.24 1h2t h LYS 37 CO 0.04 0.18 0.99 1.55 -0.57 0.00 0.00 179.45 181.64 1h2t n VAL 38 N -2.84 0.30 0.00 0.50 3.14 -0.93 -1.44 118.33 117.06 1h2t n VAL 38 Ca -0.04 -0.05 0.00 0.00 -2.96 0.00 0.00 64.34 61.29 1h2t n VAL 38 Cb 0.70 -1.83 0.00 0.00 -1.06 0.00 0.00 33.84 31.65 1h2t n VAL 38 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1h2t n GLY 39 N 3.98 0.59 0.00 7.55 0.00 -1.26 -5.05 105.19 111.01 1h2t n GLY 39 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1h2t n GLY 39 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1h2t n GLU 40 N -1.27 1.25 -1.67 1.61 1.02 -0.52 -4.98 120.64 116.09 1h2t n GLU 40 Ca 0.00 0.00 -0.57 0.00 -0.02 0.00 0.00 57.16 56.57 1h2t n GLU 40 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.35 1h2t n GLU 40 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1h2t n LYS 41 N -0.63 1.12 -3.67 3.49 2.85 -1.26 -4.95 118.16 115.11 1h2t n LYS 41 Ca 0.00 0.40 -0.14 0.00 -1.05 0.00 0.00 58.31 57.52 1h2t n LYS 41 Cb 0.00 -2.13 -0.08 0.00 -0.65 0.00 0.00 35.03 32.17 1h2t n LYS 41 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1h2t s SER 42 N 4.05 -0.51 0.35 -5.58 0.15 -1.26 -5.00 113.70 105.89 1h2t s SER 42 Ca 1.00 0.85 0.27 0.00 0.70 0.00 0.00 55.95 58.77 1h2t s SER 42 Cb -1.06 0.87 1.05 0.00 -1.71 0.00 0.00 66.02 65.16 1h2t s SER 42 CO 0.64 -0.30 1.79 0.00 1.20 0.00 0.00 173.24 176.58 1h2t h ALA 43 N 4.67 1.00 -1.81 5.45 0.00 -2.06 -3.44 119.26 123.08 1h2t h ALA 43 Ca -0.28 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.16 1h2t h ALA 43 Cb 1.17 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1h2t h ALA 43 CO 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 179.25 179.10 1h2t s SER 45 N -4.09 3.98 0.04 0.00 1.04 -1.26 -4.87 113.70 108.54 1h2t s SER 45 Ca 0.43 1.22 -0.23 0.00 0.48 0.00 0.00 55.95 57.85 1h2t s SER 45 Cb -0.08 -1.90 -0.16 0.00 0.10 0.00 0.00 66.02 63.99 1h2t s SER 45 CO 0.29 -2.28 1.49 0.25 0.98 0.00 0.00 173.24 173.97 1h2t h LEU 46 N -1.31 0.10 -1.13 2.42 5.85 -1.96 -1.36 115.31 117.91 1h2t h LEU 46 Ca -0.49 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.02 1h2t h LEU 46 Cb 1.29 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.24 1h2t h LEU 46 CO 0.59 0.35 0.59 -0.33 -0.34 0.00 0.00 178.44 179.30 1h2t h GLU 47 N -0.16 1.03 0.28 1.25 3.07 -1.93 0.32 114.58 118.44 1h2t h GLU 47 Ca 0.02 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.80 1h2t h GLU 47 Cb 0.29 -0.23 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1h2t h GLU 47 CO 0.00 0.68 -0.13 1.03 -1.40 0.00 0.00 179.01 179.19 1h2t h SER 48 N 1.06 -0.32 -0.74 1.42 0.87 -1.89 -1.13 113.55 112.83 1h2t h SER 48 Ca 0.38 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.87 1h2t h SER 48 Cb 0.15 0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.16 1h2t h SER 48 CO -0.14 -0.13 0.42 0.78 -0.53 0.00 0.00 176.83 177.23 1h2t h ASN 49 N -0.49 0.92 0.30 6.23 -0.26 -0.54 0.21 115.58 121.95 1h2t h ASN 49 Ca -0.04 -0.07 -0.01 0.00 -0.56 0.00 0.00 56.30 55.62 1h2t h ASN 49 Cb 0.36 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.39 1h2t h ASN 49 CO 0.06 0.73 -0.14 -0.07 -1.06 0.00 0.00 177.43 176.95 1h2t h LEU 50 N 1.04 -0.34 -1.26 1.61 3.38 -0.18 0.79 115.31 120.36 1h2t h LEU 50 Ca 0.27 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 1h2t h LEU 50 Cb 0.01 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1h2t h LEU 50 CO -0.04 -0.19 0.13 -0.08 0.09 0.00 0.00 178.44 178.35 1h2t h GLU 51 N -0.46 0.64 -0.23 1.13 4.57 -1.02 0.50 114.58 119.71 1h2t h GLU 51 Ca -0.04 -0.10 -0.06 0.00 -1.18 0.00 0.00 59.36 57.97 1h2t h GLU 51 Cb 0.35 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 1h2t h GLU 51 CO 0.07 0.57 -0.14 0.78 -1.18 0.00 0.00 179.01 179.10 1h2t h GLY 52 N 0.83 0.41 1.40 1.92 0.00 -0.55 -2.34 103.07 104.75 1h2t h GLY 52 Ca 0.15 -0.28 -0.31 0.00 0.00 0.00 0.00 47.33 46.89 1h2t h GLY 52 CO -0.01 0.26 -1.40 -2.00 0.00 0.00 0.00 176.54 173.39 1h2t h LEU 53 N 0.36 0.68 -1.00 3.11 5.85 0.02 -3.04 115.31 121.29 1h2t h LEU 53 Ca 0.07 -0.73 0.07 0.00 0.84 0.00 0.00 57.88 58.12 1h2t h LEU 53 Cb 0.47 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.21 1h2t h LEU 53 CO 0.03 1.57 0.64 0.00 -0.34 0.00 0.00 178.44 180.34 1h2t h ALA 54 N 0.33 1.38 -0.15 1.25 0.00 -0.78 -0.48 119.26 120.81 1h2t h ALA 54 Ca -0.21 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1h2t h ALA 54 Cb 2.09 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.58 1h2t h ALA 54 CO 0.25 0.43 0.06 0.78 0.00 0.00 0.00 179.25 180.77 1h2t h GLY 55 N 1.17 0.24 1.05 0.00 0.00 -1.46 -1.29 103.07 102.78 1h2t h GLY 55 Ca 0.43 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.62 1h2t h GLY 55 CO -0.17 0.13 0.53 -2.08 0.00 0.00 0.00 176.54 174.94 1h2t h VAL 56 N 0.09 1.26 -0.33 4.60 2.07 -1.28 -2.32 116.25 120.33 1h2t h VAL 56 Ca 0.05 -0.59 -0.16 0.00 0.82 0.00 0.00 66.70 66.82 1h2t h VAL 56 Cb 0.18 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 29.93 1h2t h VAL 56 CO -0.00 0.28 -0.40 -0.07 0.02 0.00 0.00 177.57 177.39 1h2t h LEU 57 N 1.27 0.93 -0.74 2.57 3.38 -1.00 -2.78 115.31 118.93 1h2t h LEU 57 Ca 0.33 -0.49 0.04 0.00 0.09 0.00 0.00 57.88 57.85 1h2t h LEU 57 Cb -0.02 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 1h2t h LEU 57 CO -0.06 1.23 0.45 -0.08 0.09 0.00 0.00 178.44 180.08 1h2t h GLU 58 N 0.65 0.84 -0.07 1.13 4.81 -0.96 -1.40 114.58 119.57 1h2t h GLU 58 Ca 0.04 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1h2t h GLU 58 Cb 1.00 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 1h2t h GLU 58 CO 0.10 0.55 -0.15 0.00 -0.73 0.00 0.00 179.01 178.78 1h2t h ALA 59 N 1.34 1.61 -0.19 2.92 0.00 -1.35 -2.45 119.26 121.14 1h2t h ALA 59 Ca 0.31 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1h2t h ALA 59 Cb 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1h2t h ALA 59 CO -0.14 0.29 0.00 -0.25 0.00 0.00 0.00 179.25 179.15 1h2t n ASP 60 N -4.30 2.34 -0.34 0.00 8.00 -0.62 -4.35 116.55 117.28 1h2t n ASP 60 Ca -0.02 -1.80 -0.03 0.00 0.71 0.00 0.00 54.79 53.65 1h2t n ASP 60 Cb 0.25 -0.12 0.09 0.00 -0.02 0.00 0.00 41.12 41.33 1h2t n ASP 60 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1h2t h LEU 61 N 3.23 1.13 -1.09 0.64 3.38 -0.80 0.28 115.31 122.07 1h2t h LEU 61 Ca 0.00 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1h2t h LEU 61 Cb 0.70 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1h2t h LEU 61 CO 0.00 0.89 0.28 1.55 0.09 0.00 0.00 178.44 181.25 1h2t h PRO 62 N 1.29 0.92 0.00 1.13 0.13 -1.78 -1.91 132.00 131.77 1h2t h PRO 62 Ca 0.33 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1h2t h PRO 62 Cb -0.01 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 30.95 1h2t h PRO 62 CO -0.06 0.73 -1.53 0.09 -0.23 0.00 0.00 178.00 177.01 1h2t n ASN 63 N -4.33 0.53 -2.25 1.44 3.02 -1.12 -4.67 115.26 107.88 1h2t n ASN 63 Ca 0.06 -0.43 0.01 0.00 -0.03 0.00 0.00 54.58 54.19 1h2t n ASN 63 Cb 0.15 1.54 0.04 0.00 -0.61 0.00 0.00 39.78 40.90 1h2t n ASN 63 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1h2t n TYR 64 N -1.90 0.56 -0.26 3.10 4.01 0.97 -4.91 117.16 118.73 1h2t n TYR 64 Ca -0.00 -1.42 -0.05 0.00 -0.16 0.00 0.00 57.90 56.26 1h2t n TYR 64 Cb 0.45 -0.08 0.06 0.00 -0.31 0.00 0.00 39.34 39.46 1h2t n TYR 64 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1h2t h LYS 65 N 1.81 0.96 -0.40 -0.72 3.64 -1.44 -0.53 116.57 119.89 1h2t h LYS 65 Ca -0.21 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1h2t h LYS 65 Cb 1.52 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 33.11 1h2t h LYS 65 CO 0.11 0.64 0.26 1.03 -2.27 0.00 0.00 179.45 179.22 1h2t h SER 66 N 0.98 0.46 -0.12 4.20 0.87 -1.91 0.68 113.55 118.71 1h2t h SER 66 Ca 0.26 -0.01 -0.11 0.00 -1.23 0.00 0.00 61.79 60.70 1h2t h SER 66 Cb -0.10 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 1h2t h SER 66 CO -0.06 0.33 -0.26 0.50 -0.53 0.00 0.00 176.83 176.82 1h2t h LYS 67 N 0.54 0.57 -0.38 2.24 3.64 -1.88 -2.21 116.57 119.10 1h2t h LYS 67 Ca 0.14 -0.23 -0.15 0.00 -1.27 0.00 0.00 60.65 59.14 1h2t h LYS 67 Cb -0.06 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1h2t h LYS 67 CO -0.03 0.78 -0.37 0.82 -2.27 0.00 0.00 179.45 178.39 1h2t h ILE 68 N 0.50 1.27 -0.55 2.00 2.04 -0.62 -1.51 117.51 120.65 1h2t h ILE 68 Ca 0.07 -1.54 -0.06 0.00 1.00 0.00 0.00 64.86 64.34 1h2t h ILE 68 Cb 0.72 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 1h2t h ILE 68 CO 0.05 0.51 0.13 -0.07 0.00 0.00 0.00 178.15 178.77 1h2t h LEU 69 N 0.74 0.84 -0.10 1.44 3.38 -0.75 -1.52 115.31 119.33 1h2t h LEU 69 Ca 0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 1h2t h LEU 69 Cb 0.94 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 1h2t h LEU 69 CO 0.09 0.86 0.02 -0.09 0.09 0.00 0.00 178.44 179.41 1h2t h ARG 70 N 0.78 0.17 -0.83 1.13 2.43 -1.33 -1.78 114.38 114.95 1h2t h ARG 70 Ca 0.17 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 1h2t h ARG 70 Cb 0.35 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.84 1h2t h ARG 70 CO 0.00 0.36 0.54 -0.07 -1.51 0.00 0.00 179.97 179.29 1h2t h LEU 71 N -0.05 0.93 -0.50 3.80 3.38 -1.19 -0.27 115.31 121.41 1h2t h LEU 71 Ca 0.03 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1h2t h LEU 71 Cb 0.27 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1h2t h LEU 71 CO 0.00 0.66 -0.05 -0.07 0.09 0.00 0.00 178.44 179.07 1h2t h LEU 72 N 1.09 0.91 -1.29 1.67 3.38 -1.20 -1.48 115.31 118.40 1h2t h LEU 72 Ca 0.32 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1h2t h LEU 72 Cb -0.07 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.42 1h2t h LEU 72 CO -0.09 1.02 -0.10 0.00 0.09 0.00 0.00 178.44 179.37 1h2t h THR 74 N 0.34 1.33 0.00 0.00 2.02 -0.65 -2.43 112.91 113.52 1h2t h THR 74 Ca 0.07 -1.03 -0.04 0.00 0.77 0.00 0.00 66.41 66.18 1h2t h THR 74 Cb 0.39 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 1h2t h THR 74 CO 0.02 0.28 -0.21 -0.37 0.37 0.00 0.00 175.52 175.61 1h2t h VAL 75 N -0.31 0.90 -0.33 3.16 -1.51 -1.18 0.14 116.25 117.11 1h2t h VAL 75 Ca 0.01 -0.79 -0.07 0.00 -1.23 0.00 0.00 66.70 64.62 1h2t h VAL 75 Cb 0.46 1.46 -0.02 0.00 -2.13 0.00 0.00 31.29 31.06 1h2t h VAL 75 CO 0.01 0.21 -0.10 0.00 -1.23 0.00 0.00 177.57 176.46 1h2t h ALA 76 N 1.79 1.21 0.06 5.19 0.00 -1.28 0.14 119.26 126.38 1h2t h ALA 76 Ca -0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 54.91 54.34 1h2t h ALA 76 Cb 0.44 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1h2t h ALA 76 CO 0.03 0.51 -1.65 -0.09 0.00 0.00 0.00 179.25 178.05 1h2t h ARG 77 N 0.52 0.13 0.00 0.00 2.43 -0.83 -3.40 114.38 113.24 1h2t h ARG 77 Ca 0.10 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1h2t h ARG 77 Cb 0.48 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 1h2t h ARG 77 CO 0.03 0.87 -0.95 1.28 -1.51 0.00 0.00 179.97 179.69 1h2t n LEU 78 N -3.29 0.47 -2.76 3.80 4.77 0.40 -4.65 117.00 115.74 1h2t n LEU 78 Ca -0.18 -0.36 -0.26 0.00 -0.03 0.00 0.00 56.01 55.18 1h2t n LEU 78 Cb 1.04 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.11 1h2t n LEU 78 CO 0.46 0.12 0.13 0.18 -1.33 0.00 0.00 177.39 176.95 1h2t n LEU 79 N -1.52 4.24 0.22 2.23 4.32 0.03 -4.89 117.00 121.63 1h2t n LEU 79 Ca 0.01 -5.38 0.13 0.00 -0.02 0.00 0.00 56.01 50.75 1h2t n LEU 79 Cb 0.26 -0.40 0.74 0.00 -1.62 0.00 0.00 43.42 42.40 1h2t n LEU 79 CO 0.29 2.27 1.11 1.55 -1.22 0.00 0.00 177.39 181.40 1h2t h PRO 80 N 2.82 0.00 0.00 3.23 0.13 -1.80 -0.96 132.00 135.43 1h2t h PRO 80 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1h2t h PRO 80 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1h2t h PRO 80 CO 0.80 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.72 1h2t n GLU 81 N -4.25 0.05 -0.13 0.86 0.00 -1.26 -1.44 120.64 114.46 1h2t n GLU 81 Ca -0.00 0.46 0.10 0.00 0.00 0.00 0.00 57.16 57.71 1h2t n GLU 81 Cb 0.21 -1.64 0.15 0.00 0.00 0.00 0.00 31.44 30.16 1h2t n GLU 81 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1h2t n LYS 82 N -1.75 1.43 -0.38 3.44 5.02 -0.37 -4.88 118.16 120.68 1h2t n LYS 82 Ca 0.01 -2.65 -0.02 0.00 -2.02 0.00 0.00 58.31 53.64 1h2t n LYS 82 Cb 0.07 -1.54 0.03 0.00 -0.02 0.00 0.00 35.03 33.58 1h2t n LYS 82 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1h2t h LEU 83 N 0.20 -1.47 -1.19 -0.35 5.85 -1.29 -0.83 115.31 116.24 1h2t h LEU 83 Ca 0.00 0.31 -0.06 0.00 0.84 0.00 0.00 57.88 58.97 1h2t h LEU 83 Cb 1.04 0.77 -0.01 0.00 0.37 0.00 0.00 40.66 42.83 1h2t h LEU 83 CO 0.02 -0.29 -0.29 0.71 -0.34 0.00 0.00 178.44 178.26 1h2t h THR 84 N -0.00 0.77 -0.24 1.05 1.35 -1.86 -0.83 112.91 113.14 1h2t h THR 84 Ca 0.34 -1.21 -0.07 0.00 -0.55 0.00 0.00 66.41 64.91 1h2t h THR 84 Cb 0.59 1.76 -0.01 0.00 -1.73 0.00 0.00 68.15 68.76 1h2t h THR 84 CO -0.98 0.28 -0.13 0.40 -0.25 0.00 0.00 175.52 174.84 1h2t h ILE 85 N 0.00 1.30 0.00 6.82 2.04 -1.48 -2.64 117.51 123.55 1h2t h ILE 85 Ca -0.00 -1.21 -0.17 0.00 1.00 0.00 0.00 64.86 64.48 1h2t h ILE 85 Cb 0.74 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.37 1h2t h ILE 85 CO 0.04 0.38 -0.82 1.88 0.00 0.00 0.00 178.15 179.62 1h2t h TYR 86 N 0.22 0.00 -0.28 1.37 0.05 -1.31 -2.72 116.97 114.31 1h2t h TYR 86 Ca 0.05 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.71 1h2t h TYR 86 Cb 0.63 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.36 1h2t h TYR 86 CO 0.06 0.82 -0.32 1.79 -1.05 0.00 0.00 178.16 179.46 1h2t h THR 87 N 0.00 1.28 -0.27 -2.88 1.35 -1.19 -1.55 112.91 109.65 1h2t h THR 87 Ca -0.01 -1.43 -0.03 0.00 -0.55 0.00 0.00 66.41 64.40 1h2t h THR 87 Cb 1.63 1.42 -0.01 0.00 -1.73 0.00 0.00 68.15 69.45 1h2t h THR 87 CO 0.11 0.46 0.05 0.74 -0.25 0.00 0.00 175.52 176.63 1h2t h THR 88 N 0.50 1.22 -0.77 6.82 2.02 -1.45 -0.74 112.91 120.52 1h2t h THR 88 Ca 0.06 -0.74 0.09 0.00 0.77 0.00 0.00 66.41 66.58 1h2t h THR 88 Cb 0.79 1.20 -0.07 0.00 -1.74 0.00 0.00 68.15 68.34 1h2t h THR 88 CO 0.06 0.24 0.42 0.25 0.37 0.00 0.00 175.52 176.87 1h2t h LEU 89 N 0.25 0.59 -0.65 2.58 5.85 -1.20 0.02 115.31 122.76 1h2t h LEU 89 Ca 0.08 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 1h2t h LEU 89 Cb 0.31 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 1h2t h LEU 89 CO 0.00 0.35 0.12 0.58 -0.34 0.00 0.00 178.44 179.14 1h2t h VAL 90 N 0.72 1.26 -0.58 1.05 2.07 -1.05 -1.85 116.25 117.87 1h2t h VAL 90 Ca 0.37 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.89 1h2t h VAL 90 Cb 0.33 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 1h2t h VAL 90 CO -0.24 0.38 0.38 1.23 0.02 0.00 0.00 177.57 179.33 1h2t h GLY 91 N 0.98 0.81 1.25 2.17 0.00 0.43 0.20 103.07 108.90 1h2t h GLY 91 Ca 0.20 -0.30 -0.08 0.00 0.00 0.00 0.00 47.33 47.15 1h2t h GLY 91 CO 0.01 0.28 0.02 1.41 0.00 0.00 0.00 176.54 178.27 1h2t h LEU 92 N 0.77 0.88 -0.46 3.11 3.38 -0.86 -1.23 115.31 120.89 1h2t h LEU 92 Ca 0.22 -0.22 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1h2t h LEU 92 Cb -0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.44 1h2t h LEU 92 CO -0.06 0.93 -0.53 -0.07 0.09 0.00 0.00 178.44 178.80 1h2t h LEU 93 N 0.85 0.74 -1.20 1.67 4.07 -0.99 -2.67 115.31 117.78 1h2t h LEU 93 Ca 0.16 -0.39 -0.06 0.00 0.08 0.00 0.00 57.88 57.68 1h2t h LEU 93 Cb 0.47 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.98 1h2t h LEU 93 CO 0.02 1.12 -0.12 -1.13 -1.08 0.00 0.00 178.44 177.26 1h2t h ASN 94 N 0.52 0.40 -0.44 -0.43 -1.24 -0.34 0.36 115.58 114.41 1h2t h ASN 94 Ca 0.02 -0.09 -0.14 0.00 0.71 0.00 0.00 56.30 56.79 1h2t h ASN 94 Cb 1.09 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 40.03 1h2t h ASN 94 CO 0.11 0.55 -0.26 0.00 -1.29 0.00 0.00 177.43 176.53 1h2t h ALA 95 N 1.50 0.63 0.00 1.57 0.00 -1.10 -2.54 119.26 119.31 1h2t h ALA 95 Ca 0.08 -0.41 -0.19 0.00 0.00 0.00 0.00 54.91 54.39 1h2t h ALA 95 Cb 0.44 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1h2t h ALA 95 CO 0.02 0.64 -0.91 0.00 0.00 0.00 0.00 179.25 179.01 1h2t h ARG 96 N 0.79 0.00 -2.20 0.00 3.08 -1.11 -3.42 114.38 111.52 1h2t h ARG 96 Ca 0.09 0.00 -0.43 0.00 0.07 0.00 0.00 59.98 59.71 1h2t h ARG 96 Cb 0.84 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 30.55 1h2t h ARG 96 CO 0.07 0.91 -0.73 1.21 -1.07 0.00 0.00 179.97 180.37 1h2t s ASN 97 N -6.73 1.87 0.41 7.04 3.84 0.12 -5.00 114.94 116.49 1h2t s ASN 97 Ca 0.01 -1.59 0.13 0.00 0.21 0.00 0.00 52.86 51.61 1h2t s ASN 97 Cb 0.11 0.24 0.97 0.00 -0.55 0.00 0.00 41.25 42.02 1h2t s ASN 97 CO 0.81 -0.31 1.94 0.22 -2.79 0.00 0.00 177.10 176.97 1h2t h TYR 98 N 7.33 0.55 0.10 0.43 3.20 -1.70 -2.17 116.97 124.71 1h2t h TYR 98 Ca 0.01 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 1h2t h TYR 98 Cb 1.03 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.13 1h2t h TYR 98 CO 0.34 0.24 -0.05 -0.91 -1.64 0.00 0.00 178.16 176.15 1h2t h ASN 99 N 0.50 -0.11 -0.93 -2.11 -0.26 -1.95 -2.21 115.58 108.52 1h2t h ASN 99 Ca 0.34 -0.23 0.09 0.00 -0.56 0.00 0.00 56.30 55.93 1h2t h ASN 99 Cb 0.63 0.03 -0.07 0.00 -1.06 0.00 0.00 38.32 37.85 1h2t h ASN 99 CO -0.11 0.17 0.60 0.15 -1.06 0.00 0.00 177.43 177.18 1h2t h PHE 100 N -0.40 1.04 -0.86 1.19 3.57 -1.77 -1.08 116.94 118.63 1h2t h PHE 100 Ca -0.01 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1h2t h PHE 100 Cb 0.33 -0.34 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 1h2t h PHE 100 CO 0.01 0.49 0.51 0.78 -2.23 0.00 0.00 178.31 177.88 1h2t h GLY 101 N 0.98 1.24 1.57 2.40 0.00 -1.19 -0.36 103.07 107.72 1h2t h GLY 101 Ca 0.42 -0.52 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 1h2t h GLY 101 CO -0.18 0.50 -0.51 -1.33 0.00 0.00 0.00 176.54 175.02 1h2t h GLY 102 N 1.20 0.49 0.96 4.60 0.00 -0.60 -2.27 103.07 107.45 1h2t h GLY 102 Ca 0.31 -0.55 -0.11 0.00 0.00 0.00 0.00 47.33 46.98 1h2t h GLY 102 CO -0.06 0.50 -0.23 0.83 0.00 0.00 0.00 176.54 177.58 1h2t h GLU 103 N 0.35 0.70 -0.21 4.80 5.08 -0.86 -1.97 114.58 122.47 1h2t h GLU 103 Ca 0.01 -0.34 0.03 0.00 -1.00 0.00 0.00 59.36 58.06 1h2t h GLU 103 Cb 1.02 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 1h2t h GLU 103 CO 0.09 0.95 0.04 0.35 -1.00 0.00 0.00 179.01 179.44 1h2t h PHE 104 N 0.46 0.06 -0.58 4.33 3.57 -0.99 -0.06 116.94 123.72 1h2t h PHE 104 Ca 0.06 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1h2t h PHE 104 Cb 0.78 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.50 1h2t h PHE 104 CO 0.07 0.02 0.33 0.28 -2.23 0.00 0.00 178.31 176.77 1h2t h VAL 105 N 0.12 1.19 -0.52 1.41 2.07 -1.39 -0.79 116.25 118.33 1h2t h VAL 105 Ca 0.09 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1h2t h VAL 105 Cb 0.09 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 1h2t h VAL 105 CO -0.13 0.20 0.33 -0.08 0.02 0.00 0.00 177.57 177.91 1h2t h GLU 106 N 0.79 0.69 -0.69 1.57 4.81 -1.05 -1.91 114.58 118.78 1h2t h GLU 106 Ca 0.21 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.39 1h2t h GLU 106 Cb 0.03 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 1h2t h GLU 106 CO -0.03 0.48 0.46 0.00 -0.73 0.00 0.00 179.01 179.18 1h2t h ALA 107 N 1.17 1.50 -0.27 2.92 0.00 -0.51 -2.18 119.26 121.89 1h2t h ALA 107 Ca 0.19 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1h2t h ALA 107 Cb -0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1h2t h ALA 107 CO -0.04 0.46 0.03 0.52 0.00 0.00 0.00 179.25 180.22 1h2t h MET 108 N 0.94 0.46 -0.61 0.00 2.86 -0.48 -1.39 114.93 116.71 1h2t h MET 108 Ca 0.25 -0.13 0.01 0.00 -2.06 0.00 0.00 59.70 57.77 1h2t h MET 108 Cb -0.11 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.48 1h2t h MET 108 CO -0.05 0.59 0.40 0.82 1.06 0.00 0.00 176.91 179.73 1h2t h ILE 109 N 0.26 1.16 -0.49 -1.22 1.08 -1.09 -0.95 117.51 116.25 1h2t h ILE 109 Ca 0.08 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 1h2t h ILE 109 Cb 0.37 0.27 -0.02 0.00 -3.07 0.00 0.00 36.82 34.36 1h2t h ILE 109 CO 0.01 0.15 0.31 0.03 -0.69 0.00 0.00 178.15 177.96 1h2t h ARG 110 N 0.82 0.66 -0.47 2.37 3.08 -1.23 -2.14 114.38 117.47 1h2t h ARG 110 Ca 0.22 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 1h2t h ARG 110 Cb -0.09 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.79 1h2t h ARG 110 CO -0.05 0.46 0.18 0.37 -1.07 0.00 0.00 179.97 179.86 1h2t h GLN 111 N 0.66 0.67 -0.15 0.04 5.75 -0.85 -2.26 115.11 118.95 1h2t h GLN 111 Ca 0.18 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.58 1h2t h GLN 111 Cb -0.04 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.38 1h2t h GLN 111 CO -0.04 0.55 0.07 1.25 -2.65 0.00 0.00 178.83 178.02 1h2t h LEU 112 N 0.66 0.20 -0.66 -2.39 5.85 -0.56 0.76 115.31 119.17 1h2t h LEU 112 Ca 0.16 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1h2t h LEU 112 Cb 0.14 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1h2t h LEU 112 CO -0.02 0.28 0.37 0.11 -0.34 0.00 0.00 178.44 178.84 1h2t h LYS 113 N 0.12 0.91 -0.39 1.25 1.57 -1.23 -0.89 116.57 117.91 1h2t h LYS 113 Ca 0.05 -0.10 -0.06 0.00 -1.87 0.00 0.00 60.65 58.67 1h2t h LYS 113 Cb 0.13 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1h2t h LYS 113 CO -0.01 0.68 -0.00 0.93 -0.57 0.00 0.00 179.45 180.48 1h2t h GLU 114 N 0.90 0.62 -0.34 3.15 3.07 -1.19 0.73 114.58 121.52 1h2t h GLU 114 Ca 0.23 -0.15 -0.08 0.00 -0.50 0.00 0.00 59.36 58.87 1h2t h GLU 114 Cb 0.02 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.84 1h2t h GLU 114 CO -0.04 0.65 -0.08 0.77 -1.40 0.00 0.00 179.01 178.90 1h2t h SER 115 N 0.59 0.67 -0.42 1.42 0.02 -0.17 -1.50 113.55 114.16 1h2t h SER 115 Ca 0.12 -0.36 -0.05 0.00 -0.84 0.00 0.00 61.79 60.65 1h2t h SER 115 Cb 0.38 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 1h2t h SER 115 CO 0.01 0.88 0.05 -0.07 -1.14 0.00 0.00 176.83 176.56 1h2t h LEU 116 N 0.45 0.68 -1.44 5.07 3.38 -0.98 0.27 115.31 122.75 1h2t h LEU 116 Ca 0.09 -0.27 0.04 0.00 0.09 0.00 0.00 57.88 57.82 1h2t h LEU 116 Cb 0.58 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1h2t h LEU 116 CO 0.03 0.79 0.42 0.50 0.09 0.00 0.00 178.44 180.26 1h2t h LYS 117 N 0.55 0.70 -0.40 1.13 3.64 -0.75 -0.54 116.57 120.91 1h2t h LYS 117 Ca 0.12 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1h2t h LYS 117 Cb 0.41 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1h2t h LYS 117 CO 0.01 0.46 0.00 0.00 -2.27 0.00 0.00 179.45 177.66 1h2t n ALA 118 N -2.46 2.54 -2.04 5.00 0.00 -0.57 -4.90 120.51 118.09 1h2t n ALA 118 Ca 0.08 -0.62 -0.18 0.00 0.00 0.00 0.00 53.44 52.72 1h2t n ALA 118 Cb 0.15 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 1h2t n ALA 118 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1h2t n ASN 119 N 0.45 -5.24 -3.42 0.00 3.02 -0.21 -4.90 115.26 104.97 1h2t n ASN 119 Ca 0.11 0.16 -0.40 0.00 -0.03 0.00 0.00 54.58 54.42 1h2t n ASN 119 Cb 0.34 -4.31 0.01 0.00 -0.61 0.00 0.00 39.78 35.20 1h2t n ASN 119 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1h2t n ASN 120 N -1.26 7.51 0.18 6.41 3.02 0.94 -4.71 115.26 127.36 1h2t n ASN 120 Ca -0.20 -3.53 0.06 0.00 -0.03 0.00 0.00 54.58 50.87 1h2t n ASN 120 Cb 0.64 -1.21 0.54 0.00 -0.61 0.00 0.00 39.78 39.14 1h2t n ASN 120 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1h2t h TYR 121 N 4.07 0.15 -0.47 3.10 0.05 -1.89 -0.66 116.97 121.32 1h2t h TYR 121 Ca 0.58 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.35 1h2t h TYR 121 Cb 0.30 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 1h2t h TYR 121 CO 1.40 0.14 0.25 -0.91 -1.05 0.00 0.00 178.16 177.99 1h2t h ASN 122 N 0.15 0.59 1.03 3.88 -0.26 -1.95 -2.04 115.58 116.98 1h2t h ASN 122 Ca 0.04 -0.10 -0.12 0.00 -0.56 0.00 0.00 56.30 55.56 1h2t h ASN 122 Cb 0.08 -0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 37.17 1h2t h ASN 122 CO -0.00 0.52 -0.59 -0.33 -1.06 0.00 0.00 177.43 175.96 1h2t h GLU 123 N 0.61 0.00 -0.89 0.81 5.08 -1.78 -3.17 114.58 115.25 1h2t h GLU 123 Ca 0.16 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.56 1h2t h GLU 123 Cb 0.07 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.27 1h2t h GLU 123 CO -0.03 0.59 0.58 0.00 -1.00 0.00 0.00 179.01 179.16 1h2t h ALA 124 N 1.41 1.44 -0.65 3.43 0.00 -0.56 -2.34 119.26 121.98 1h2t h ALA 124 Ca -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1h2t h ALA 124 Cb 1.27 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1h2t h ALA 124 CO 0.08 0.48 0.37 0.28 0.00 0.00 0.00 179.25 180.46 1h2t h VAL 125 N 1.12 1.20 -0.41 0.00 2.07 -1.36 -1.04 116.25 117.83 1h2t h VAL 125 Ca 0.35 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 1h2t h VAL 125 Cb 0.01 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 1h2t h VAL 125 CO -0.10 0.21 0.15 1.88 0.02 0.00 0.00 177.57 179.73 1h2t h TYR 126 N 0.89 0.58 -0.31 1.57 0.05 -1.54 -0.88 116.97 117.34 1h2t h TYR 126 Ca 0.23 -0.02 -0.09 0.00 0.05 0.00 0.00 58.73 58.90 1h2t h TYR 126 Cb 0.02 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.57 1h2t h TYR 126 CO -0.01 0.47 -0.16 -0.07 -1.05 0.00 0.00 178.16 177.34 1h2t h LEU 127 N 0.58 0.67 -0.98 3.88 3.38 -1.12 -0.59 115.31 121.13 1h2t h LEU 127 Ca 0.14 -0.41 0.01 0.00 0.09 0.00 0.00 57.88 57.71 1h2t h LEU 127 Cb 0.15 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 1h2t h LEU 127 CO -0.01 0.93 0.65 0.58 0.09 0.00 0.00 178.44 180.68 1h2t h VAL 128 N 0.40 1.24 -0.20 1.22 2.07 -0.63 -0.87 116.25 119.48 1h2t h VAL 128 Ca 0.07 -0.45 -0.11 0.00 0.82 0.00 0.00 66.70 67.02 1h2t h VAL 128 Cb 0.69 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1h2t h VAL 128 CO 0.05 0.24 -0.36 0.03 0.02 0.00 0.00 177.57 177.55 1h2t h ARG 129 N 1.32 0.42 -0.54 1.57 3.08 -1.01 -1.71 114.38 117.52 1h2t h ARG 129 Ca 0.36 -0.19 -0.11 0.00 0.07 0.00 0.00 59.98 60.11 1h2t h ARG 129 Cb -0.14 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 1h2t h ARG 129 CO -0.08 0.73 -0.10 0.35 -1.07 0.00 0.00 179.97 179.79 1h2t h PHE 130 N 0.36 1.12 -0.43 3.04 3.04 -0.31 -1.60 116.94 122.16 1h2t h PHE 130 Ca 0.04 -0.23 -0.11 0.00 3.98 0.00 0.00 57.97 61.65 1h2t h PHE 130 Cb 0.80 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 39.01 1h2t h PHE 130 CO 0.02 1.04 -0.18 -0.07 -2.02 0.00 0.00 178.31 177.10 1h2t h LEU 131 N 0.90 0.85 0.16 0.59 3.38 -1.01 -2.48 115.31 117.70 1h2t h LEU 131 Ca 0.14 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1h2t h LEU 131 Cb 0.66 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1h2t h LEU 131 CO 0.05 1.02 -0.08 0.28 0.09 0.00 0.00 178.44 179.79 1h2t h SER 132 N 0.74 -0.19 0.33 -0.43 0.02 -1.09 -2.80 113.55 110.14 1h2t h SER 132 Ca 0.11 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1h2t h SER 132 Cb 0.70 0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.29 1h2t h SER 132 CO 0.05 0.01 -0.09 -0.78 -1.14 0.00 0.00 176.83 174.88 1h2t h ASP 133 N -0.38 0.00 0.11 3.07 3.58 -1.30 -1.43 116.42 120.08 1h2t h ASP 133 Ca -0.02 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.42 1h2t h ASP 133 Cb 0.29 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.34 1h2t h ASP 133 CO 0.04 0.09 -0.04 -0.07 -2.88 0.00 0.00 179.24 176.38 1h2t h LEU 134 N 0.00 0.00 -0.41 2.28 3.38 -1.16 -0.87 115.31 118.53 1h2t h LEU 134 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1h2t h LEU 134 Cb 0.28 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1h2t h LEU 134 CO 0.01 0.04 0.18 0.58 0.09 0.00 0.00 178.44 179.34 1h2t h VAL 135 N 0.00 1.19 0.00 1.22 2.07 -1.28 -1.26 116.25 118.19 1h2t h VAL 135 Ca -0.00 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 1h2t h VAL 135 Cb 0.10 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1h2t h VAL 135 CO 0.00 0.20 -0.05 0.78 0.02 0.00 0.00 177.57 178.52 1h2t h ASN 136 N 0.52 0.00 -0.25 0.57 2.35 -1.29 -0.04 115.58 117.44 1h2t h ASN 136 Ca 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1h2t h ASN 136 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1h2t h ASN 136 CO -0.01 0.05 0.00 0.00 -1.65 0.00 0.00 177.43 175.82 1h2t n HIS 138 N 0.43 -2.49 -0.07 0.00 8.25 -0.03 -4.71 115.22 116.59 1h2t n HIS 138 Ca 0.14 0.95 -0.09 0.00 -0.26 0.00 0.00 57.72 58.46 1h2t n HIS 138 Cb 0.32 -4.53 -0.08 0.00 1.12 0.00 0.00 29.99 26.81 1h2t n HIS 138 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1h2t n VAL 139 N -4.74 0.91 -5.26 1.59 0.31 -0.56 -4.12 118.33 106.46 1h2t n VAL 139 Ca -0.03 -0.43 -0.31 0.00 -0.01 0.00 0.00 64.34 63.57 1h2t n VAL 139 Cb 0.57 -0.92 -0.16 0.00 -0.91 0.00 0.00 33.84 32.41 1h2t n VAL 139 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1h2t s ILE 140 N -2.32 2.01 0.13 2.52 1.01 -1.20 -0.30 121.20 123.06 1h2t s ILE 140 Ca -0.16 -1.07 -0.31 0.00 0.00 0.00 0.00 60.65 59.11 1h2t s ILE 140 Cb 0.05 -1.68 -0.07 0.00 0.01 0.00 0.00 42.46 40.77 1h2t s ILE 140 CO 0.43 0.56 1.28 0.00 0.00 0.00 0.00 174.94 177.21 1h2t s ALA 141 N -0.42 3.49 0.25 9.38 0.00 -0.05 -4.22 121.76 130.19 1h2t s ALA 141 Ca 0.05 1.00 -0.04 0.00 0.00 0.00 0.00 51.96 52.96 1h2t s ALA 141 Cb -0.11 -3.47 0.47 0.00 0.00 0.00 0.00 23.12 20.01 1h2t s ALA 141 CO 0.01 -0.49 1.69 0.00 0.00 0.00 0.00 175.76 176.96 1h2t h ALA 142 N 6.21 0.99 -0.84 0.00 0.00 -1.91 -0.71 119.26 122.99 1h2t h ALA 142 Ca -0.43 0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.75 1h2t h ALA 142 Cb 1.21 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 19.15 1h2t h ALA 142 CO 0.81 -0.32 0.54 -1.35 0.00 0.00 0.00 179.25 178.93 1h2t h PRO 143 N 0.29 0.75 -0.12 0.00 0.11 -1.96 -1.65 132.00 129.43 1h2t h PRO 143 Ca 0.42 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.50 1h2t h PRO 143 Cb 0.72 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 1h2t h PRO 143 CO -0.50 0.49 0.04 0.77 -0.21 0.00 0.00 178.00 178.60 1h2t h SER 144 N 0.77 0.05 -0.59 -2.05 0.02 -1.47 -0.31 113.55 109.96 1h2t h SER 144 Ca 0.39 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.28 1h2t h SER 144 Cb 0.48 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 1h2t h SER 144 CO -0.16 0.05 0.10 0.24 -1.14 0.00 0.00 176.83 175.92 1h2t h MET 145 N 0.10 1.01 -0.78 3.45 2.86 -1.37 -1.34 114.93 118.86 1h2t h MET 145 Ca 0.05 -0.26 -0.05 0.00 -2.06 0.00 0.00 59.70 57.38 1h2t h MET 145 Cb 0.02 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.52 1h2t h MET 145 CO -0.05 0.93 0.30 0.28 1.06 0.00 0.00 176.91 179.44 1h2t h VAL 146 N 0.95 1.26 -0.49 -2.22 2.07 -1.05 -0.33 116.25 116.45 1h2t h VAL 146 Ca 0.19 -0.83 -0.06 0.00 0.82 0.00 0.00 66.70 66.83 1h2t h VAL 146 Cb 0.42 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1h2t h VAL 146 CO 0.01 0.34 0.09 0.00 0.02 0.00 0.00 177.57 178.02 1h2t h ALA 147 N 1.19 0.65 -0.20 1.67 0.00 -0.66 -2.11 119.26 119.79 1h2t h ALA 147 Ca 0.26 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1h2t h ALA 147 Cb 0.23 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1h2t h ALA 147 CO -0.02 0.37 0.05 1.98 0.00 0.00 0.00 179.25 181.63 1h2t h MET 148 N 0.68 0.33 -0.48 0.00 -1.53 -0.90 -2.78 114.93 110.24 1h2t h MET 148 Ca 0.15 -0.08 0.05 0.00 -3.44 0.00 0.00 59.70 56.38 1h2t h MET 148 Cb 0.38 -0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.36 1h2t h MET 148 CO 0.01 0.46 0.32 0.74 0.14 0.00 0.00 176.91 178.57 1h2t h PHE 149 N 0.14 0.45 -0.67 1.39 0.04 -0.96 -0.24 116.94 117.10 1h2t h PHE 149 Ca 0.06 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.85 1h2t h PHE 149 Cb 0.28 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.25 1h2t h PHE 149 CO 0.01 0.25 0.42 0.93 -0.60 0.00 0.00 178.31 179.32 1h2t h GLU 150 N 0.45 0.89 0.00 1.51 5.08 -1.12 -0.46 114.58 120.94 1h2t h GLU 150 Ca 0.20 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1h2t h GLU 150 Cb 0.24 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1h2t h GLU 150 CO -0.05 0.62 -0.28 -0.91 -1.00 0.00 0.00 179.01 177.39 1h2t h ASN 151 N 0.91 0.00 0.14 1.42 2.35 -0.88 -0.67 115.58 118.84 1h2t h ASN 151 Ca 0.24 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.98 1h2t h ASN 151 Cb -0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.31 1h2t h ASN 151 CO -0.05 0.28 -0.07 -0.26 -1.65 0.00 0.00 177.43 175.69 1h2t h PHE 152 N 0.00 -0.17 -0.01 1.19 -1.00 -0.12 -3.12 116.94 113.71 1h2t h PHE 152 Ca -0.00 -0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.74 1h2t h PHE 152 Cb 0.60 0.06 -0.01 0.00 3.61 0.00 0.00 35.95 40.21 1h2t h PHE 152 CO 0.00 0.22 -0.14 0.28 -1.61 0.00 0.00 178.31 177.05 1h2t h VAL 153 N -0.60 1.11 0.00 -0.55 2.07 -0.90 -1.05 116.25 116.32 1h2t h VAL 153 Ca -0.02 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.97 1h2t h VAL 153 Cb 0.46 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1h2t h VAL 153 CO 0.03 0.15 -0.01 0.77 0.02 0.00 0.00 177.57 178.54 1h2t h SER 154 N 0.02 0.00 0.00 0.57 4.64 -1.06 -0.96 113.55 116.76 1h2t h SER 154 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h2t h SER 154 Cb 0.27 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1h2t h SER 154 CO 0.02 0.01 -0.00 0.58 -0.87 0.00 0.00 176.83 176.57 1h2t h VAL 155 N 0.00 0.93 0.00 0.95 2.07 -1.20 0.20 116.25 119.19 1h2t h VAL 155 Ca -0.00 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1h2t h VAL 155 Cb 0.05 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1h2t h VAL 155 CO 0.00 0.00 0.00 0.35 0.02 0.00 0.00 177.57 177.94 1h2t n THR 156 N -4.44 0.97 0.08 2.57 -2.24 -0.37 -2.07 114.28 108.79 1h2t n THR 156 Ca -0.03 0.26 0.03 0.00 -2.27 0.00 0.00 64.05 62.04 1h2t n THR 156 Cb 0.09 -1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 67.18 1h2t n THR 156 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1h2t h GLN 157 N 0.00 0.00 -6.68 -0.78 1.08 -0.75 -3.47 115.11 104.50 1h2t h GLN 157 Ca 0.00 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.62 1h2t h GLN 157 Cb 0.28 0.00 0.12 0.00 -0.05 0.00 0.00 27.48 27.83 1h2t h GLN 157 CO 0.00 0.27 0.29 0.39 -0.95 0.00 0.00 178.83 178.83 1h2t n GLU 158 N -2.93 1.61 -4.00 1.46 1.02 -0.88 -4.98 120.64 111.94 1h2t n GLU 158 Ca -0.05 0.57 -0.28 0.00 -0.02 0.00 0.00 57.16 57.38 1h2t n GLU 158 Cb 0.75 -2.14 -0.05 0.00 -0.02 0.00 0.00 31.44 29.98 1h2t n GLU 158 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1h2t s GLU 159 N -1.99 3.18 -1.37 3.49 2.02 -1.26 -4.58 118.70 118.19 1h2t s GLU 159 Ca 0.61 -0.64 -0.05 0.00 0.02 0.00 0.00 54.97 54.90 1h2t s GLU 159 Cb -0.56 -2.85 0.03 0.00 0.10 0.00 0.00 34.13 30.84 1h2t s GLU 159 CO 0.58 0.55 0.89 -0.25 0.02 0.00 0.00 175.26 177.04 1h2t n ASP 160 N -0.04 -3.02 -4.18 -0.19 8.00 -1.26 -5.01 116.55 110.85 1h2t n ASP 160 Ca -0.07 -0.75 -0.20 0.00 0.71 0.00 0.00 54.79 54.48 1h2t n ASP 160 Cb 0.53 -4.27 -0.12 0.00 -0.02 0.00 0.00 41.12 37.24 1h2t n ASP 160 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1h2t s VAL 161 N -3.48 1.19 0.37 2.53 -7.23 -1.26 -5.12 120.40 107.40 1h2t s VAL 161 Ca 0.27 -1.23 -0.26 0.00 -1.81 0.00 0.00 61.98 58.95 1h2t s VAL 161 Cb -0.13 -1.12 -0.12 0.00 0.56 0.00 0.00 36.38 35.57 1h2t s VAL 161 CO 0.80 -0.12 1.06 -2.65 -0.31 0.00 0.00 175.10 173.88 1h2t n PRO 162 N 1.47 1.50 -0.06 4.82 -0.02 -1.26 -4.88 135.00 136.57 1h2t n PRO 162 Ca -0.20 0.53 0.01 0.00 -2.02 0.00 0.00 63.50 61.82 1h2t n PRO 162 Cb 0.54 -2.04 0.31 0.00 -0.02 0.00 0.00 33.50 32.29 1h2t n PRO 162 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1h2t h GLN 163 N 1.85 0.66 0.00 -0.52 4.15 -1.84 -1.47 115.11 117.94 1h2t h GLN 163 Ca -0.43 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 58.90 1h2t h GLN 163 Cb 1.33 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.90 1h2t h GLN 163 CO 0.59 0.54 0.00 -0.39 -1.93 0.00 0.00 178.83 177.64 1h2t h VAL 164 N 0.65 0.00 0.00 2.39 -1.51 -1.78 0.22 116.25 116.23 1h2t h VAL 164 Ca 0.16 -0.14 -0.00 0.00 -1.23 0.00 0.00 66.70 65.49 1h2t h VAL 164 Cb 0.13 1.05 0.00 0.00 -2.13 0.00 0.00 31.29 30.33 1h2t h VAL 164 CO -0.02 0.00 -0.00 -0.09 -1.23 0.00 0.00 177.57 176.23 1h2t h ARG 165 N 0.00 -0.01 -0.89 5.19 2.43 -1.58 -2.93 114.38 116.59 1h2t h ARG 165 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1h2t h ARG 165 Cb 0.15 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.65 1h2t h ARG 165 CO 0.00 0.86 0.57 0.00 -1.51 0.00 0.00 179.97 179.89 1h2t h ARG 166 N -0.90 1.19 -0.39 0.20 3.08 -1.22 -2.76 114.38 113.58 1h2t h ARG 166 Ca -0.00 -0.09 0.01 0.00 0.07 0.00 0.00 59.98 59.97 1h2t h ARG 166 Cb 0.87 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 1h2t h ARG 166 CO 0.00 0.81 0.25 -0.44 -1.07 0.00 0.00 179.97 179.52 1h2t h ASP 167 N 1.22 0.43 -0.43 7.04 3.32 -0.69 -2.57 116.42 124.75 1h2t h ASP 167 Ca 0.32 -0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.40 1h2t h ASP 167 Cb -0.10 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.31 1h2t h ASP 167 CO -0.07 0.31 0.21 -0.25 -1.72 0.00 0.00 179.24 177.72 1h2t h TRP 168 N 0.52 0.38 -0.45 4.55 7.01 -1.29 0.13 115.95 126.79 1h2t h TRP 168 Ca 0.15 0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.11 1h2t h TRP 168 Cb -0.05 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 26.88 1h2t h TRP 168 CO -0.05 0.19 0.07 1.88 -2.79 0.00 0.00 178.44 177.73 1h2t h TYR 169 N 0.42 0.72 -0.35 2.65 0.05 -1.47 0.13 116.97 119.12 1h2t h TYR 169 Ca 0.18 -0.07 -0.06 0.00 0.05 0.00 0.00 58.73 58.83 1h2t h TYR 169 Cb 0.10 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 37.61 1h2t h TYR 169 CO -0.11 0.64 -0.02 0.28 -1.05 0.00 0.00 178.16 177.91 1h2t h VAL 170 N 0.67 1.26 -0.72 -2.88 2.07 -0.97 -2.53 116.25 113.15 1h2t h VAL 170 Ca 0.15 -1.02 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 1h2t h VAL 170 Cb 0.32 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1h2t h VAL 170 CO 0.00 0.34 0.37 0.22 0.02 0.00 0.00 177.57 178.52 1h2t h TYR 171 N 0.45 1.03 -0.87 1.57 3.20 -0.22 -1.23 116.97 120.89 1h2t h TYR 171 Ca 0.10 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.94 1h2t h TYR 171 Cb 0.49 -0.32 -0.05 0.00 1.54 0.00 0.00 36.73 38.39 1h2t h TYR 171 CO 0.04 0.75 0.57 0.00 -1.64 0.00 0.00 178.16 177.88 1h2t h ALA 172 N 1.18 1.12 0.39 1.82 0.00 -0.65 -0.54 119.26 122.58 1h2t h ALA 172 Ca 0.25 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1h2t h ALA 172 Cb 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1h2t h ALA 172 CO -0.03 0.48 -0.19 0.35 0.00 0.00 0.00 179.25 179.86 1h2t h PHE 173 N 1.16 -0.48 -0.65 0.00 3.57 -1.03 -3.19 116.94 116.32 1h2t h PHE 173 Ca 0.33 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.93 1h2t h PHE 173 Cb -0.10 0.16 -0.08 0.00 2.79 0.00 0.00 35.95 38.72 1h2t h PHE 173 CO -0.01 -0.30 0.21 -0.07 -2.23 0.00 0.00 178.31 175.91 1h2t h LEU 174 N -0.68 0.16 0.00 0.59 3.38 -1.20 -0.98 115.31 116.57 1h2t h LEU 174 Ca -0.05 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1h2t h LEU 174 Cb 0.40 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1h2t h LEU 174 CO 0.09 0.08 0.00 -1.54 0.09 0.00 0.00 178.44 177.16 1h2t n SER 175 N -5.05 0.00 -0.01 -0.43 3.41 -0.22 -1.69 113.62 109.64 1h2t n SER 175 Ca 0.10 0.29 -0.10 0.00 -0.26 0.00 0.00 58.87 58.91 1h2t n SER 175 Cb 0.33 -0.38 -0.14 0.00 -0.26 0.00 0.00 64.21 63.76 1h2t n SER 175 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1h2t h SER 176 N 0.00 0.04 -0.98 4.04 0.02 -1.16 -3.40 113.55 112.12 1h2t h SER 176 Ca 0.00 -0.09 0.22 0.00 -0.84 0.00 0.00 61.79 61.08 1h2t h SER 176 Cb 0.16 -0.01 -0.12 0.00 0.14 0.00 0.00 62.40 62.57 1h2t h SER 176 CO 0.00 1.08 0.56 -0.07 -1.14 0.00 0.00 176.83 177.26 1h2t h LEU 177 N 0.01 0.64 -1.62 5.07 3.38 -1.23 -1.42 115.31 120.14 1h2t h LEU 177 Ca -0.28 0.13 0.20 0.00 0.09 0.00 0.00 57.88 58.02 1h2t h LEU 177 Cb 2.00 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 42.72 1h2t h LEU 177 CO 0.08 0.14 0.58 -0.65 0.09 0.00 0.00 178.44 178.68 1h2t h PRO 178 N 0.60 0.31 0.10 1.13 0.11 -1.77 1.15 132.00 133.64 1h2t h PRO 178 Ca 0.60 -0.02 -0.28 0.00 0.11 0.00 0.00 66.00 66.41 1h2t h PRO 178 Cb 1.08 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 1h2t h PRO 178 CO -0.45 0.21 -1.48 -1.49 -0.21 0.00 0.00 178.00 174.58 1h2t h TRP 179 N 0.32 0.40 -0.01 0.65 6.55 -1.57 -3.42 115.95 118.87 1h2t h TRP 179 Ca 0.44 -0.29 0.00 0.00 0.95 0.00 0.00 58.89 59.98 1h2t h TRP 179 Cb 1.19 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 29.48 1h2t h TRP 179 CO -0.00 1.58 0.00 1.55 -1.05 0.00 0.00 178.44 180.52 1h2t n VAL 180 N -3.91 0.09 -0.09 1.49 3.14 -1.01 -4.78 118.33 113.26 1h2t n VAL 180 Ca -0.27 -0.54 -0.07 0.00 -2.96 0.00 0.00 64.34 60.50 1h2t n VAL 180 Cb 0.90 1.02 -0.00 0.00 -1.06 0.00 0.00 33.84 34.69 1h2t n VAL 180 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1h2t h GLY 181 N 0.65 -0.06 0.31 7.55 0.00 0.12 -1.23 103.07 110.41 1h2t h GLY 181 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.62 1h2t h GLY 181 CO 0.00 -0.20 -0.52 1.70 0.00 0.00 0.00 176.54 177.52 1h2t h LYS 182 N -0.19 -0.85 -0.57 4.80 3.64 -1.80 -1.22 116.57 120.38 1h2t h LYS 182 Ca 0.17 0.06 0.10 0.00 -1.27 0.00 0.00 60.65 59.71 1h2t h LYS 182 Cb 0.46 0.19 -0.08 0.00 -0.41 0.00 0.00 32.23 32.39 1h2t h LYS 182 CO -0.45 -0.56 0.14 1.49 -2.27 0.00 0.00 179.45 177.80 1h2t h GLU 183 N -0.88 0.28 -0.55 1.90 4.57 -1.85 -0.34 114.58 117.71 1h2t h GLU 183 Ca -0.03 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1h2t h GLU 183 Cb 0.82 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.32 1h2t h GLU 183 CO -0.18 0.18 0.26 -0.07 -1.18 0.00 0.00 179.01 178.02 1h2t h LEU 184 N 0.29 0.68 -0.01 1.64 3.38 -0.90 -2.73 115.31 117.66 1h2t h LEU 184 Ca 0.29 -0.06 -0.18 0.00 0.09 0.00 0.00 57.88 58.02 1h2t h LEU 184 Cb 0.40 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 40.99 1h2t h LEU 184 CO -0.35 0.58 -0.69 0.22 0.09 0.00 0.00 178.44 178.29 1h2t h TYR 185 N 0.76 0.72 0.00 1.13 3.20 -0.45 -0.72 116.97 121.61 1h2t h TYR 185 Ca 0.19 -0.38 0.00 0.00 3.14 0.00 0.00 58.73 61.68 1h2t h TYR 185 Cb 0.08 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.26 1h2t h TYR 185 CO 0.01 1.20 0.00 0.39 -1.64 0.00 0.00 178.16 178.12 1h2t n GLU 186 N -4.14 0.04 -0.02 1.82 1.02 -0.21 -0.60 120.64 118.55 1h2t n GLU 186 Ca -0.10 0.31 -0.02 0.00 -0.02 0.00 0.00 57.16 57.33 1h2t n GLU 186 Cb 0.71 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.61 1h2t n GLU 186 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1h2t n LYS 187 N -1.43 2.60 -2.77 3.49 4.76 -1.05 -4.85 118.16 118.92 1h2t n LYS 187 Ca 0.03 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.44 1h2t n LYS 187 Cb 0.08 -1.08 0.05 0.00 -1.84 0.00 0.00 35.03 32.25 1h2t n LYS 187 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1h2t n LYS 188 N -2.24 1.52 -0.24 1.97 4.76 -0.28 -4.92 118.16 118.72 1h2t n LYS 188 Ca -0.05 -3.19 0.29 0.00 -2.87 0.00 0.00 58.31 52.48 1h2t n LYS 188 Cb 0.59 -1.29 0.69 0.00 -1.84 0.00 0.00 35.03 33.18 1h2t n LYS 188 CO 0.00 0.00 0.00 0.38 -1.37 0.00 0.00 177.40 176.41 1h2t h ASP 189 N 2.57 0.09 -0.13 4.39 2.03 -0.95 0.36 116.42 124.78 1h2t h ASP 189 Ca -0.16 0.01 -0.03 0.00 -0.73 0.00 0.00 57.03 56.13 1h2t h ASP 189 Cb 1.25 -0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.74 1h2t h ASP 189 CO 0.23 0.02 -0.03 0.00 -1.03 0.00 0.00 179.24 178.44 1h2t h ALA 190 N 1.52 0.18 -0.48 4.15 0.00 -1.91 -1.18 119.26 121.54 1h2t h ALA 190 Ca 0.49 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 1h2t h ALA 190 Cb 1.80 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.53 1h2t h ALA 190 CO -0.06 -0.08 -0.16 0.93 0.00 0.00 0.00 179.25 179.89 1h2t h GLU 191 N -0.05 0.93 -0.04 0.00 3.07 -0.92 -2.93 114.58 114.63 1h2t h GLU 191 Ca 0.03 -0.35 -0.04 0.00 -0.50 0.00 0.00 59.36 58.50 1h2t h GLU 191 Cb 0.44 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1h2t h GLU 191 CO 0.01 1.01 -0.14 0.52 -1.40 0.00 0.00 179.01 179.01 1h2t h MET 192 N 0.82 0.07 -0.05 2.33 2.86 -0.37 -2.45 114.93 118.13 1h2t h MET 192 Ca 0.12 -0.01 -0.15 0.00 -2.06 0.00 0.00 59.70 57.60 1h2t h MET 192 Cb 0.70 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 1h2t h MET 192 CO 0.05 0.21 -0.64 -0.44 1.06 0.00 0.00 176.91 177.16 1h2t h ASP 193 N 0.06 0.21 -0.41 1.22 3.32 -1.03 -1.70 116.42 118.10 1h2t h ASP 193 Ca 0.01 -0.12 -0.11 0.00 0.02 0.00 0.00 57.03 56.83 1h2t h ASP 193 Cb 0.30 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1h2t h ASP 193 CO 0.02 0.79 -0.17 0.03 -1.72 0.00 0.00 179.24 178.19 1h2t h ARG 194 N 0.13 0.83 -0.48 3.56 3.08 -1.37 -1.72 114.38 118.41 1h2t h ARG 194 Ca -0.01 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.67 1h2t h ARG 194 Cb 1.15 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.15 1h2t h ARG 194 CO 0.09 0.99 0.24 0.82 -1.07 0.00 0.00 179.97 181.04 1h2t h ILE 195 N 0.65 1.18 -0.21 2.04 1.08 -1.37 -2.22 117.51 118.66 1h2t h ILE 195 Ca 0.09 -0.51 -0.04 0.00 -0.39 0.00 0.00 64.86 64.01 1h2t h ILE 195 Cb 0.72 0.64 -0.01 0.00 -3.07 0.00 0.00 36.82 35.09 1h2t h ILE 195 CO 0.05 0.20 -0.06 -0.26 -0.69 0.00 0.00 178.15 177.39 1h2t h PHE 196 N 0.63 0.34 0.08 1.37 0.04 -1.19 0.13 116.94 118.34 1h2t h PHE 196 Ca 0.17 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.90 1h2t h PHE 196 Cb 0.10 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1h2t h PHE 196 CO -0.01 0.40 -0.04 0.00 -0.60 0.00 0.00 178.31 178.06 1h2t h ALA 197 N 1.62 -0.11 -0.74 2.45 0.00 -0.93 0.11 119.26 121.66 1h2t h ALA 197 Ca 0.07 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1h2t h ALA 197 Cb 0.32 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1h2t h ALA 197 CO 0.01 -0.43 0.24 -0.91 0.00 0.00 0.00 179.25 178.16 1h2t h ASN 198 N -0.37 1.07 0.11 0.00 -0.26 -1.13 -1.05 115.58 113.94 1h2t h ASN 198 Ca -0.01 -0.20 -0.01 0.00 -0.56 0.00 0.00 56.30 55.53 1h2t h ASN 198 Cb 0.32 -0.28 0.00 0.00 -1.06 0.00 0.00 38.32 37.30 1h2t h ASN 198 CO 0.02 0.99 -0.05 0.74 -1.06 0.00 0.00 177.43 178.07 1h2t h THR 199 N 1.10 0.94 -0.56 2.81 2.02 -0.65 -1.38 112.91 117.19 1h2t h THR 199 Ca 0.24 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.28 1h2t h THR 199 Cb 0.30 1.03 -0.03 0.00 -1.74 0.00 0.00 68.15 67.71 1h2t h THR 199 CO -0.01 0.04 0.36 -0.08 0.37 0.00 0.00 175.52 176.20 1h2t h GLU 200 N -0.21 0.75 -0.74 6.66 4.81 -0.81 -0.62 114.58 124.42 1h2t h GLU 200 Ca -0.01 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1h2t h GLU 200 Cb 0.17 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.34 1h2t h GLU 200 CO 0.02 0.51 0.46 0.66 -0.73 0.00 0.00 179.01 179.94 1h2t h SER 201 N 0.76 0.76 0.11 1.04 4.64 -1.08 -1.40 113.55 118.38 1h2t h SER 201 Ca 0.20 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 1h2t h SER 201 Cb -0.06 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 61.86 1h2t h SER 201 CO -0.04 0.52 -0.05 0.22 -0.87 0.00 0.00 176.83 176.61 1h2t h TYR 202 N 0.90 -0.13 -0.51 4.77 3.20 -0.61 -2.72 116.97 121.87 1h2t h TYR 202 Ca 0.30 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.27 1h2t h TYR 202 Cb 0.03 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.32 1h2t h TYR 202 CO -0.04 -0.00 0.35 -0.07 -1.64 0.00 0.00 178.16 176.76 1h2t h LEU 203 N -0.24 0.21 -1.22 2.82 3.38 -0.81 -0.62 115.31 118.82 1h2t h LEU 203 Ca -0.01 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1h2t h LEU 203 Cb 0.19 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1h2t h LEU 203 CO 0.02 0.12 -0.34 0.11 0.09 0.00 0.00 178.44 178.44 1h2t h LYS 204 N 0.23 0.00 -0.02 1.13 1.57 -0.95 -3.16 116.57 115.37 1h2t h LYS 204 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1h2t h LYS 204 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1h2t h LYS 204 CO -0.04 0.34 -0.27 2.89 -0.57 0.00 0.00 179.45 181.80 1h2t n ARG 205 N -3.78 1.62 -1.70 3.15 1.85 -0.26 -4.99 116.66 112.56 1h2t n ARG 205 Ca -0.01 -1.31 -0.36 0.00 -1.00 0.00 0.00 57.85 55.16 1h2t n ARG 205 Cb 0.43 -1.47 0.07 0.00 -1.05 0.00 0.00 32.46 30.44 1h2t n ARG 205 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1h2t s ARG 206 N -2.28 2.48 0.31 2.89 0.52 -1.06 -5.00 118.95 116.81 1h2t s ARG 206 Ca 0.23 2.02 -0.14 0.00 -0.52 0.00 0.00 55.73 57.32 1h2t s ARG 206 Cb 0.19 -1.84 -0.09 0.00 0.52 0.00 0.00 34.95 33.73 1h2t s ARG 206 CO 0.46 -1.64 0.71 -0.65 0.02 0.00 0.00 175.30 174.20 1h2t s GLN 207 N -3.46 3.97 -0.09 3.54 -1.52 -1.26 -4.99 119.66 115.85 1h2t s GLN 207 Ca 0.81 0.61 0.14 0.00 -1.95 0.00 0.00 55.36 54.97 1h2t s GLN 207 Cb -0.36 -2.46 0.21 0.00 -0.22 0.00 0.00 33.01 30.18 1h2t s GLN 207 CO 0.40 0.17 1.10 1.63 -0.25 0.00 0.00 175.29 178.35 1h2t n LYS 208 N -0.37 1.11 -0.15 2.91 4.76 -1.26 -4.79 118.16 120.37 1h2t n LYS 208 Ca 0.03 -2.17 0.26 0.00 -2.87 0.00 0.00 58.31 53.56 1h2t n LYS 208 Cb 0.53 -1.26 0.69 0.00 -1.84 0.00 0.00 35.03 33.15 1h2t n LYS 208 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1h2t h THR 209 N 1.43 0.61 -0.04 -0.18 2.02 -1.95 -1.72 112.91 113.08 1h2t h THR 209 Ca 0.00 -0.02 -0.16 0.00 0.77 0.00 0.00 66.41 67.00 1h2t h THR 209 Cb 1.05 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 1h2t h THR 209 CO 0.00 0.01 -0.71 1.12 0.37 0.00 0.00 175.52 176.31 1h2t h HIS 210 N 0.06 0.26 -0.97 3.16 2.07 -1.87 -3.39 115.15 114.48 1h2t h HIS 210 Ca 0.40 -0.12 0.10 0.00 -2.85 0.00 0.00 60.37 57.91 1h2t h HIS 210 Cb 1.50 -0.04 -0.13 0.00 2.57 0.00 0.00 27.41 31.31 1h2t h HIS 210 CO -0.00 0.83 -0.52 0.28 -3.07 0.00 0.00 177.93 175.46 1h2t n VAL 211 N -3.78 -0.62 0.09 6.12 0.31 -0.65 -0.83 118.33 118.97 1h2t n VAL 211 Ca -0.03 2.32 0.19 0.00 -0.01 0.00 0.00 64.34 66.82 1h2t n VAL 211 Cb 0.69 -2.92 0.75 0.00 -0.91 0.00 0.00 33.84 31.45 1h2t n VAL 211 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1h2t h PRO 212 N 0.00 0.00 0.00 5.55 0.11 -1.78 -0.61 132.00 135.27 1h2t h PRO 212 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1h2t h PRO 212 Cb 0.45 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.56 1h2t h PRO 212 CO -0.92 0.00 -0.30 1.98 -0.21 0.00 0.00 178.00 178.55 1h2t h MET 213 N 0.00 0.00 -0.01 1.05 1.85 -1.25 -3.35 114.93 113.22 1h2t h MET 213 Ca 0.18 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.27 1h2t h MET 213 Cb 0.90 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.93 1h2t h MET 213 CO -0.00 0.00 -0.29 1.28 -0.40 0.00 0.00 176.91 177.50 1h2t n LEU 214 N -2.24 1.20 -4.72 3.39 4.77 -0.27 -4.91 117.00 114.22 1h2t n LEU 214 Ca 0.04 -0.72 -0.42 0.00 -0.03 0.00 0.00 56.01 54.88 1h2t n LEU 214 Cb 0.44 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.50 1h2t n LEU 214 CO 0.33 0.24 0.79 -1.10 -1.33 0.00 0.00 177.39 176.33 1h2t s GLN 215 N -1.59 4.52 0.34 3.23 -0.21 -1.01 -4.58 119.66 120.36 1h2t s GLN 215 Ca 0.09 1.63 0.15 0.00 0.02 0.00 0.00 55.36 57.24 1h2t s GLN 215 Cb 0.09 -3.37 0.58 0.00 1.00 0.00 0.00 33.01 31.31 1h2t s GLN 215 CO 0.32 -0.11 1.71 0.28 -2.12 0.00 0.00 175.29 175.37 1h2t h VAL 216 N 4.44 1.17 -4.03 1.09 2.07 -1.94 -3.43 116.25 115.63 1h2t h VAL 216 Ca -0.42 -1.70 -0.39 0.00 0.82 0.00 0.00 66.70 65.01 1h2t h VAL 216 Cb 1.22 1.96 -0.27 0.00 -1.52 0.00 0.00 31.29 32.68 1h2t h VAL 216 CO 0.77 0.46 -0.78 0.26 0.02 0.00 0.00 177.57 178.30 1h2t s TRP 217 N -3.72 0.87 0.04 1.57 0.51 -1.26 -0.89 118.94 116.06 1h2t s TRP 217 Ca -0.01 -0.23 -0.03 0.00 -2.12 0.00 0.00 56.10 53.70 1h2t s TRP 217 Cb 0.12 -0.55 -0.28 0.00 -0.81 0.00 0.00 33.47 31.96 1h2t s TRP 217 CO 0.72 -0.01 1.00 1.79 -0.51 0.00 0.00 176.95 179.94 1h2t h THR 218 N 4.79 1.33 -3.82 2.01 1.35 -1.68 -3.44 112.91 113.44 1h2t h THR 218 Ca -0.33 -2.94 -0.55 0.00 -0.55 0.00 0.00 66.41 62.05 1h2t h THR 218 Cb 1.18 2.85 0.12 0.00 -1.73 0.00 0.00 68.15 70.57 1h2t h THR 218 CO 0.47 0.85 0.65 0.00 -0.25 0.00 0.00 175.52 177.24 1h2t n ALA 219 N -2.59 1.87 -0.36 6.62 0.00 -1.26 -4.89 120.51 119.89 1h2t n ALA 219 Ca -0.12 0.27 0.10 0.00 0.00 0.00 0.00 53.44 53.69 1h2t n ALA 219 Cb 1.03 -2.36 0.33 0.00 0.00 0.00 0.00 19.45 18.45 1h2t n ALA 219 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1h2t n ASP 220 N 0.06 4.19 -3.95 0.00 5.75 -1.26 -4.64 116.55 116.70 1h2t n ASP 220 Ca 0.05 -2.25 -0.17 0.00 -0.01 0.00 0.00 54.79 52.41 1h2t n ASP 220 Cb 0.40 -0.52 -0.15 0.00 -1.03 0.00 0.00 41.12 39.82 1h2t n ASP 220 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1h2t s LYS 221 N -1.53 0.51 0.12 0.11 2.47 -1.26 -3.11 119.74 117.05 1h2t s LYS 221 Ca 0.47 -0.19 0.24 0.00 -1.56 0.00 0.00 55.97 54.94 1h2t s LYS 221 Cb 0.28 -0.51 0.94 0.00 -1.46 0.00 0.00 37.83 37.08 1h2t s LYS 221 CO 0.27 0.09 1.75 -0.35 0.16 0.00 0.00 175.35 177.27 1h2t n PRO 222 N 3.11 0.12 -3.96 4.03 -0.04 -1.26 -4.99 135.00 132.02 1h2t n PRO 222 Ca -0.15 0.20 -0.22 0.00 -0.04 0.00 0.00 63.50 63.29 1h2t n PRO 222 Cb 0.57 -1.67 -0.17 0.00 -0.04 0.00 0.00 33.50 32.18 1h2t n PRO 222 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1h2t s HIS 223 N -3.10 0.85 0.32 0.54 3.76 -1.25 -5.12 115.29 111.29 1h2t s HIS 223 Ca 0.10 -0.28 -0.28 0.00 -0.15 0.00 0.00 55.06 54.44 1h2t s HIS 223 Cb 0.13 -0.83 -0.10 0.00 1.11 0.00 0.00 32.58 32.90 1h2t s HIS 223 CO 0.47 -0.31 1.19 -2.14 -0.85 0.00 0.00 174.74 173.10 1h2t s PRO 224 N 1.51 4.43 -0.64 8.40 0.02 -1.18 -4.67 135.00 142.88 1h2t s PRO 224 Ca -0.01 1.96 -0.18 0.00 0.02 0.00 0.00 61.00 62.78 1h2t s PRO 224 Cb -0.13 -3.05 0.12 0.00 0.02 0.00 0.00 34.50 31.46 1h2t s PRO 224 CO -0.04 -0.02 0.72 -0.65 -0.33 0.00 0.00 177.00 176.68 1h2t s GLN 225 N -1.73 3.14 0.29 5.54 -1.52 -1.26 -4.80 119.66 119.32 1h2t s GLN 225 Ca 0.48 -1.53 -0.16 0.00 -1.95 0.00 0.00 55.36 52.20 1h2t s GLN 225 Cb -0.34 -4.34 -0.09 0.00 -0.22 0.00 0.00 33.01 28.02 1h2t s GLN 225 CO 0.45 -1.51 0.73 -1.21 -0.25 0.00 0.00 175.29 173.50 1h2t s GLU 226 N 2.29 4.08 0.17 2.91 2.02 -1.25 -4.80 118.70 124.11 1h2t s GLU 226 Ca 0.13 0.73 -0.31 0.00 0.02 0.00 0.00 54.97 55.53 1h2t s GLU 226 Cb -0.22 -2.56 -0.10 0.00 0.10 0.00 0.00 34.13 31.35 1h2t s GLU 226 CO 0.03 0.23 1.55 -2.00 0.02 0.00 0.00 175.26 175.09 1h2t s GLU 227 N -2.68 4.22 0.38 1.61 -6.30 -1.26 0.17 118.70 114.84 1h2t s GLU 227 Ca 0.51 2.35 0.18 0.00 -2.50 0.00 0.00 54.97 55.50 1h2t s GLU 227 Cb -0.12 -3.15 1.10 0.00 0.00 0.00 0.00 34.13 31.96 1h2t s GLU 227 CO 0.18 -0.58 1.73 0.10 0.02 0.00 0.00 175.26 176.71 1h2t h TYR 228 N 6.63 0.73 0.02 5.30 -0.00 -1.55 -1.78 116.97 126.33 1h2t h TYR 228 Ca -0.43 0.03 -0.25 0.00 -0.00 0.00 0.00 58.73 58.08 1h2t h TYR 228 Cb 1.21 -0.21 0.01 0.00 -0.00 0.00 0.00 36.73 37.74 1h2t h TYR 228 CO 0.64 0.00 -1.02 -0.07 -0.00 0.00 0.00 178.16 177.72 1h2t h LEU 229 N 0.38 0.64 -0.90 0.10 3.38 -1.90 -1.96 115.31 115.06 1h2t h LEU 229 Ca 0.65 -0.53 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 1h2t h LEU 229 Cb 1.61 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.15 1h2t h LEU 229 CO -0.38 1.34 -0.13 0.44 0.09 0.00 0.00 178.44 179.81 1h2t h ASP 230 N 0.26 0.66 0.15 -0.43 3.32 -1.74 -1.08 116.42 117.56 1h2t h ASP 230 Ca -0.11 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 56.74 1h2t h ASP 230 Cb 1.67 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 41.04 1h2t h ASP 230 CO 0.18 0.81 -0.07 0.00 -1.72 0.00 0.00 179.24 178.44 1h2t h LEU 232 N -0.56 1.00 -0.50 0.00 5.85 -1.27 -0.79 115.31 119.04 1h2t h LEU 232 Ca -0.02 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1h2t h LEU 232 Cb 0.43 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1h2t h LEU 232 CO 0.03 0.67 0.32 -0.25 -0.34 0.00 0.00 178.44 178.88 1h2t h TRP 233 N 1.15 0.61 -0.79 1.25 2.91 -1.17 0.21 115.95 120.12 1h2t h TRP 233 Ca 0.38 0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.39 1h2t h TRP 233 Cb 0.05 -0.20 -0.04 0.00 -0.51 0.00 0.00 29.16 28.46 1h2t h TRP 233 CO -0.01 0.37 0.38 0.00 -1.03 0.00 0.00 178.44 178.15 1h2t h ALA 234 N 1.20 1.17 -0.49 2.65 0.00 -0.75 0.70 119.26 123.74 1h2t h ALA 234 Ca 0.19 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1h2t h ALA 234 Cb -0.04 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1h2t h ALA 234 CO -0.06 0.63 -0.12 1.96 0.00 0.00 0.00 179.25 181.66 1h2t h GLN 235 N 1.13 0.91 -0.11 0.00 4.20 -0.58 -1.27 115.11 119.39 1h2t h GLN 235 Ca 0.27 -0.33 -0.15 0.00 0.06 0.00 0.00 58.65 58.51 1h2t h GLN 235 Cb 0.12 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1h2t h GLN 235 CO -0.03 0.98 -0.57 0.82 -0.67 0.00 0.00 178.83 179.36 1h2t h ILE 236 N 0.81 1.36 -0.44 2.54 1.08 -0.58 -1.38 117.51 120.89 1h2t h ILE 236 Ca 0.13 -1.87 -0.03 0.00 -0.39 0.00 0.00 64.86 62.70 1h2t h ILE 236 Cb 0.65 1.89 -0.02 0.00 -3.07 0.00 0.00 36.82 36.27 1h2t h ILE 236 CO 0.05 0.56 0.16 1.56 -0.69 0.00 0.00 178.15 179.79 1h2t h GLN 237 N 0.26 0.68 -0.68 2.37 1.08 -0.52 0.98 115.11 119.28 1h2t h GLN 237 Ca 0.00 -0.13 -0.05 0.00 -1.45 0.00 0.00 58.65 57.02 1h2t h GLN 237 Cb 1.07 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 28.37 1h2t h GLN 237 CO 0.09 0.64 0.23 -0.22 -0.95 0.00 0.00 178.83 178.62 1h2t h LYS 238 N 0.58 1.02 -0.35 1.46 3.64 -1.09 -0.32 116.57 121.51 1h2t h LYS 238 Ca 0.15 -0.20 -0.05 0.00 -1.27 0.00 0.00 60.65 59.28 1h2t h LYS 238 Cb 0.23 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1h2t h LYS 238 CO -0.01 0.86 0.03 1.25 -2.27 0.00 0.00 179.45 179.32 1h2t h LEU 239 N 0.99 0.57 -0.87 5.20 5.85 -0.76 -2.14 115.31 124.16 1h2t h LEU 239 Ca 0.22 -0.28 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 1h2t h LEU 239 Cb 0.25 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1h2t h LEU 239 CO -0.01 0.71 0.34 0.50 -0.34 0.00 0.00 178.44 179.64 1h2t h LYS 240 N 0.41 1.17 0.00 1.25 3.64 -0.49 0.97 116.57 123.52 1h2t h LYS 240 Ca 0.10 -0.19 -0.04 0.00 -1.27 0.00 0.00 60.65 59.25 1h2t h LYS 240 Cb 0.40 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1h2t h LYS 240 CO 0.01 0.93 -0.19 -0.22 -2.27 0.00 0.00 179.45 177.71 1h2t h LYS 241 N 1.15 0.00 -0.89 1.90 3.64 -0.90 -1.97 116.57 119.49 1h2t h LYS 241 Ca 0.27 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.47 1h2t h LYS 241 Cb 0.17 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 31.89 1h2t h LYS 241 CO -0.03 0.19 0.22 -0.25 -2.27 0.00 0.00 179.45 177.32 1h2t n ASP 242 N -4.06 3.64 -2.97 4.20 8.00 -0.65 -4.86 116.55 119.84 1h2t n ASP 242 Ca -0.02 -2.79 -0.22 0.00 0.71 0.00 0.00 54.79 52.46 1h2t n ASP 242 Cb 0.27 -0.67 0.03 0.00 -0.02 0.00 0.00 41.12 40.73 1h2t n ASP 242 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1h2t n ARG 243 N -0.11 -4.39 -3.60 -1.24 3.00 -0.74 -2.41 116.66 107.17 1h2t n ARG 243 Ca 0.28 0.88 -0.23 0.00 -0.01 0.00 0.00 57.85 58.77 1h2t n ARG 243 Cb 1.04 -5.71 0.08 0.00 0.00 0.00 0.00 32.46 27.87 1h2t n ARG 243 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 1h2t n TRP 244 N -4.40 -2.65 -4.04 -1.55 7.02 0.24 -4.95 117.44 107.13 1h2t n TRP 244 Ca -0.12 0.99 -0.34 0.00 -1.02 0.00 0.00 57.50 57.01 1h2t n TRP 244 Cb 0.62 -4.93 -0.15 0.00 -2.42 0.00 0.00 31.31 24.43 1h2t n TRP 244 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 1h2t s GLN 245 N -6.13 2.84 0.23 -0.99 -1.52 -1.01 -4.55 119.66 108.52 1h2t s GLN 245 Ca 0.45 -0.96 0.12 0.00 -1.95 0.00 0.00 55.36 53.02 1h2t s GLN 245 Cb -0.20 -2.81 -0.05 0.00 -0.22 0.00 0.00 33.01 29.73 1h2t s GLN 245 CO 0.74 -0.34 -0.21 -1.83 -0.25 0.00 0.00 175.29 173.40 1h2t s GLU 246 N 1.29 1.62 -0.21 2.91 4.04 -1.26 -4.93 118.70 122.16 1h2t s GLU 246 Ca 0.01 -1.61 0.15 0.00 0.04 0.00 0.00 54.97 53.56 1h2t s GLU 246 Cb -0.16 -1.83 0.58 0.00 0.02 0.00 0.00 34.13 32.74 1h2t s GLU 246 CO -0.08 0.37 1.50 0.54 -1.84 0.00 0.00 175.26 175.75 1h2t n ARG 247 N -0.12 3.09 -0.02 -4.83 1.74 -1.26 -4.77 116.66 110.48 1h2t n ARG 247 Ca -0.09 -2.94 -0.05 0.00 -0.77 0.00 0.00 57.85 53.99 1h2t n ARG 247 Cb 0.58 -1.92 -0.02 0.00 -1.02 0.00 0.00 32.46 30.07 1h2t n ARG 247 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 1h2t n HIS 248 N -0.43 0.00 -1.65 -1.55 -0.00 -1.26 -3.59 115.22 106.74 1h2t n HIS 248 Ca 0.25 0.00 -0.48 0.00 0.46 0.00 0.00 57.72 57.95 1h2t n HIS 248 Cb 0.99 -0.17 -0.05 0.00 -0.12 0.00 0.00 29.99 30.64 1h2t n HIS 248 CO 0.00 0.00 0.00 -0.89 0.46 0.00 0.00 176.34 175.91 1h2t n ILE 249 N -3.21 0.02 -3.06 3.57 5.41 -1.26 -0.54 119.36 120.29 1h2t n ILE 249 Ca -0.09 -0.00 -0.40 0.00 1.00 0.00 0.00 62.75 63.25 1h2t n ILE 249 Cb 0.57 -1.34 -0.05 0.00 -0.71 0.00 0.00 39.64 38.11 1h2t n ILE 249 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1h2t s LEU 250 N 0.93 4.31 -0.54 1.39 1.43 -1.26 -4.66 118.68 120.28 1h2t s LEU 250 Ca 0.81 1.16 0.04 0.00 -1.03 0.00 0.00 54.13 55.11 1h2t s LEU 250 Cb -0.76 -3.06 0.16 0.00 0.03 0.00 0.00 46.19 42.56 1h2t s LEU 250 CO 0.41 -0.11 0.37 -0.13 0.23 0.00 0.00 176.35 177.12 1h2t s ARG 251 N 0.82 1.66 0.57 1.70 0.52 -1.26 -4.72 118.95 118.24 1h2t s ARG 251 Ca 0.37 -2.59 0.28 0.00 -0.52 0.00 0.00 55.73 53.26 1h2t s ARG 251 Cb -0.17 -2.52 1.49 0.00 0.52 0.00 0.00 34.95 34.26 1h2t s ARG 251 CO 0.17 -1.28 1.95 -1.35 0.02 0.00 0.00 175.30 174.82 1h2t h PRO 252 N 5.86 0.00 0.00 3.54 0.11 -1.96 -1.71 132.00 137.84 1h2t h PRO 252 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1h2t h PRO 252 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1h2t h PRO 252 CO 0.55 0.00 0.00 2.48 -0.21 0.00 0.00 178.00 180.82 1h2t n TYR 253 N -3.96 0.75 0.39 0.65 0.18 -1.26 -2.00 117.16 111.91 1h2t n TYR 253 Ca 0.09 0.32 0.13 0.00 1.88 0.00 0.00 57.90 60.32 1h2t n TYR 253 Cb 0.63 -1.01 0.51 0.00 -0.38 0.00 0.00 39.34 39.09 1h2t n TYR 253 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1h2t h LEU 254 N 0.00 0.00 -0.31 -3.48 3.38 -1.70 -2.01 115.31 111.20 1h2t h LEU 254 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h2t h LEU 254 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1h2t h LEU 254 CO 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 178.44 178.30 1h2t n ALA 255 N -1.88 3.00 -1.72 1.53 0.00 -0.85 -3.80 120.51 116.80 1h2t n ALA 255 Ca 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 53.44 53.12 1h2t n ALA 255 Cb 0.30 -1.22 0.16 0.00 0.00 0.00 0.00 19.45 18.69 1h2t n ALA 255 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1h2t n PHE 256 N -0.92 0.63 0.05 0.00 3.01 -0.76 -4.78 117.46 114.69 1h2t n PHE 256 Ca 0.12 -1.65 0.15 0.00 1.01 0.00 0.00 57.45 57.08 1h2t n PHE 256 Cb 0.32 -0.27 0.63 0.00 -0.01 0.00 0.00 39.48 40.16 1h2t n PHE 256 CO 0.00 0.00 0.00 0.22 1.01 0.00 0.00 176.76 177.99 1h2t h ASP 257 N 1.28 0.09 0.67 4.37 1.82 -1.65 -1.01 116.42 121.97 1h2t h ASP 257 Ca 0.08 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.69 1h2t h ASP 257 Cb 1.14 -0.02 0.01 0.00 0.68 0.00 0.00 39.33 41.14 1h2t h ASP 257 CO 0.17 0.05 -0.32 0.28 -1.61 0.00 0.00 179.24 177.82 1h2t h SER 258 N 0.10 -0.76 0.31 2.28 0.02 -1.92 -1.86 113.55 111.72 1h2t h SER 258 Ca 0.19 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 1h2t h SER 258 Cb 0.64 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.38 1h2t h SER 258 CO -0.02 -0.51 -0.15 0.40 -1.14 0.00 0.00 176.83 175.41 1h2t h ILE 259 N -0.94 0.70 -0.99 3.27 2.04 -1.83 -3.24 117.51 116.53 1h2t h ILE 259 Ca -0.09 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.28 1h2t h ILE 259 Cb 0.70 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 37.69 1h2t h ILE 259 CO 0.15 0.10 0.66 -0.07 0.00 0.00 0.00 178.15 178.98 1h2t h LEU 260 N -0.70 1.13 -1.25 1.44 3.38 -1.30 -2.71 115.31 115.31 1h2t h LEU 260 Ca -0.04 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1h2t h LEU 260 Cb 0.48 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1h2t h LEU 260 CO 0.07 0.82 0.50 0.00 0.09 0.00 0.00 178.44 179.92 1h2t n GLU 262 N -4.42 2.84 -4.14 0.00 1.02 -1.03 -4.86 120.64 110.05 1h2t n GLU 262 Ca 0.08 -1.48 -0.35 0.00 -0.02 0.00 0.00 57.16 55.39 1h2t n GLU 262 Cb 0.03 -1.86 -0.09 0.00 -0.02 0.00 0.00 31.44 29.50 1h2t n GLU 262 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1h2t s ALA 263 N -1.83 3.46 0.33 0.62 0.00 -0.29 -5.08 121.76 118.97 1h2t s ALA 263 Ca 0.26 -0.75 -0.27 0.00 0.00 0.00 0.00 51.96 51.21 1h2t s ALA 263 Cb 0.20 -1.74 -0.09 0.00 0.00 0.00 0.00 23.12 21.49 1h2t s ALA 263 CO 0.08 0.46 1.02 -0.51 0.00 0.00 0.00 175.76 176.81 1h2t s LEU 264 N -0.51 4.35 0.45 0.00 1.02 -1.26 -4.93 118.68 117.80 1h2t s LEU 264 Ca 0.10 2.03 0.04 0.00 0.02 0.00 0.00 54.13 56.32 1h2t s LEU 264 Cb -0.12 -3.94 0.01 0.00 0.02 0.00 0.00 46.19 42.16 1h2t s LEU 264 CO 0.02 -0.22 0.63 -1.10 0.02 0.00 0.00 176.35 175.71 1h2t s GLN 265 N -1.97 2.87 0.10 1.70 -0.21 -1.26 -4.72 119.66 116.17 1h2t s GLN 265 Ca 0.51 -0.87 0.10 0.00 0.02 0.00 0.00 55.36 55.12 1h2t s GLN 265 Cb -0.24 -2.64 -0.04 0.00 1.00 0.00 0.00 33.01 31.09 1h2t s GLN 265 CO 0.30 -0.33 -0.26 -1.01 -2.12 0.00 0.00 175.29 171.88 1h2t s HIS 266 N -2.48 2.23 0.07 0.91 3.76 0.59 -4.87 115.29 115.48 1h2t s HIS 266 Ca 0.52 -0.39 -0.08 0.00 -0.15 0.00 0.00 55.06 54.95 1h2t s HIS 266 Cb -0.10 -1.24 -0.05 0.00 1.11 0.00 0.00 32.58 32.30 1h2t s HIS 266 CO 0.35 0.26 0.36 -0.80 -0.85 0.00 0.00 174.74 174.07 1h2t s ASN 267 N -1.82 6.58 -0.17 1.40 0.01 -1.26 -0.87 114.94 118.82 1h2t s ASN 267 Ca 0.12 0.70 -0.15 0.00 -0.71 0.00 0.00 52.86 52.82 1h2t s ASN 267 Cb -0.10 -2.14 -0.04 0.00 0.41 0.00 0.00 41.25 39.38 1h2t s ASN 267 CO 0.05 0.18 0.36 -0.76 -1.51 0.00 0.00 177.10 175.42 1h2t s LEU 268 N -1.96 4.22 0.61 0.60 1.43 -1.26 -5.00 118.68 117.32 1h2t s LEU 268 Ca 0.32 0.56 -0.19 0.00 -1.03 0.00 0.00 54.13 53.79 1h2t s LEU 268 Cb -0.13 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.58 1h2t s LEU 268 CO 0.18 0.02 1.29 -2.16 0.23 0.00 0.00 176.35 175.92 1h2t s PRO 269 N 0.80 2.78 0.15 1.29 0.04 -1.26 -4.85 135.00 133.96 1h2t s PRO 269 Ca 0.19 2.07 -0.33 0.00 0.04 0.00 0.00 61.00 62.97 1h2t s PRO 269 Cb -0.14 -1.97 -0.16 0.00 0.04 0.00 0.00 34.50 32.27 1h2t s PRO 269 CO 0.06 -1.42 1.04 -2.30 0.04 0.00 0.00 177.00 174.43 1h2t n PRO 270 N -1.61 0.81 -4.21 0.56 -0.02 -1.26 -4.94 135.00 124.33 1h2t n PRO 270 Ca 0.14 0.29 -0.34 0.00 -2.02 0.00 0.00 63.50 61.57 1h2t n PRO 270 Cb 0.48 -1.70 -0.11 0.00 -0.02 0.00 0.00 33.50 32.14 1h2t n PRO 270 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1h2t s PHE 271 N -0.33 3.14 -0.22 6.00 2.19 -1.26 -5.08 117.98 122.42 1h2t s PHE 271 Ca 0.74 -0.10 0.02 0.00 0.33 0.00 0.00 56.93 57.91 1h2t s PHE 271 Cb -0.92 -2.01 0.04 0.00 -1.31 0.00 0.00 43.02 38.81 1h2t s PHE 271 CO 0.54 0.07 -0.16 0.99 1.83 0.00 0.00 175.22 178.49 1h2t s THR 272 N 0.33 2.10 0.16 0.12 2.01 -1.26 -4.82 115.64 114.28 1h2t s THR 272 Ca -0.00 -1.26 -0.31 0.00 0.31 0.00 0.00 61.69 60.43 1h2t s THR 272 Cb -0.13 -2.05 -0.11 0.00 0.01 0.00 0.00 72.50 70.22 1h2t s THR 272 CO 0.02 0.28 1.71 -2.16 -0.69 0.00 0.00 174.62 173.77 1h2t s PRO 273 N 1.21 4.15 0.10 4.92 0.04 -1.26 -4.89 135.00 139.27 1h2t s PRO 273 Ca -0.01 2.52 -0.34 0.00 0.04 0.00 0.00 61.00 63.21 1h2t s PRO 273 Cb -0.16 -3.29 -0.14 0.00 0.04 0.00 0.00 34.50 30.95 1h2t s PRO 273 CO -0.09 -0.75 1.63 -2.30 0.04 0.00 0.00 177.00 175.53 1h2t n PRO 274 N 4.63 2.10 -1.36 0.56 -0.02 -1.26 -4.90 135.00 134.75 1h2t n PRO 274 Ca 0.16 0.76 -0.36 0.00 -2.02 0.00 0.00 63.50 62.04 1h2t n PRO 274 Cb 0.37 -2.54 0.08 0.00 -0.02 0.00 0.00 33.50 31.39 1h2t n PRO 274 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1h2t n PRO 275 N 4.04 0.48 -2.33 0.52 -0.02 -1.26 -4.94 135.00 131.49 1h2t n PRO 275 Ca 0.18 0.21 -0.41 0.00 -2.02 0.00 0.00 63.50 61.46 1h2t n PRO 275 Cb 0.28 -2.08 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 1h2t n PRO 275 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1h2t s HIS 276 N -1.81 3.37 0.19 6.00 5.65 -1.26 -5.04 115.29 122.38 1h2t s HIS 276 Ca 0.71 1.36 0.04 0.00 0.25 0.00 0.00 55.06 57.43 1h2t s HIS 276 Cb -0.36 -3.48 -0.05 0.00 -1.18 0.00 0.00 32.58 27.51 1h2t s HIS 276 CO 0.52 -1.41 -0.06 0.95 -0.65 0.00 0.00 174.74 174.09 1h2t s THR 277 N -0.00 1.16 -0.23 0.89 -4.23 -1.26 -5.01 115.64 106.96 1h2t s THR 277 Ca 0.54 -2.06 0.22 0.00 -1.18 0.00 0.00 61.69 59.21 1h2t s THR 277 Cb -0.34 -2.08 0.22 0.00 1.34 0.00 0.00 72.50 71.65 1h2t s THR 277 CO 0.37 -0.55 1.68 -0.62 -0.54 0.00 0.00 174.62 174.95 1h2t n GLU 278 N -0.31 0.15 -0.37 3.99 1.02 -1.26 -0.53 120.64 123.33 1h2t n GLU 278 Ca -0.08 0.61 0.12 0.00 -0.02 0.00 0.00 57.16 57.79 1h2t n GLU 278 Cb 0.62 -1.96 0.32 0.00 -0.02 0.00 0.00 31.44 30.41 1h2t n GLU 278 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1h2t n ASP 279 N -2.27 3.93 -4.72 1.62 9.92 -1.26 -4.94 116.55 118.83 1h2t n ASP 279 Ca -0.01 -2.00 -0.41 0.00 -0.53 0.00 0.00 54.79 51.84 1h2t n ASP 279 Cb 0.06 -0.49 -0.04 0.00 -0.64 0.00 0.00 41.12 40.01 1h2t n ASP 279 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1h2t s SER 280 N -1.00 7.37 -0.13 -2.24 0.01 0.31 -4.98 113.70 113.05 1h2t s SER 280 Ca 0.49 1.66 0.01 0.00 1.31 0.00 0.00 55.95 59.42 1h2t s SER 280 Cb 0.26 -2.56 0.02 0.00 0.21 0.00 0.00 66.02 63.95 1h2t s SER 280 CO 0.33 -0.18 -0.14 -0.69 0.41 0.00 0.00 173.24 172.98 1h2t s VAL 281 N 0.62 1.49 0.23 3.43 1.01 -1.26 -4.95 120.40 120.97 1h2t s VAL 281 Ca 0.49 -0.60 0.09 0.00 0.00 0.00 0.00 61.98 61.96 1h2t s VAL 281 Cb -0.21 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 1h2t s VAL 281 CO 0.28 0.44 -0.04 -0.31 0.00 0.00 0.00 175.10 175.47 1h2t s TYR 282 N 1.34 2.69 0.55 5.22 1.51 -1.26 -4.80 117.35 122.60 1h2t s TYR 282 Ca 0.01 -0.21 -0.22 0.00 -1.01 0.00 0.00 57.07 55.64 1h2t s TYR 282 Cb -0.13 -1.24 -0.05 0.00 -0.11 0.00 0.00 41.96 40.42 1h2t s TYR 282 CO -0.07 0.58 1.34 -2.14 -1.11 0.00 0.00 175.55 174.14 1h2t s PRO 283 N -3.31 3.14 0.72 -1.71 0.02 -1.26 -4.98 135.00 127.62 1h2t s PRO 283 Ca 0.29 2.19 -0.11 0.00 0.02 0.00 0.00 61.00 63.39 1h2t s PRO 283 Cb -0.08 -2.24 0.03 0.00 0.02 0.00 0.00 34.50 32.23 1h2t s PRO 283 CO 0.18 -1.17 1.07 -1.64 -0.33 0.00 0.00 177.00 175.11 1h2t s MET 284 N -2.93 2.67 0.75 5.54 -1.94 -1.26 -4.90 119.30 117.23 1h2t s MET 284 Ca 0.72 1.07 -0.11 0.00 -1.71 0.00 0.00 55.69 55.65 1h2t s MET 284 Cb -0.39 -1.95 0.04 0.00 2.01 0.00 0.00 34.83 34.53 1h2t s MET 284 CO 0.46 -1.32 1.08 -1.25 -0.01 0.00 0.00 175.02 173.98 1h2t s PRO 285 N -4.92 2.50 0.32 2.03 0.04 -1.26 -5.06 135.00 128.64 1h2t s PRO 285 Ca 0.60 0.87 0.05 0.00 0.04 0.00 0.00 61.00 62.56 1h2t s PRO 285 Cb -0.16 -1.95 -0.06 0.00 0.04 0.00 0.00 34.50 32.37 1h2t s PRO 285 CO 0.54 -1.39 0.01 1.03 0.04 0.00 0.00 177.00 177.23 1h2t s ARG 286 N -5.06 1.64 -0.07 4.56 0.52 -1.26 -5.01 118.95 114.28 1h2t s ARG 286 Ca 0.60 -1.88 0.02 0.00 -0.52 0.00 0.00 55.73 53.94 1h2t s ARG 286 Cb -0.15 -1.05 0.02 0.00 0.52 0.00 0.00 34.95 34.29 1h2t s ARG 286 CO 0.55 -0.09 -0.10 0.08 0.02 0.00 0.00 175.30 175.76 1h2t s VAL 287 N -3.13 1.02 -0.18 3.52 1.01 -1.26 -1.34 120.40 120.04 1h2t s VAL 287 Ca 0.33 -0.40 -0.29 0.00 0.00 0.00 0.00 61.98 61.63 1h2t s VAL 287 Cb 0.07 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.46 1h2t s VAL 287 CO 0.14 0.34 1.50 -0.63 0.00 0.00 0.00 175.10 176.45 1h2t s ILE 288 N 0.83 3.86 0.27 2.22 -1.09 0.13 -4.87 121.20 122.55 1h2t s ILE 288 Ca -0.12 1.01 -0.30 0.00 -2.23 0.00 0.00 60.65 59.02 1h2t s ILE 288 Cb -0.15 -3.77 -0.10 0.00 -1.58 0.00 0.00 42.46 36.86 1h2t s ILE 288 CO 0.02 -0.22 1.34 0.12 -1.23 0.00 0.00 174.94 174.97 1h2t s PHE 289 N 4.41 3.11 -0.17 3.97 5.36 -1.26 -3.88 117.98 129.52 1h2t s PHE 289 Ca 0.66 1.24 -0.07 0.00 -0.96 0.00 0.00 56.93 57.80 1h2t s PHE 289 Cb -0.25 -3.69 0.07 0.00 -0.34 0.00 0.00 43.02 38.81 1h2t s PHE 289 CO 0.25 -2.08 0.38 0.50 -1.46 0.00 0.00 175.22 172.80 1h2t s ARG 290 N -0.85 0.32 0.00 10.12 6.06 -1.26 -5.02 118.95 128.31 1h2t s ARG 290 Ca 0.54 0.85 0.00 0.00 -2.50 0.00 0.00 55.73 54.62 1h2t s ARG 290 Cb -0.39 0.09 0.00 0.00 0.06 0.00 0.00 34.95 34.71 1h2t s ARG 290 CO 0.45 -0.21 0.00 0.00 -2.50 0.00 0.00 175.30 173.04 1h2t n MET 291 N 4.81 2.52 -4.36 5.12 0.00 -1.26 -4.80 117.12 119.14 1h2t n MET 291 Ca -0.16 0.00 -0.28 0.00 0.00 0.00 0.00 57.70 57.26 1h2t n MET 291 Cb 0.52 -0.24 -0.11 0.00 0.00 0.00 0.00 33.22 33.38 1h2t n MET 291 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 1h2t s PHE 292 N -0.13 2.42 0.18 3.17 0.08 -1.26 -5.02 117.98 117.41 1h2t s PHE 292 Ca 0.00 -0.32 -0.05 0.00 0.12 0.00 0.00 56.93 56.68 1h2t s PHE 292 Cb 0.00 -1.24 -0.03 0.00 -0.57 0.00 0.00 43.02 41.19 1h2t s PHE 292 CO 0.00 0.44 0.21 0.16 -0.10 0.00 0.00 175.22 175.93 1h2t s ASP 293 N -2.44 0.12 0.59 1.36 3.84 -1.26 -4.91 116.67 113.96 1h2t s ASP 293 Ca 0.19 -1.12 0.29 0.00 -0.00 0.00 0.00 52.55 51.91 1h2t s ASP 293 Cb -0.09 0.41 1.41 0.00 -1.38 0.00 0.00 42.92 43.27 1h2t s ASP 293 CO 0.10 -0.88 1.81 0.10 -0.00 0.00 0.00 175.17 176.30 1h2t h TYR 294 N 2.60 0.00 0.00 2.11 -0.00 -1.89 -0.18 116.97 119.61 1h2t h TYR 294 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.40 1h2t h TYR 294 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.96 1h2t h TYR 294 CO 0.39 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 178.80 1h2t n THR 295 N -3.72 0.32 0.74 -0.90 -2.24 -1.26 -2.29 114.28 104.92 1h2t n THR 295 Ca 0.12 0.08 0.12 0.00 -2.27 0.00 0.00 64.05 62.11 1h2t n THR 295 Cb 0.85 -0.71 0.26 0.00 -2.10 0.00 0.00 70.33 68.63 1h2t n THR 295 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1h2t n ASP 296 N -1.31 0.58 -3.23 3.42 8.00 -0.08 -4.27 116.55 119.66 1h2t n ASP 296 Ca 0.10 0.11 -0.24 0.00 0.71 0.00 0.00 54.79 55.46 1h2t n ASP 296 Cb 0.19 0.02 -0.07 0.00 -0.02 0.00 0.00 41.12 41.24 1h2t n ASP 296 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1h2t n ASP 297 N -1.90 0.92 -0.21 -2.24 2.03 -0.97 -4.98 116.55 109.21 1h2t n ASP 297 Ca 0.04 -2.86 -0.07 0.00 0.52 0.00 0.00 54.79 52.43 1h2t n ASP 297 Cb 0.40 -0.64 0.03 0.00 -0.72 0.00 0.00 41.12 40.19 1h2t n ASP 297 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1h2t h PRO 298 N 3.99 0.81 -0.90 -0.67 0.13 -1.74 -2.89 132.00 130.72 1h2t h PRO 298 Ca 0.10 -0.09 -0.06 0.00 -0.87 0.00 0.00 66.00 65.08 1h2t h PRO 298 Cb 0.84 -0.16 -0.03 0.00 0.13 0.00 0.00 31.00 31.77 1h2t h PRO 298 CO 0.54 0.62 0.07 0.39 -0.23 0.00 0.00 178.00 179.39 1h2t n GLU 299 N -4.59 2.06 -4.43 0.86 4.71 -1.26 -4.88 120.64 113.12 1h2t n GLU 299 Ca 0.04 -1.07 -0.25 0.00 -0.01 0.00 0.00 57.16 55.86 1h2t n GLU 299 Cb 0.08 -1.65 -0.07 0.00 -1.01 0.00 0.00 31.44 28.79 1h2t n GLU 299 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1h2t n GLY 300 N 0.13 3.20 3.65 0.62 0.00 -1.09 -5.12 105.19 106.57 1h2t n GLY 300 Ca 0.13 -2.10 -0.40 0.00 0.00 0.00 0.00 46.02 43.65 1h2t n GLY 300 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1h2t n PRO 301 N -0.91 1.39 -1.94 1.61 -0.02 -1.26 -4.85 135.00 129.01 1h2t n PRO 301 Ca -0.05 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.51 1h2t n PRO 301 Cb 0.62 -2.21 -0.03 0.00 -0.02 0.00 0.00 33.50 31.86 1h2t n PRO 301 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1h2t s VAL 302 N -1.33 3.47 0.03 -1.45 1.01 -1.26 -4.32 120.40 116.54 1h2t s VAL 302 Ca 0.67 0.55 -0.30 0.00 0.00 0.00 0.00 61.98 62.90 1h2t s VAL 302 Cb -0.49 -3.39 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 1h2t s VAL 302 CO 0.53 -0.09 1.46 -0.32 0.00 0.00 0.00 175.10 176.68 1h2t s MET 303 N 4.36 4.27 0.34 2.72 1.75 -1.26 -4.77 119.30 126.70 1h2t s MET 303 Ca 0.77 2.06 -0.28 0.00 -1.25 0.00 0.00 55.69 56.99 1h2t s MET 303 Cb -0.34 -3.55 -0.12 0.00 2.84 0.00 0.00 34.83 33.66 1h2t s MET 303 CO 0.32 -0.60 1.26 -2.30 -0.65 0.00 0.00 175.02 173.05 1h2t n PRO 304 N 5.30 2.04 -1.61 4.11 -0.02 -1.26 -4.36 135.00 139.21 1h2t n PRO 304 Ca 0.14 0.72 -0.32 0.00 -2.02 0.00 0.00 63.50 62.01 1h2t n PRO 304 Cb 0.43 -2.27 0.06 0.00 -0.02 0.00 0.00 33.50 31.69 1h2t n PRO 304 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1h2t s GLY 305 N -0.34 1.97 0.54 -1.23 0.00 -1.26 -4.79 107.32 102.22 1h2t s GLY 305 Ca 0.56 0.42 0.28 0.00 0.00 0.00 0.00 44.72 45.98 1h2t s GLY 305 CO 0.62 0.76 1.94 1.76 0.00 0.00 0.00 173.10 178.18 1h2t h SER 306 N -0.35 0.00 -0.60 1.64 0.02 -1.91 -0.36 113.55 111.99 1h2t h SER 306 Ca -0.46 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.39 1h2t h SER 306 Cb 1.24 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.72 1h2t h SER 306 CO 0.54 0.00 0.12 1.41 -1.14 0.00 0.00 176.83 177.75 1h2t n HIS 307 N -4.25 2.06 -4.02 3.45 8.25 -1.26 -4.90 115.22 114.56 1h2t n HIS 307 Ca 0.13 -0.99 -0.32 0.00 -0.26 0.00 0.00 57.72 56.28 1h2t n HIS 307 Cb 0.76 -0.56 -0.06 0.00 1.12 0.00 0.00 29.99 31.24 1h2t n HIS 307 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1h2t s SER 308 N -1.13 5.92 0.51 0.41 1.04 -0.15 -3.88 113.70 116.42 1h2t s SER 308 Ca 0.53 0.19 0.27 0.00 0.48 0.00 0.00 55.95 57.41 1h2t s SER 308 Cb 0.42 -1.74 1.36 0.00 0.10 0.00 0.00 66.02 66.15 1h2t s SER 308 CO 0.13 0.24 2.03 -0.37 0.98 0.00 0.00 173.24 176.25 1h2t h VAL 309 N 2.85 0.56 -0.47 5.02 -1.51 -1.88 -2.58 116.25 118.23 1h2t h VAL 309 Ca -0.48 -0.64 -0.02 0.00 -1.23 0.00 0.00 66.70 64.33 1h2t h VAL 309 Cb 1.18 1.42 -0.02 0.00 -2.13 0.00 0.00 31.29 31.74 1h2t h VAL 309 CO 0.66 0.14 0.22 -0.33 -1.23 0.00 0.00 177.57 177.03 1h2t h GLU 310 N 0.00 0.68 -0.73 5.19 3.07 -1.94 -0.06 114.58 120.80 1h2t h GLU 310 Ca -0.00 -0.11 0.02 0.00 -0.50 0.00 0.00 59.36 58.77 1h2t h GLU 310 Cb 0.41 -0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 28.16 1h2t h GLU 310 CO 0.02 0.59 0.48 -0.09 -1.40 0.00 0.00 179.01 178.60 1h2t h ARG 311 N 0.62 0.93 -0.13 2.33 9.65 -1.70 -0.38 114.38 125.70 1h2t h ARG 311 Ca 0.16 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 58.98 1h2t h ARG 311 Cb 0.13 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 28.50 1h2t h ARG 311 CO -0.02 0.61 0.07 0.35 2.80 0.00 0.00 179.97 183.79 1h2t h PHE 312 N 0.96 0.18 -0.39 2.20 3.57 -1.37 -2.20 116.94 119.88 1h2t h PHE 312 Ca 0.28 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.73 1h2t h PHE 312 Cb -0.06 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 1h2t h PHE 312 CO -0.03 0.20 0.09 0.28 -2.23 0.00 0.00 178.31 176.62 1h2t h VAL 313 N 0.12 1.23 0.13 1.41 2.07 -0.75 -1.23 116.25 119.23 1h2t h VAL 313 Ca 0.05 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 66.79 1h2t h VAL 313 Cb 0.07 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 1h2t h VAL 313 CO -0.01 0.27 -0.21 0.40 0.02 0.00 0.00 177.57 178.05 1h2t h ILE 314 N 0.49 0.54 -0.63 4.57 2.04 -1.04 -0.02 117.51 123.46 1h2t h ILE 314 Ca 0.12 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.95 1h2t h ILE 314 Cb 0.32 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 1h2t h ILE 314 CO 0.00 0.00 0.25 -0.33 0.00 0.00 0.00 178.15 178.07 1h2t h GLU 315 N -0.40 0.94 -0.79 2.37 5.08 -1.36 -1.56 114.58 118.85 1h2t h GLU 315 Ca 0.02 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.17 1h2t h GLU 315 Cb 0.41 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 1h2t h GLU 315 CO -0.10 0.80 0.35 1.49 -1.00 0.00 0.00 179.01 180.54 1h2t h GLU 316 N 0.88 1.16 -0.28 2.33 4.57 -1.03 -0.32 114.58 121.89 1h2t h GLU 316 Ca 0.21 -0.19 -0.17 0.00 -1.18 0.00 0.00 59.36 58.03 1h2t h GLU 316 Cb 0.21 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.60 1h2t h GLU 316 CO -0.02 0.92 -0.51 -0.91 -1.18 0.00 0.00 179.01 177.31 1h2t h ASN 317 N 1.13 0.87 -0.09 1.04 2.35 -0.79 -1.79 115.58 118.31 1h2t h ASN 317 Ca 0.27 -0.45 -0.13 0.00 -0.55 0.00 0.00 56.30 55.44 1h2t h ASN 317 Cb 0.17 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1h2t h ASN 317 CO -0.03 1.22 -0.37 -0.07 -1.65 0.00 0.00 177.43 176.53 1h2t h LEU 318 N 0.62 0.63 -0.59 1.61 3.38 -1.05 -0.48 115.31 119.42 1h2t h LEU 318 Ca 0.02 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 1h2t h LEU 318 Cb 1.09 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 1h2t h LEU 318 CO 0.11 0.94 0.16 0.45 0.09 0.00 0.00 178.44 180.18 1h2t h HIS 319 N 0.50 0.98 -0.82 1.13 3.86 -1.00 -2.29 115.15 117.51 1h2t h HIS 319 Ca 0.05 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.12 1h2t h HIS 319 Cb 0.87 -0.28 -0.04 0.00 1.06 0.00 0.00 27.41 29.02 1h2t h HIS 319 CO 0.04 0.83 0.40 0.00 0.86 0.00 0.00 177.93 180.06 1h2t h ILE 321 N 1.16 1.15 -0.69 0.00 2.04 -0.89 -0.47 117.51 119.80 1h2t h ILE 321 Ca 0.28 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.72 1h2t h ILE 321 Cb 0.11 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 1h2t h ILE 321 CO -0.04 0.15 0.20 0.40 0.00 0.00 0.00 178.15 178.87 1h2t h ILE 322 N 0.57 1.25 -0.94 -0.67 2.04 -1.04 -0.98 117.51 117.75 1h2t h ILE 322 Ca 0.15 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 1h2t h ILE 322 Cb 0.03 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 1h2t h ILE 322 CO -0.03 0.34 0.55 0.50 0.00 0.00 0.00 178.15 179.52 1h2t h LYS 323 N 1.02 1.28 -0.18 2.37 3.64 -0.57 0.10 116.57 124.24 1h2t h LYS 323 Ca 0.22 -0.13 -0.21 0.00 -1.27 0.00 0.00 60.65 59.27 1h2t h LYS 323 Cb 0.30 -0.26 0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1h2t h LYS 323 CO -0.01 0.90 -0.69 0.77 -2.27 0.00 0.00 179.45 178.16 1h2t h SER 324 N 1.30 0.92 -0.21 4.20 0.02 -0.66 -3.37 113.55 115.74 1h2t h SER 324 Ca 0.33 -0.61 -0.04 0.00 -0.84 0.00 0.00 61.79 60.64 1h2t h SER 324 Cb -0.03 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.22 1h2t h SER 324 CO -0.06 1.37 -0.03 1.41 -1.14 0.00 0.00 176.83 178.38 1h2t n HIS 325 N -3.99 0.73 0.17 3.45 8.25 -0.41 -4.77 115.22 118.65 1h2t n HIS 325 Ca -0.07 -1.06 0.17 0.00 -0.26 0.00 0.00 57.72 56.49 1h2t n HIS 325 Cb 0.70 -0.31 0.77 0.00 1.12 0.00 0.00 29.99 32.27 1h2t n HIS 325 CO 0.00 0.00 0.00 0.11 0.64 0.00 0.00 176.34 177.09 1h2t h TRP 326 N 1.22 0.00 0.00 4.41 5.08 -0.96 -1.90 115.95 123.80 1h2t h TRP 326 Ca 0.04 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.00 1h2t h TRP 326 Cb 1.38 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.53 1h2t h TRP 326 CO 0.50 0.00 -0.08 0.87 -1.28 0.00 0.00 178.44 178.45 1h2t h LYS 327 N 0.00 0.00 -3.71 0.12 1.57 -1.87 -3.39 116.57 109.29 1h2t h LYS 327 Ca 0.11 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.21 1h2t h LYS 327 Cb 0.55 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 32.50 1h2t h LYS 327 CO -0.00 0.08 -0.44 -1.21 -0.57 0.00 0.00 179.45 177.31 1h2t s GLU 328 N -3.32 2.37 0.30 3.15 0.41 -0.71 -4.98 118.70 115.91 1h2t s GLU 328 Ca 0.05 -2.43 0.00 0.00 -0.41 0.00 0.00 54.97 52.18 1h2t s GLU 328 Cb 0.07 -3.63 0.51 0.00 -1.78 0.00 0.00 34.13 29.29 1h2t s GLU 328 CO 0.65 -1.14 1.91 0.07 -0.49 0.00 0.00 175.26 176.26 1h2t h ARG 329 N 7.10 1.02 -0.27 1.61 0.11 -1.78 0.26 114.38 122.44 1h2t h ARG 329 Ca -0.04 -0.06 -0.14 0.00 0.10 0.00 0.00 59.98 59.84 1h2t h ARG 329 Cb 0.96 -0.23 -0.00 0.00 1.11 0.00 0.00 29.97 31.80 1h2t h ARG 329 CO 0.70 0.68 -0.37 0.87 0.10 0.00 0.00 179.97 181.95 1h2t h LYS 330 N 1.06 0.72 -0.13 0.08 1.57 -1.93 -2.14 116.57 115.78 1h2t h LYS 330 Ca 0.39 -0.42 -0.12 0.00 -1.87 0.00 0.00 60.65 58.63 1h2t h LYS 330 Cb 0.16 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1h2t h LYS 330 CO -0.14 1.04 -0.44 1.15 -0.57 0.00 0.00 179.45 180.49 1h2t h THR 331 N 0.45 1.32 -0.25 -0.16 2.02 -1.82 -2.14 112.91 112.34 1h2t h THR 331 Ca 0.03 -1.61 -0.04 0.00 0.77 0.00 0.00 66.41 65.56 1h2t h THR 331 Cb 0.96 1.71 -0.01 0.00 -1.74 0.00 0.00 68.15 69.06 1h2t h THR 331 CO 0.09 0.49 -0.01 0.00 0.37 0.00 0.00 175.52 176.46 1h2t h ALA 333 N 0.80 1.17 -0.51 0.00 0.00 -1.30 -1.68 119.26 117.76 1h2t h ALA 333 Ca 0.07 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1h2t h ALA 333 Cb 0.42 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1h2t h ALA 333 CO 0.01 0.62 -0.06 0.00 0.00 0.00 0.00 179.25 179.82 1h2t h ALA 334 N 1.29 0.69 -0.39 0.00 0.00 -1.24 -1.73 119.26 117.87 1h2t h ALA 334 Ca 0.26 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1h2t h ALA 334 Cb 0.14 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1h2t h ALA 334 CO -0.03 0.56 -0.14 1.96 0.00 0.00 0.00 179.25 181.60 1h2t h GLN 335 N 0.80 0.71 -0.07 0.00 1.08 -0.93 -1.46 115.11 115.23 1h2t h GLN 335 Ca 0.14 -0.24 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 1h2t h GLN 335 Cb 0.61 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.98 1h2t h GLN 335 CO 0.04 0.81 -0.00 -0.07 -0.95 0.00 0.00 178.83 178.66 1h2t h LEU 336 N 0.64 0.13 -1.67 1.46 3.38 -1.19 -2.96 115.31 115.08 1h2t h LEU 336 Ca 0.11 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1h2t h LEU 336 Cb 0.60 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1h2t h LEU 336 CO 0.04 0.42 -0.15 0.58 0.09 0.00 0.00 178.44 179.41 1h2t h VAL 337 N -0.17 1.12 -0.45 1.22 2.07 -1.22 -2.22 116.25 116.59 1h2t h VAL 337 Ca 0.02 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1h2t h VAL 337 Cb 0.36 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1h2t h VAL 337 CO 0.00 0.16 0.00 -1.54 0.02 0.00 0.00 177.57 176.21 1h2t n SER 338 N -4.35 2.40 -4.67 0.57 3.41 -0.56 -4.95 113.62 105.47 1h2t n SER 338 Ca -0.02 -2.00 -0.48 0.00 -0.26 0.00 0.00 58.87 56.10 1h2t n SER 338 Cb 0.22 -0.30 -0.05 0.00 -0.26 0.00 0.00 64.21 63.83 1h2t n SER 338 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1h2t n TYR 339 N 0.80 2.21 -3.66 7.33 9.36 -0.84 -4.97 117.16 127.39 1h2t n TYR 339 Ca 0.15 0.23 -0.27 0.00 3.32 0.00 0.00 57.90 61.33 1h2t n TYR 339 Cb 0.38 -2.56 -0.03 0.00 -0.63 0.00 0.00 39.34 36.50 1h2t n TYR 339 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1h2t s PRO 340 N 1.97 3.53 0.18 2.98 0.04 -1.26 -5.11 135.00 137.32 1h2t s PRO 340 Ca 0.85 -0.31 -0.17 0.00 0.04 0.00 0.00 61.00 61.40 1h2t s PRO 340 Cb -0.73 -2.82 0.03 0.00 0.04 0.00 0.00 34.50 31.02 1h2t s PRO 340 CO 0.44 0.38 0.49 0.20 0.04 0.00 0.00 177.00 178.56 1h2t s GLY 341 N -3.16 -0.13 0.26 0.56 0.00 -1.26 -4.92 107.32 98.67 1h2t s GLY 341 Ca 0.39 -0.18 0.03 0.00 0.00 0.00 0.00 44.72 44.96 1h2t s GLY 341 CO 0.29 -0.27 1.64 1.70 0.00 0.00 0.00 173.10 176.45 1h2t h LYS 342 N 2.23 0.35 -5.11 2.90 3.64 -1.03 -3.45 116.57 116.11 1h2t h LYS 342 Ca -0.30 -0.18 -0.35 0.00 -1.27 0.00 0.00 60.65 58.54 1h2t h LYS 342 Cb 1.26 0.01 -0.19 0.00 -0.41 0.00 0.00 32.23 32.90 1h2t h LYS 342 CO 0.40 0.73 -0.75 -0.80 -2.27 0.00 0.00 179.45 176.76 1h2t s ASN 343 N -6.87 1.59 0.51 4.20 0.01 -1.24 -5.02 114.94 108.12 1h2t s ASN 343 Ca -0.05 -0.77 -0.23 0.00 -0.71 0.00 0.00 52.86 51.09 1h2t s ASN 343 Cb 0.13 -0.02 -0.06 0.00 0.41 0.00 0.00 41.25 41.71 1h2t s ASN 343 CO 0.79 -0.20 1.37 -0.54 -1.51 0.00 0.00 177.10 177.01 1h2t s LYS 344 N -2.55 3.36 0.08 -0.60 1.02 -1.26 -5.01 119.74 114.78 1h2t s LYS 344 Ca 0.04 2.28 -0.03 0.00 0.02 0.00 0.00 55.97 58.29 1h2t s LYS 344 Cb -0.05 -2.41 -0.03 0.00 -0.52 0.00 0.00 37.83 34.83 1h2t s LYS 344 CO 0.01 -1.03 0.05 0.96 -0.92 0.00 0.00 175.35 174.42 1h2t s ILE 345 N -1.28 0.17 -1.51 2.17 -4.36 -1.26 -4.76 121.20 110.38 1h2t s ILE 345 Ca 0.67 -1.69 -0.11 0.00 -0.26 0.00 0.00 60.65 59.26 1h2t s ILE 345 Cb -0.41 -1.61 -0.00 0.00 1.25 0.00 0.00 42.46 41.68 1h2t s ILE 345 CO 0.50 -0.78 2.54 -0.81 0.24 0.00 0.00 174.94 176.63 1h2t n PRO 346 N 0.02 3.38 -0.33 0.37 -0.04 -1.26 -4.80 135.00 132.34 1h2t n PRO 346 Ca -0.12 -2.54 0.06 0.00 -0.04 0.00 0.00 63.50 60.86 1h2t n PRO 346 Cb 0.62 -3.01 0.14 0.00 -0.04 0.00 0.00 33.50 31.21 1h2t n PRO 346 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1h2t h LEU 347 N 8.29 -0.81 -1.16 1.53 5.85 -1.96 0.81 115.31 127.85 1h2t h LEU 347 Ca 0.70 0.28 0.17 0.00 0.84 0.00 0.00 57.88 59.87 1h2t h LEU 347 Cb 0.46 0.56 -0.09 0.00 0.37 0.00 0.00 40.66 41.97 1h2t h LEU 347 CO 1.81 -0.31 0.61 0.78 -0.34 0.00 0.00 178.44 180.98 1h2t h ASN 348 N 0.00 0.72 -0.23 1.25 2.35 -1.98 0.24 115.58 117.93 1h2t h ASN 348 Ca 0.46 0.06 -0.13 0.00 -0.55 0.00 0.00 56.30 56.15 1h2t h ASN 348 Cb 0.74 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 39.04 1h2t h ASN 348 CO -0.95 0.31 -0.35 1.88 -1.65 0.00 0.00 177.43 176.67 1h2t h TYR 349 N 0.73 0.80 -0.73 1.19 -1.99 -1.25 -2.17 116.97 113.55 1h2t h TYR 349 Ca 0.51 -0.27 -0.04 0.00 2.00 0.00 0.00 58.73 60.93 1h2t h TYR 349 Cb 0.83 -0.16 -0.03 0.00 2.00 0.00 0.00 36.73 39.37 1h2t h TYR 349 CO -0.00 1.02 0.31 0.45 -0.00 0.00 0.00 178.16 179.94 1h2t h HIS 350 N 0.35 1.10 0.17 4.88 3.86 -0.73 -1.04 115.15 123.74 1h2t h HIS 350 Ca 0.02 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1h2t h HIS 350 Cb 0.94 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 29.08 1h2t h HIS 350 CO 0.08 0.83 -0.08 0.82 0.86 0.00 0.00 177.93 180.45 1h2t h ILE 351 N 1.04 0.91 -0.88 2.45 2.04 -0.55 -0.46 117.51 122.06 1h2t h ILE 351 Ca 0.25 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 1h2t h ILE 351 Cb 0.19 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 1h2t h ILE 351 CO -0.02 0.07 0.47 0.58 0.00 0.00 0.00 178.15 179.25 1h2t h VAL 352 N -0.37 1.26 -0.34 1.67 2.07 -1.35 -1.64 116.25 117.55 1h2t h VAL 352 Ca -0.02 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 1h2t h VAL 352 Cb 0.29 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1h2t h VAL 352 CO 0.04 0.29 0.14 -0.08 0.02 0.00 0.00 177.57 177.98 1h2t h GLU 353 N 1.23 0.50 -0.79 1.57 4.81 -1.03 -1.59 114.58 119.28 1h2t h GLU 353 Ca 0.31 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1h2t h GLU 353 Cb 0.04 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 1h2t h GLU 353 CO -0.05 0.49 0.37 0.28 -0.73 0.00 0.00 179.01 179.38 1h2t h VAL 354 N 0.40 1.25 -0.28 0.32 2.07 -0.85 0.27 116.25 119.43 1h2t h VAL 354 Ca 0.11 -0.70 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 1h2t h VAL 354 Cb 0.18 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1h2t h VAL 354 CO -0.01 0.30 0.07 0.40 0.02 0.00 0.00 177.57 178.35 1h2t h ILE 355 N 1.13 1.21 -0.09 4.57 2.04 -1.07 -1.68 117.51 123.63 1h2t h ILE 355 Ca 0.27 -0.70 -0.07 0.00 1.00 0.00 0.00 64.86 65.36 1h2t h ILE 355 Cb 0.12 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1h2t h ILE 355 CO -0.03 0.23 -0.29 -0.26 0.00 0.00 0.00 178.15 177.80 1h2t h PHE 356 N 0.29 0.17 -0.54 1.37 0.04 -0.96 -0.80 116.94 116.51 1h2t h PHE 356 Ca 0.09 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.80 1h2t h PHE 356 Cb 0.28 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.36 1h2t h PHE 356 CO 0.01 0.43 0.23 0.00 -0.60 0.00 0.00 178.31 178.38 1h2t h ALA 357 N 1.57 1.39 0.00 2.45 0.00 -0.54 0.12 119.26 124.26 1h2t h ALA 357 Ca 0.02 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1h2t h ALA 357 Cb 0.59 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1h2t h ALA 357 CO 0.04 0.47 -0.17 0.93 0.00 0.00 0.00 179.25 180.51 1h2t h GLU 358 N 0.76 0.11 -0.76 0.00 5.08 -0.69 -2.29 114.58 116.79 1h2t h GLU 358 Ca 0.18 -0.13 0.06 0.00 -1.00 0.00 0.00 59.36 58.48 1h2t h GLU 358 Cb 0.13 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.37 1h2t h GLU 358 CO -0.02 0.89 0.50 1.25 -1.00 0.00 0.00 179.01 180.63 1h2t h LEU 359 N -0.61 0.73 -1.82 1.33 5.85 -0.93 -2.26 115.31 117.61 1h2t h LEU 359 Ca -0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1h2t h LEU 359 Cb 0.95 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1h2t h LEU 359 CO 0.03 0.48 0.00 0.49 -0.34 0.00 0.00 178.44 179.10 1h2t n PHE 360 N -4.48 0.31 -1.82 1.25 3.72 0.41 -4.67 117.46 112.18 1h2t n PHE 360 Ca 0.11 -0.15 -0.41 0.00 -0.05 0.00 0.00 57.45 56.95 1h2t n PHE 360 Cb 0.20 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.73 1h2t n PHE 360 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1h2t s GLN 361 N -1.69 4.13 -0.07 -1.08 0.74 -0.85 -4.85 119.66 115.99 1h2t s GLN 361 Ca 0.35 2.55 0.03 0.00 0.05 0.00 0.00 55.36 58.34 1h2t s GLN 361 Cb 0.21 -2.99 -0.02 0.00 1.10 0.00 0.00 33.01 31.30 1h2t s GLN 361 CO 0.30 -0.54 -0.15 -0.51 -0.55 0.00 0.00 175.29 173.84 1h2t s LEU 362 N -1.60 2.65 0.17 3.68 1.43 -1.26 -2.85 118.68 120.89 1h2t s LEU 362 Ca 0.56 -0.26 -0.12 0.00 -1.03 0.00 0.00 54.13 53.27 1h2t s LEU 362 Cb -0.46 -1.54 0.06 0.00 0.03 0.00 0.00 46.19 44.28 1h2t s LEU 362 CO 0.58 0.30 1.72 -0.65 0.23 0.00 0.00 176.35 178.53 1h2t h PRO 363 N 5.69 0.85 -4.02 1.29 0.11 -1.91 -3.47 132.00 130.54 1h2t h PRO 363 Ca -0.41 -0.16 -0.11 0.00 0.11 0.00 0.00 66.00 65.43 1h2t h PRO 363 Cb 1.17 -0.14 -0.14 0.00 0.11 0.00 0.00 31.00 32.00 1h2t h PRO 363 CO 0.51 0.74 -0.48 0.00 -0.21 0.00 0.00 178.00 178.55 1h2t s ALA 364 N -5.53 0.15 0.73 -0.75 0.00 -1.13 -4.76 121.76 110.46 1h2t s ALA 364 Ca -0.13 -0.93 -0.13 0.00 0.00 0.00 0.00 51.96 50.77 1h2t s ALA 364 Cb 0.12 0.53 0.04 0.00 0.00 0.00 0.00 23.12 23.81 1h2t s ALA 364 CO 0.79 -0.49 1.12 -2.14 0.00 0.00 0.00 175.76 175.04 1h2t s PRO 365 N -3.92 2.38 0.46 0.00 0.02 -1.24 -4.70 135.00 128.01 1h2t s PRO 365 Ca 0.10 1.37 0.25 0.00 0.02 0.00 0.00 61.00 62.74 1h2t s PRO 365 Cb 0.06 -1.90 1.08 0.00 0.02 0.00 0.00 34.50 33.76 1h2t s PRO 365 CO -0.07 -1.58 1.90 -1.35 -0.33 0.00 0.00 177.00 175.57 1h2t h PRO 366 N -0.57 0.00 -4.99 5.54 0.11 -1.95 -3.45 132.00 126.69 1h2t h PRO 366 Ca -0.45 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.31 1h2t h PRO 366 Cb 1.25 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.21 1h2t h PRO 366 CO 0.51 0.20 -0.66 -1.01 -0.21 0.00 0.00 178.00 176.83 1h2t s HIS 367 N -3.82 1.43 0.21 0.65 3.76 -1.26 -5.11 115.29 111.14 1h2t s HIS 367 Ca -0.01 -0.95 -0.32 0.00 -0.15 0.00 0.00 55.06 53.63 1h2t s HIS 367 Cb 0.11 -0.82 -0.14 0.00 1.11 0.00 0.00 32.58 32.84 1h2t s HIS 367 CO 0.62 -0.10 1.34 1.51 -0.85 0.00 0.00 174.74 177.26 1h2t n ILE 368 N -0.35 0.84 -0.23 0.60 3.06 -1.26 -4.87 119.36 117.15 1h2t n ILE 368 Ca -0.06 -0.21 0.03 0.00 -2.50 0.00 0.00 62.75 60.02 1h2t n ILE 368 Cb 0.63 -1.26 0.14 0.00 0.54 0.00 0.00 39.64 39.70 1h2t n ILE 368 CO 0.00 0.00 0.00 0.44 -2.50 0.00 0.00 176.55 174.49 1h2t h ASP 369 N 4.06 -0.07 -0.18 9.51 5.19 -1.98 -2.40 116.42 130.55 1h2t h ASP 369 Ca -0.44 0.14 0.05 0.00 -0.62 0.00 0.00 57.03 56.16 1h2t h ASP 369 Cb 1.30 0.21 -0.01 0.00 0.18 0.00 0.00 39.33 41.01 1h2t h ASP 369 CO 0.75 -0.05 0.18 1.62 -3.12 0.00 0.00 179.24 178.62 1h2t h VAL 370 N 0.22 0.54 -0.72 -1.35 3.04 -2.01 -2.07 116.25 113.90 1h2t h VAL 370 Ca 0.37 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 66.05 1h2t h VAL 370 Cb 0.60 0.86 -0.04 0.00 -2.01 0.00 0.00 31.29 30.71 1h2t h VAL 370 CO -0.50 0.00 0.43 -0.03 -1.01 0.00 0.00 177.57 176.46 1h2t h MET 371 N 0.00 0.97 -0.18 4.17 -1.53 -1.79 -2.45 114.93 114.13 1h2t h MET 371 Ca 0.08 -0.09 -0.07 0.00 -3.44 0.00 0.00 59.70 56.19 1h2t h MET 371 Cb 0.45 -0.21 -0.01 0.00 -0.55 0.00 0.00 31.60 31.28 1h2t h MET 371 CO -0.00 0.69 -0.19 1.88 0.14 0.00 0.00 176.91 179.43 1h2t h TYR 372 N 0.99 0.33 -0.04 1.39 0.05 -1.53 0.12 116.97 118.28 1h2t h TYR 372 Ca 0.26 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.98 1h2t h TYR 372 Cb -0.03 -0.09 -0.00 0.00 1.01 0.00 0.00 36.73 37.62 1h2t h TYR 372 CO 0.00 0.49 0.00 1.15 -1.05 0.00 0.00 178.16 178.76 1h2t h THR 373 N 0.28 1.24 -0.18 -2.88 2.02 -1.54 -1.66 112.91 110.19 1h2t h THR 373 Ca 0.05 -0.73 -0.12 0.00 0.77 0.00 0.00 66.41 66.38 1h2t h THR 373 Cb 0.51 1.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.56 1h2t h THR 373 CO 0.03 0.20 -0.39 0.74 0.37 0.00 0.00 175.52 176.47 1h2t h THR 374 N -0.21 1.30 -0.68 3.16 2.02 -1.37 -2.45 112.91 114.68 1h2t h THR 374 Ca 0.01 -1.52 -0.05 0.00 0.77 0.00 0.00 66.41 65.62 1h2t h THR 374 Cb 0.32 1.59 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 1h2t h THR 374 CO 0.00 0.47 0.22 0.25 0.37 0.00 0.00 175.52 176.83 1h2t h LEU 375 N 0.34 0.99 -0.92 2.58 5.85 -0.69 -1.01 115.31 122.45 1h2t h LEU 375 Ca 0.03 -0.21 -0.11 0.00 0.84 0.00 0.00 57.88 58.44 1h2t h LEU 375 Cb 0.84 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1h2t h LEU 375 CO 0.07 0.93 -0.36 -0.07 -0.34 0.00 0.00 178.44 178.67 1h2t h LEU 376 N 1.00 0.35 -0.37 2.25 3.38 -1.10 -1.49 115.31 119.32 1h2t h LEU 376 Ca 0.22 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 1h2t h LEU 376 Cb 0.29 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1h2t h LEU 376 CO -0.01 0.69 0.05 0.40 0.09 0.00 0.00 178.44 179.66 1h2t h ILE 377 N 0.29 1.24 -0.24 1.22 2.04 -1.00 -0.95 117.51 120.12 1h2t h ILE 377 Ca 0.03 -0.87 -0.03 0.00 1.00 0.00 0.00 64.86 64.99 1h2t h ILE 377 Cb 0.78 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1h2t h ILE 377 CO 0.06 0.29 -0.00 -0.33 0.00 0.00 0.00 178.15 178.17 1h2t h GLU 378 N 0.46 0.35 -0.18 2.37 4.39 -0.93 -1.89 114.58 119.15 1h2t h GLU 378 Ca 0.11 -0.06 -0.19 0.00 0.34 0.00 0.00 59.36 59.57 1h2t h GLU 378 Cb 0.38 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1h2t h GLU 378 CO 0.01 0.38 -0.63 -0.07 -1.16 0.00 0.00 179.01 177.53 1h2t h LEU 379 N 0.34 0.75 -1.16 1.33 3.38 -0.94 -2.53 115.31 116.48 1h2t h LEU 379 Ca 0.08 -0.44 -0.02 0.00 0.09 0.00 0.00 57.88 57.59 1h2t h LEU 379 Cb 0.23 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1h2t h LEU 379 CO 0.01 1.20 0.33 0.00 0.09 0.00 0.00 178.44 180.06 1h2t h LYS 381 N 0.91 0.01 0.00 0.00 1.57 -1.23 -2.10 116.57 115.73 1h2t h LYS 381 Ca 0.23 -0.01 -0.20 0.00 -1.87 0.00 0.00 60.65 58.80 1h2t h LYS 381 Cb 0.07 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1h2t h LYS 381 CO -0.03 0.43 -1.22 1.25 -0.57 0.00 0.00 179.45 179.30 1h2t h LEU 382 N 0.01 0.00 -5.56 2.94 5.85 -0.93 -3.37 115.31 114.24 1h2t h LEU 382 Ca -0.00 0.00 -0.52 0.00 0.84 0.00 0.00 57.88 58.20 1h2t h LEU 382 Cb 0.74 0.00 -0.41 0.00 0.37 0.00 0.00 40.66 41.36 1h2t h LEU 382 CO 0.05 0.80 -0.95 0.00 -0.34 0.00 0.00 178.44 178.00 1h2t n GLN 383 N -3.12 2.02 -0.18 1.25 1.13 -0.46 -4.95 117.38 113.07 1h2t n GLN 383 Ca -0.07 -4.02 0.24 0.00 -1.94 0.00 0.00 57.00 51.21 1h2t n GLN 383 Cb 0.91 -1.91 0.64 0.00 0.11 0.00 0.00 30.24 29.99 1h2t n GLN 383 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1h2t h PRO 384 N 2.97 0.14 -0.01 -1.09 0.11 -1.56 -0.33 132.00 132.23 1h2t h PRO 384 Ca 0.11 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1h2t h PRO 384 Cb 0.80 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1h2t h PRO 384 CO 0.65 0.10 -0.05 0.41 -0.21 0.00 0.00 178.00 178.89 1h2t n GLY 385 N -1.63 -0.23 0.00 -0.55 0.00 -1.26 -4.62 105.19 96.90 1h2t n GLY 385 Ca 0.18 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1h2t n GLY 385 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h2t n SER 386 N -0.11 0.00 0.02 1.61 3.41 -0.70 -4.94 113.62 112.91 1h2t n SER 386 Ca 0.18 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.67 1h2t n SER 386 Cb 0.33 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.21 1h2t n SER 386 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1h2t h LEU 387 N 0.00 0.04 -1.40 1.04 7.12 -1.36 -2.77 115.31 117.99 1h2t h LEU 387 Ca 0.00 -0.12 0.22 0.00 0.13 0.00 0.00 57.88 58.11 1h2t h LEU 387 Cb 0.00 -0.01 -0.08 0.00 -0.53 0.00 0.00 40.66 40.04 1h2t h LEU 387 CO 0.00 0.14 0.62 -0.65 -0.13 0.00 0.00 178.44 178.42 1h2t h PRO 388 N -0.07 0.45 -0.11 5.25 0.11 -1.82 -0.09 132.00 135.72 1h2t h PRO 388 Ca 0.01 -0.03 -0.22 0.00 0.11 0.00 0.00 66.00 65.87 1h2t h PRO 388 Cb 0.11 -0.10 0.01 0.00 0.11 0.00 0.00 31.00 31.14 1h2t h PRO 388 CO -0.00 0.30 -0.80 1.96 -0.21 0.00 0.00 178.00 179.25 1h2t h GLN 389 N 0.46 0.73 -0.36 1.05 7.50 -1.88 -1.13 115.11 121.48 1h2t h GLN 389 Ca 0.52 -0.64 -0.06 0.00 0.50 0.00 0.00 58.65 58.96 1h2t h GLN 389 Cb 1.22 0.15 -0.02 0.00 0.05 0.00 0.00 27.48 28.88 1h2t h GLN 389 CO -0.24 1.25 -0.05 0.28 -1.50 0.00 0.00 178.83 178.57 1h2t h VAL 390 N 0.44 1.22 -0.17 -0.54 2.07 -0.98 -1.71 116.25 116.58 1h2t h VAL 390 Ca -0.07 -0.93 -0.20 0.00 0.82 0.00 0.00 66.70 66.31 1h2t h VAL 390 Cb 1.44 1.00 0.01 0.00 -1.52 0.00 0.00 31.29 32.22 1h2t h VAL 390 CO 0.16 0.32 -0.69 0.25 0.02 0.00 0.00 177.57 177.63 1h2t h LEU 391 N 0.56 0.90 -0.88 2.57 5.85 -1.00 -0.88 115.31 122.43 1h2t h LEU 391 Ca 0.11 -0.61 -0.05 0.00 0.84 0.00 0.00 57.88 58.17 1h2t h LEU 391 Cb 0.42 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 1h2t h LEU 391 CO 0.02 1.36 0.26 0.00 -0.34 0.00 0.00 178.44 179.74 1h2t h ALA 392 N 0.56 1.10 -0.22 1.25 0.00 -1.07 -0.18 119.26 120.70 1h2t h ALA 392 Ca -0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1h2t h ALA 392 Cb 1.31 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1h2t h ALA 392 CO 0.14 0.63 0.07 0.37 0.00 0.00 0.00 179.25 180.46 1h2t h GLN 393 N 1.06 0.34 -0.72 0.00 4.15 -1.21 -0.91 115.11 117.81 1h2t h GLN 393 Ca 0.24 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.55 1h2t h GLN 393 Cb 0.24 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.84 1h2t h GLN 393 CO -0.02 0.43 0.31 0.00 -1.93 0.00 0.00 178.83 177.63 1h2t h ALA 394 N 0.89 1.19 -0.27 3.38 0.00 -0.84 0.08 119.26 123.69 1h2t h ALA 394 Ca 0.07 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1h2t h ALA 394 Cb 0.24 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1h2t h ALA 394 CO -0.00 0.60 -0.10 1.15 0.00 0.00 0.00 179.25 180.90 1h2t h THR 395 N 1.04 1.21 -0.16 0.00 2.02 -0.76 0.13 112.91 116.39 1h2t h THR 395 Ca 0.25 -0.92 -0.06 0.00 0.77 0.00 0.00 66.41 66.45 1h2t h THR 395 Cb 0.16 1.12 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1h2t h THR 395 CO -0.03 0.30 -0.12 -0.08 0.37 0.00 0.00 175.52 175.96 1h2t h GLU 396 N 0.41 0.36 -0.30 6.66 4.57 -0.22 -2.38 114.58 123.68 1h2t h GLU 396 Ca 0.08 -0.18 -0.00 0.00 -1.18 0.00 0.00 59.36 58.08 1h2t h GLU 396 Cb 0.43 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 1h2t h GLU 396 CO 0.02 0.72 0.19 0.52 -1.18 0.00 0.00 179.01 179.27 1h2t h MET 397 N 0.01 0.40 -0.78 1.92 2.86 -0.50 -1.64 114.93 117.20 1h2t h MET 397 Ca 0.03 -0.03 0.05 0.00 -2.06 0.00 0.00 59.70 57.69 1h2t h MET 397 Cb 0.63 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 32.15 1h2t h MET 397 CO 0.03 0.30 0.47 -0.07 1.06 0.00 0.00 176.91 178.70 1h2t h LEU 398 N 0.39 0.75 0.07 1.22 3.38 -0.77 -1.95 115.31 118.39 1h2t h LEU 398 Ca 0.11 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1h2t h LEU 398 Cb -0.01 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1h2t h LEU 398 CO -0.02 0.49 -0.05 0.22 0.09 0.00 0.00 178.44 179.17 1h2t h TYR 399 N 0.88 -0.14 0.00 1.13 3.20 -1.07 -2.59 116.97 118.39 1h2t h TYR 399 Ca 0.33 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.20 1h2t h TYR 399 Cb 0.13 0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1h2t h TYR 399 CO -0.04 -0.09 0.00 -1.33 -1.64 0.00 0.00 178.16 175.06 1h2t n MET 400 N -5.16 0.06 -0.16 1.82 2.81 -0.65 -2.02 117.12 113.82 1h2t n MET 400 Ca -0.07 0.40 0.05 0.00 -1.81 0.00 0.00 57.70 56.27 1h2t n MET 400 Cb 0.09 -1.64 0.14 0.00 -0.71 0.00 0.00 33.22 31.10 1h2t n MET 400 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1h2t n ARG 401 N -1.77 2.74 0.30 0.03 1.74 -0.78 -4.70 116.66 114.22 1h2t n ARG 401 Ca 0.02 -1.99 0.18 0.00 -0.77 0.00 0.00 57.85 55.30 1h2t n ARG 401 Cb 0.12 -1.26 1.01 0.00 -1.02 0.00 0.00 32.46 31.31 1h2t n ARG 401 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1h2t h LEU 402 N 1.98 0.00 -0.99 0.55 3.38 -1.06 -3.21 115.31 115.95 1h2t h LEU 402 Ca 0.00 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 1h2t h LEU 402 Cb 0.71 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.39 1h2t h LEU 402 CO 0.00 0.00 0.64 0.44 0.09 0.00 0.00 178.44 179.61 1h2t h ASP 403 N 0.00 1.01 -0.37 -0.43 3.32 -1.84 -2.76 116.42 115.35 1h2t h ASP 403 Ca 0.02 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1h2t h ASP 403 Cb 0.15 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1h2t h ASP 403 CO -0.00 0.62 0.00 0.35 -1.72 0.00 0.00 179.24 178.49 1h2t n THR 404 N -4.53 1.64 -2.52 0.35 -2.24 -1.21 -4.94 114.28 100.83 1h2t n THR 404 Ca 0.16 -1.37 -0.41 0.00 -2.27 0.00 0.00 64.05 60.16 1h2t n THR 404 Cb 0.21 0.15 -0.04 0.00 -2.10 0.00 0.00 70.33 68.55 1h2t n THR 404 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1h2t s MET 405 N -1.85 4.55 0.29 -0.78 0.00 -1.04 -1.95 119.30 118.52 1h2t s MET 405 Ca 0.36 1.69 -0.30 0.00 0.00 0.00 0.00 55.69 57.44 1h2t s MET 405 Cb 0.24 -3.32 -0.11 0.00 0.00 0.00 0.00 34.83 31.65 1h2t s MET 405 CO 0.15 -0.02 1.53 1.21 0.00 0.00 0.00 175.02 177.89 1h2t s ASN 406 N 0.31 6.47 0.37 1.11 3.84 -0.07 -4.79 114.94 122.17 1h2t s ASN 406 Ca 0.52 2.86 0.15 0.00 0.21 0.00 0.00 52.86 56.61 1h2t s ASN 406 Cb -0.28 -2.63 1.02 0.00 -0.55 0.00 0.00 41.25 38.81 1h2t s ASN 406 CO 0.32 -0.83 1.76 0.74 -2.79 0.00 0.00 177.10 176.30 1h2t h THR 407 N 3.39 0.53 -0.30 -5.21 2.02 -1.91 -0.51 112.91 110.92 1h2t h THR 407 Ca -0.47 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 66.53 1h2t h THR 407 Cb 1.22 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1h2t h THR 407 CO 0.77 0.08 0.11 0.74 0.37 0.00 0.00 175.52 177.59 1h2t h THR 408 N 0.46 1.19 -0.52 3.16 2.02 -1.90 -1.98 112.91 115.33 1h2t h THR 408 Ca 0.61 -0.59 -0.08 0.00 0.77 0.00 0.00 66.41 67.13 1h2t h THR 408 Cb 1.40 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.81 1h2t h THR 408 CO -0.35 0.20 0.02 0.00 0.37 0.00 0.00 175.52 175.75 1h2t h VAL 410 N 0.82 1.24 -0.81 0.00 2.07 -1.03 -1.19 116.25 117.35 1h2t h VAL 410 Ca 0.16 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.16 1h2t h VAL 410 Cb 0.46 0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 1h2t h VAL 410 CO 0.02 0.26 0.51 0.44 0.02 0.00 0.00 177.57 178.82 1h2t h ASP 411 N 1.19 0.83 0.01 0.57 5.19 -1.09 0.71 116.42 123.83 1h2t h ASP 411 Ca 0.31 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.58 1h2t h ASP 411 Cb -0.02 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.31 1h2t h ASP 411 CO -0.05 0.56 -0.44 0.03 -3.12 0.00 0.00 179.24 176.22 1h2t h ARG 412 N 0.98 0.52 0.35 3.56 3.08 -1.28 -1.42 114.38 120.17 1h2t h ARG 412 Ca 0.33 -0.28 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 1h2t h ARG 412 Cb 0.06 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1h2t h ARG 412 CO -0.13 0.86 -0.17 0.35 -1.07 0.00 0.00 179.97 179.81 1h2t h PHE 413 N 0.42 -0.44 -0.54 3.04 3.57 -0.80 0.64 116.94 122.84 1h2t h PHE 413 Ca 0.03 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.61 1h2t h PHE 413 Cb 0.94 0.14 -0.07 0.00 2.79 0.00 0.00 35.95 39.75 1h2t h PHE 413 CO 0.04 -0.16 0.12 0.82 -2.23 0.00 0.00 178.31 176.90 1h2t h ILE 414 N -0.67 0.70 -0.16 1.41 2.04 -0.82 0.13 117.51 120.14 1h2t h ILE 414 Ca -0.05 -0.09 -0.11 0.00 1.00 0.00 0.00 64.86 65.61 1h2t h ILE 414 Cb 0.47 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1h2t h ILE 414 CO 0.08 0.05 -0.39 0.78 0.00 0.00 0.00 178.15 178.66 1h2t h ASN 415 N 0.26 0.38 0.29 1.72 2.35 -1.14 -2.41 115.58 117.02 1h2t h ASN 415 Ca 0.27 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 1h2t h ASN 415 Cb 0.37 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1h2t h ASN 415 CO -0.34 0.74 -0.14 -0.25 -1.65 0.00 0.00 177.43 175.78 1h2t h TRP 416 N 0.30 -0.36 -0.39 1.19 7.01 -0.07 -2.85 115.95 120.79 1h2t h TRP 416 Ca 0.03 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.10 1h2t h TRP 416 Cb 0.83 0.12 -0.09 0.00 -2.10 0.00 0.00 29.16 27.92 1h2t h TRP 416 CO 0.02 -0.07 -0.21 0.35 -2.79 0.00 0.00 178.44 175.74 1h2t h PHE 417 N -1.01 -0.54 -0.53 2.65 3.57 -0.84 0.47 116.94 120.71 1h2t h PHE 417 Ca -0.04 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1h2t h PHE 417 Cb 0.45 0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 1h2t h PHE 417 CO 0.04 -0.29 0.32 0.66 -2.23 0.00 0.00 178.31 176.80 1h2t h SER 418 N -0.14 0.63 -0.49 0.41 4.64 -1.56 0.25 113.55 117.27 1h2t h SER 418 Ca 0.19 -0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 61.43 1h2t h SER 418 Cb 0.44 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.35 1h2t h SER 418 CO -0.48 0.50 0.20 -0.74 -0.87 0.00 0.00 176.83 175.44 1h2t h HIS 419 N 0.71 0.75 -0.10 4.77 -0.00 -1.09 -1.69 115.15 118.49 1h2t h HIS 419 Ca 0.19 -0.05 0.02 0.00 -0.00 0.00 0.00 60.37 60.53 1h2t h HIS 419 Cb -0.02 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 27.14 1h2t h HIS 419 CO -0.03 0.62 -0.04 1.25 -0.00 0.00 0.00 177.93 179.74 1h2t h HIS 420 N 0.66 -0.08 -0.86 5.26 6.17 0.41 -2.49 115.15 124.21 1h2t h HIS 420 Ca 0.17 0.01 0.10 0.00 0.71 0.00 0.00 60.37 61.36 1h2t h HIS 420 Cb 0.18 0.05 -0.06 0.00 2.52 0.00 0.00 27.41 30.10 1h2t h HIS 420 CO 0.00 -0.06 0.56 -0.07 0.71 0.00 0.00 177.93 179.07 1h2t h LEU 421 N -0.02 0.75 -0.56 0.26 3.38 -0.22 -0.43 115.31 118.46 1h2t h LEU 421 Ca 0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1h2t h LEU 421 Cb 0.10 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1h2t h LEU 421 CO -0.12 0.44 0.00 -1.54 0.09 0.00 0.00 178.44 177.31 1h2t n SER 422 N -4.52 0.45 -0.61 -0.43 3.41 -0.66 0.21 113.62 111.47 1h2t n SER 422 Ca 0.15 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.50 1h2t n SER 422 Cb 0.33 -0.71 0.13 0.00 -0.26 0.00 0.00 64.21 63.69 1h2t n SER 422 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1h2t n ASN 423 N -2.01 2.15 -2.62 4.04 3.02 -0.18 -4.38 115.26 115.28 1h2t n ASN 423 Ca 0.02 -1.58 -0.13 0.00 -0.03 0.00 0.00 54.58 52.86 1h2t n ASN 423 Cb 0.18 0.23 0.02 0.00 -0.61 0.00 0.00 39.78 39.61 1h2t n ASN 423 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1h2t n PHE 424 N 0.34 1.71 -1.96 3.10 3.72 -0.78 -4.98 117.46 118.61 1h2t n PHE 424 Ca 0.12 -2.80 -0.15 0.00 -0.05 0.00 0.00 57.45 54.57 1h2t n PHE 424 Cb 0.48 -0.30 -0.03 0.00 -0.94 0.00 0.00 39.48 38.69 1h2t n PHE 424 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1h2t n GLN 425 N -0.21 -1.72 -1.97 -1.08 3.00 -1.20 -2.02 117.38 112.17 1h2t n GLN 425 Ca 0.16 0.80 -0.15 0.00 -0.01 0.00 0.00 57.00 57.80 1h2t n GLN 425 Cb 0.79 -5.26 -0.03 0.00 0.00 0.00 0.00 30.24 25.74 1h2t n GLN 425 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1h2t n PHE 426 N -2.84 -0.83 -2.54 1.08 3.72 0.13 -4.91 117.46 111.28 1h2t n PHE 426 Ca -0.16 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.81 1h2t n PHE 426 Cb 0.57 -2.96 -0.03 0.00 -0.94 0.00 0.00 39.48 36.12 1h2t n PHE 426 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1h2t s ARG 427 N -4.22 4.42 -0.18 -1.08 0.52 -0.86 -5.00 118.95 112.56 1h2t s ARG 427 Ca 0.00 1.60 -0.29 0.00 -0.52 0.00 0.00 55.73 56.52 1h2t s ARG 427 Cb 0.00 -3.48 0.12 0.00 0.52 0.00 0.00 34.95 32.10 1h2t s ARG 427 CO 0.00 -0.30 0.96 -0.46 0.02 0.00 0.00 175.30 175.51 1h2t s TRP 428 N 1.66 -0.44 -1.29 -0.53 -0.11 -1.26 -5.00 118.94 111.96 1h2t s TRP 428 Ca 0.55 0.86 -0.10 0.00 1.22 0.00 0.00 56.10 58.62 1h2t s TRP 428 Cb -0.24 0.42 0.15 0.00 -1.50 0.00 0.00 33.47 32.30 1h2t s TRP 428 CO 0.24 -0.35 1.86 -1.13 -4.62 0.00 0.00 176.95 172.95 1h2t n SER 429 N 1.15 4.98 -0.23 5.86 3.41 -1.26 -4.83 113.62 122.71 1h2t n SER 429 Ca -0.12 -3.07 0.22 0.00 -0.26 0.00 0.00 58.87 55.64 1h2t n SER 429 Cb 0.57 -1.51 0.57 0.00 -0.26 0.00 0.00 64.21 63.58 1h2t n SER 429 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1h2t h TRP 430 N 5.95 0.40 -0.01 7.33 4.06 -1.98 -0.31 115.95 131.39 1h2t h TRP 430 Ca 0.40 0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.37 1h2t h TRP 430 Cb 0.66 -0.12 -0.00 0.00 -1.00 0.00 0.00 29.16 28.70 1h2t h TRP 430 CO 1.26 0.09 0.09 1.05 -3.56 0.00 0.00 178.44 177.38 1h2t h GLU 431 N 0.29 0.00 0.00 0.49 9.09 -2.00 0.40 114.58 122.85 1h2t h GLU 431 Ca 0.47 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.88 1h2t h GLU 431 Cb 1.35 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.45 1h2t h GLU 431 CO -0.14 0.00 0.00 -0.25 0.05 0.00 0.00 179.01 178.67 1h2t n ASP 432 N -3.14 0.48 -0.85 3.06 9.92 -0.13 -2.63 116.55 123.26 1h2t n ASP 432 Ca -0.02 0.61 0.01 0.00 -0.53 0.00 0.00 54.79 54.86 1h2t n ASP 432 Cb 0.16 -0.71 0.20 0.00 -0.64 0.00 0.00 41.12 40.13 1h2t n ASP 432 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 1h2t n TRP 433 N -2.02 0.53 0.26 1.24 8.01 0.14 -4.70 117.44 120.91 1h2t n TRP 433 Ca 0.03 -1.52 0.14 0.00 -1.31 0.00 0.00 57.50 54.84 1h2t n TRP 433 Cb 0.23 -0.36 0.70 0.00 -2.01 0.00 0.00 31.31 29.87 1h2t n TRP 433 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 1h2t h SER 434 N 0.98 0.00 0.00 -0.99 0.02 -1.54 -2.98 113.55 109.05 1h2t h SER 434 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1h2t h SER 434 Cb 1.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 1h2t h SER 434 CO 0.19 0.12 0.21 -0.90 -1.14 0.00 0.00 176.83 175.30 1h2t n ASP 435 N -3.46 0.36 0.09 3.07 5.75 -1.26 -0.50 116.55 120.60 1h2t n ASP 435 Ca -0.01 0.59 0.03 0.00 -0.01 0.00 0.00 54.79 55.38 1h2t n ASP 435 Cb 0.28 -0.57 -0.02 0.00 -1.03 0.00 0.00 41.12 39.77 1h2t n ASP 435 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1h2t h LEU 437 N 0.00 0.18 -2.20 0.00 3.38 -1.02 -2.50 115.31 113.15 1h2t h LEU 437 Ca -0.08 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1h2t h LEU 437 Cb 1.42 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1h2t h LEU 437 CO 0.05 0.34 0.00 -1.54 0.09 0.00 0.00 178.44 177.37 1h2t n SER 438 N -4.28 3.31 -4.86 -0.43 3.41 -1.25 -4.93 113.62 104.58 1h2t n SER 438 Ca -0.01 -2.26 -0.22 0.00 -0.26 0.00 0.00 58.87 56.12 1h2t n SER 438 Cb 0.26 -0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 63.72 1h2t n SER 438 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1h2t s GLN 439 N -1.68 2.44 0.16 4.33 -0.21 -0.94 -5.06 119.66 118.69 1h2t s GLN 439 Ca 0.35 -1.66 -0.31 0.00 0.02 0.00 0.00 55.36 53.76 1h2t s GLN 439 Cb 0.22 -2.28 -0.10 0.00 1.00 0.00 0.00 33.01 31.85 1h2t s GLN 439 CO 0.18 -0.25 1.65 0.34 -2.12 0.00 0.00 175.29 175.09 1h2t s ASP 440 N -4.12 6.51 0.61 5.90 -1.08 -1.26 -4.85 116.67 118.38 1h2t s ASP 440 Ca 0.45 2.68 0.28 0.00 -0.52 0.00 0.00 52.55 55.45 1h2t s ASP 440 Cb -0.02 -2.59 1.53 0.00 -1.46 0.00 0.00 42.92 40.38 1h2t s ASP 440 CO 0.26 -0.89 1.85 -0.65 0.52 0.00 0.00 175.17 176.26 1h2t h PRO 441 N 7.21 0.00 0.00 4.34 0.11 -1.95 0.20 132.00 141.91 1h2t h PRO 441 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1h2t h PRO 441 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1h2t h PRO 441 CO 0.93 0.00 -0.81 0.39 -0.21 0.00 0.00 178.00 178.30 1h2t n GLU 442 N -2.76 0.36 -1.59 1.05 1.02 -1.26 -3.95 120.64 113.51 1h2t n GLU 442 Ca -0.02 0.07 -0.36 0.00 -0.02 0.00 0.00 57.16 56.83 1h2t n GLU 442 Cb 0.35 -1.69 0.08 0.00 -0.02 0.00 0.00 31.44 30.16 1h2t n GLU 442 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1h2t n SER 443 N -2.20 1.82 -0.12 1.62 2.88 0.72 -4.78 113.62 113.56 1h2t n SER 443 Ca 0.02 0.77 -0.12 0.00 -1.33 0.00 0.00 58.87 58.22 1h2t n SER 443 Cb 0.46 -1.54 -0.07 0.00 -0.75 0.00 0.00 64.21 62.31 1h2t n SER 443 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1h2t h PRO 444 N 0.20 -0.36 0.32 -1.46 0.11 -1.89 -2.09 132.00 126.83 1h2t h PRO 444 Ca -0.50 0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1h2t h PRO 444 Cb 1.33 0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.50 1h2t h PRO 444 CO 0.51 -0.24 -0.32 0.87 -0.21 0.00 0.00 178.00 178.61 1h2t h LYS 445 N -0.38 -0.65 -0.58 1.05 1.57 -1.90 0.27 116.57 115.95 1h2t h LYS 445 Ca 0.11 0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.90 1h2t h LYS 445 Cb 0.60 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.03 1h2t h LYS 445 CO -0.57 -0.43 0.21 -1.00 -0.57 0.00 0.00 179.45 177.10 1h2t h PRO 446 N -0.67 0.85 -0.62 3.15 0.13 -1.79 -1.41 132.00 131.64 1h2t h PRO 446 Ca -0.02 -0.14 -0.05 0.00 -0.87 0.00 0.00 66.00 64.93 1h2t h PRO 446 Cb 0.61 -0.15 -0.03 0.00 0.13 0.00 0.00 31.00 31.57 1h2t h PRO 446 CO -0.06 0.71 0.21 -0.22 -0.23 0.00 0.00 178.00 178.41 1h2t h LYS 447 N 0.84 0.96 0.10 0.86 3.64 -1.11 -1.48 116.57 120.37 1h2t h LYS 447 Ca 0.20 -0.20 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1h2t h LYS 447 Cb 0.19 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1h2t h LYS 447 CO -0.01 0.84 -0.15 0.35 -2.27 0.00 0.00 179.45 178.20 1h2t h PHE 448 N 0.89 -0.39 -0.53 1.91 3.57 0.12 -0.35 116.94 122.16 1h2t h PHE 448 Ca 0.20 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.77 1h2t h PHE 448 Cb 0.26 0.16 -0.06 0.00 2.79 0.00 0.00 35.95 39.11 1h2t h PHE 448 CO 0.02 -0.23 0.22 0.28 -2.23 0.00 0.00 178.31 176.37 1h2t h VAL 449 N -0.30 0.86 -0.89 1.41 2.07 -1.11 0.29 116.25 118.58 1h2t h VAL 449 Ca 0.02 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1h2t h VAL 449 Cb 0.31 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 1h2t h VAL 449 CO -0.08 0.08 0.50 0.03 0.02 0.00 0.00 177.57 178.12 1h2t h ARG 450 N 0.42 1.24 -0.43 1.57 3.08 -0.85 -0.41 114.38 119.01 1h2t h ARG 450 Ca 0.25 -0.14 -0.14 0.00 0.07 0.00 0.00 59.98 60.03 1h2t h ARG 450 Cb 0.24 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1h2t h ARG 450 CO -0.23 0.90 -0.26 0.93 -1.07 0.00 0.00 179.97 180.24 1h2t h GLU 451 N 1.24 0.93 0.09 0.04 4.39 -0.30 -1.36 114.58 119.62 1h2t h GLU 451 Ca 0.32 -0.43 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 1h2t h GLU 451 Cb 0.01 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1h2t h GLU 451 CO -0.05 1.09 -0.05 0.28 -1.16 0.00 0.00 179.01 179.12 1h2t h VAL 452 N 0.76 0.91 -0.93 3.13 2.07 -0.57 0.93 116.25 122.55 1h2t h VAL 452 Ca 0.09 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.65 1h2t h VAL 452 Cb 0.85 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.46 1h2t h VAL 452 CO 0.07 0.00 0.61 -0.07 0.02 0.00 0.00 177.57 178.20 1h2t h LEU 453 N -0.13 0.98 -0.61 2.57 3.38 -1.06 0.27 115.31 120.71 1h2t h LEU 453 Ca -0.01 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1h2t h LEU 453 Cb 0.10 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1h2t h LEU 453 CO 0.02 0.65 0.14 -0.08 0.09 0.00 0.00 178.44 179.26 1h2t h GLU 454 N 1.13 0.99 -0.30 1.13 4.81 -0.71 -1.50 114.58 120.12 1h2t h GLU 454 Ca 0.38 -0.25 -0.12 0.00 -0.13 0.00 0.00 59.36 59.24 1h2t h GLU 454 Cb 0.08 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 1h2t h GLU 454 CO -0.13 0.91 -0.32 0.87 -0.73 0.00 0.00 179.01 179.61 1h2t h LYS 455 N 0.90 0.65 -0.63 1.92 1.79 0.38 -2.84 116.57 118.75 1h2t h LYS 455 Ca 0.19 -0.30 -0.07 0.00 -2.18 0.00 0.00 60.65 58.29 1h2t h LYS 455 Cb 0.37 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.98 1h2t h LYS 455 CO 0.00 0.89 0.10 0.00 -1.08 0.00 0.00 179.45 179.36 1h2t h MET 457 N 0.97 0.98 0.00 0.00 1.85 -1.08 -1.43 114.93 116.22 1h2t h MET 457 Ca 0.19 -0.13 -0.02 0.00 -0.61 0.00 0.00 59.70 59.14 1h2t h MET 457 Cb 0.42 -0.19 -0.00 0.00 0.43 0.00 0.00 31.60 32.26 1h2t h MET 457 CO 0.01 0.75 -0.08 0.00 -0.40 0.00 0.00 176.91 177.19 1h2t h ARG 458 N 0.98 0.00 -0.04 0.39 3.08 -1.27 0.35 114.38 117.87 1h2t h ARG 458 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1h2t h ARG 458 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1h2t h ARG 458 CO -0.03 0.08 0.00 1.28 -1.07 0.00 0.00 179.97 180.23 1h2t n LEU 459 N -3.66 2.21 0.00 3.04 4.77 -0.59 -4.92 117.00 117.85 1h2t n LEU 459 Ca -0.02 -0.75 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 1h2t n LEU 459 Cb 0.19 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1h2t n LEU 459 CO 0.29 0.38 0.00 -0.24 -1.33 0.00 0.00 177.39 176.48 1h2t n SER 460 N 0.72 0.00 -3.61 -1.43 2.88 0.07 -5.09 113.62 107.16 1h2t n SER 460 Ca 0.17 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.64 1h2t n SER 460 Cb 0.47 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.91 1h2t n SER 460 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1h2t s TYR 461 N 2.03 -0.27 0.09 0.66 1.13 -0.97 -4.96 117.35 115.06 1h2t s TYR 461 Ca 0.00 0.04 -0.29 0.00 -1.41 0.00 0.00 57.07 55.41 1h2t s TYR 461 Cb 0.00 0.59 -0.12 0.00 -1.10 0.00 0.00 41.96 41.33 1h2t s TYR 461 CO 0.00 -0.72 1.47 1.25 -2.51 0.00 0.00 175.55 175.04 1h2t h HIS 462 N 2.00 -1.31 -0.53 -3.49 -0.00 -1.94 -2.62 115.15 107.26 1h2t h HIS 462 Ca -0.24 0.04 0.07 0.00 -0.00 0.00 0.00 60.37 60.24 1h2t h HIS 462 Cb 1.24 0.56 -0.03 0.00 -0.00 0.00 0.00 27.41 29.18 1h2t h HIS 462 CO 0.31 -0.51 0.35 0.37 -0.00 0.00 0.00 177.93 178.46 1h2t h GLN 463 N -0.63 0.42 0.44 5.26 5.75 -1.98 -0.97 115.11 123.39 1h2t h GLN 463 Ca -0.00 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.45 1h2t h GLN 463 Cb 0.64 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.10 1h2t h GLN 463 CO -0.25 0.28 -0.21 -0.09 -2.65 0.00 0.00 178.83 175.90 1h2t h ARG 464 N 0.43 -0.56 -0.16 1.69 1.12 -1.90 -2.53 114.38 112.46 1h2t h ARG 464 Ca 0.23 0.04 -0.06 0.00 -1.11 0.00 0.00 59.98 59.08 1h2t h ARG 464 Cb 0.37 0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 30.44 1h2t h ARG 464 CO -0.06 -0.36 -0.17 0.82 -3.11 0.00 0.00 179.97 177.09 1h2t h ILE 465 N -0.62 1.21 0.00 1.20 1.08 -1.11 -1.99 117.51 117.27 1h2t h ILE 465 Ca -0.06 -0.93 0.00 0.00 -0.39 0.00 0.00 64.86 63.48 1h2t h ILE 465 Cb 0.47 1.27 0.00 0.00 -3.07 0.00 0.00 36.82 35.49 1h2t h ILE 465 CO 0.10 0.29 0.00 0.25 -0.69 0.00 0.00 178.15 178.10 1h2t h LEU 466 N 0.25 0.00 0.00 1.44 5.85 -0.99 -3.00 115.31 118.87 1h2t h LEU 466 Ca 0.05 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.52 1h2t h LEU 466 Cb 0.45 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.44 1h2t h LEU 466 CO 0.03 0.00 -2.01 0.47 -0.34 0.00 0.00 178.44 176.59 1h2t n ASP 467 N -2.97 0.32 0.06 1.25 8.00 -0.78 -4.23 116.55 118.19 1h2t n ASP 467 Ca 0.00 0.14 0.12 0.00 0.71 0.00 0.00 54.79 55.76 1h2t n ASP 467 Cb 0.25 0.83 0.47 0.00 -0.02 0.00 0.00 41.12 42.65 1h2t n ASP 467 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1h2t n ILE 468 N -2.74 0.51 -4.17 0.53 -5.35 -1.01 -4.79 119.36 102.34 1h2t n ILE 468 Ca -0.21 -0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 61.96 1h2t n ILE 468 Cb 0.97 -0.73 -0.08 0.00 -1.74 0.00 0.00 39.64 38.06 1h2t n ILE 468 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1h2t s VAL 469 N -3.09 4.19 0.80 7.28 -7.23 -1.19 -4.89 120.40 116.26 1h2t s VAL 469 Ca 0.10 -0.78 -0.13 0.00 -1.81 0.00 0.00 61.98 59.35 1h2t s VAL 469 Cb 0.13 -2.95 0.08 0.00 0.56 0.00 0.00 36.38 34.20 1h2t s VAL 469 CO 0.48 0.23 1.21 -2.84 -0.31 0.00 0.00 175.10 173.86 1h2t s PRO 470 N -2.02 1.71 0.40 4.82 0.02 -1.26 -4.85 135.00 133.81 1h2t s PRO 470 Ca 0.24 1.76 0.14 0.00 0.02 0.00 0.00 61.00 63.15 1h2t s PRO 470 Cb -0.12 -1.78 0.98 0.00 0.02 0.00 0.00 34.50 33.59 1h2t s PRO 470 CO 0.16 -2.16 1.89 -1.35 -0.33 0.00 0.00 177.00 175.20 1h2t h PRO 471 N -0.81 0.50 0.00 5.54 0.11 -1.97 0.58 132.00 135.95 1h2t h PRO 471 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1h2t h PRO 471 Cb 1.30 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1h2t h PRO 471 CO 0.47 0.33 0.00 0.25 -0.21 0.00 0.00 178.00 178.84 1h2t n THR 472 N -4.52 0.00 0.10 -1.15 -2.24 -1.26 -2.15 114.28 103.06 1h2t n THR 472 Ca 0.17 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.96 1h2t n THR 472 Cb 0.55 -0.75 0.01 0.00 -2.10 0.00 0.00 70.33 68.04 1h2t n THR 472 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1h2t n PHE 473 N -0.97 0.00 -0.08 4.78 3.01 0.19 -4.68 117.46 119.70 1h2t n PHE 473 Ca 0.10 0.00 0.23 0.00 1.01 0.00 0.00 57.45 58.79 1h2t n PHE 473 Cb 0.05 0.00 0.68 0.00 -0.01 0.00 0.00 39.48 40.20 1h2t n PHE 473 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1h2t h SER 474 N 0.43 0.04 -0.35 4.37 4.64 -1.43 -0.19 113.55 121.07 1h2t h SER 474 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 1h2t h SER 474 Cb 0.10 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1h2t h SER 474 CO 0.00 0.02 -0.32 0.00 -0.87 0.00 0.00 176.83 175.66 1h2t h ALA 475 N 1.66 0.69 0.00 5.18 0.00 -1.83 -2.91 119.26 122.05 1h2t h ALA 475 Ca 0.33 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1h2t h ALA 475 Cb 1.26 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1h2t h ALA 475 CO -0.02 0.67 0.00 1.28 0.00 0.00 0.00 179.25 181.18 1h2t n LEU 476 N -4.07 0.00 -4.82 0.00 4.32 -0.10 -4.83 117.00 107.50 1h2t n LEU 476 Ca -0.01 0.17 -0.33 0.00 -0.02 0.00 0.00 56.01 55.82 1h2t n LEU 476 Cb 0.50 -0.17 -0.03 0.00 -1.62 0.00 0.00 43.42 42.11 1h2t n LEU 476 CO 0.47 -0.04 0.69 0.00 -1.22 0.00 0.00 177.39 177.29 1h2t s PRO 478 N -3.88 4.48 0.95 0.00 0.04 -1.26 -5.01 135.00 130.31 1h2t s PRO 478 Ca 0.61 1.96 -0.11 0.00 0.04 0.00 0.00 61.00 63.50 1h2t s PRO 478 Cb -0.12 -3.09 0.16 0.00 0.04 0.00 0.00 34.50 31.49 1h2t s PRO 478 CO 0.29 0.01 1.09 -1.54 0.04 0.00 0.00 177.00 176.90 1h2t s SER 479 N -0.76 2.85 -0.09 6.66 1.04 -1.26 -4.91 113.70 117.22 1h2t s SER 479 Ca 0.47 1.73 -0.30 0.00 0.48 0.00 0.00 55.95 58.33 1h2t s SER 479 Cb -0.35 -2.35 -0.03 0.00 0.10 0.00 0.00 66.02 63.39 1h2t s SER 479 CO 0.45 -3.07 1.32 0.21 0.98 0.00 0.00 173.24 173.14 1h2t s ASN 480 N -3.00 6.92 -0.56 7.02 2.47 -1.26 -4.90 114.94 121.62 1h2t s ASN 480 Ca 0.65 1.87 -0.17 0.00 0.42 0.00 0.00 52.86 55.63 1h2t s ASN 480 Cb -0.21 -2.55 -0.15 0.00 -1.45 0.00 0.00 41.25 36.89 1h2t s ASN 480 CO 0.59 -0.73 1.79 -0.81 -3.72 0.00 0.00 177.10 174.22 1h2t n PRO 481 N 6.11 1.18 -3.91 0.43 -0.04 -1.25 -4.90 135.00 132.62 1h2t n PRO 481 Ca 0.13 -1.42 -0.36 0.00 -0.04 0.00 0.00 63.50 61.81 1h2t n PRO 481 Cb 0.45 -2.61 -0.06 0.00 -0.04 0.00 0.00 33.50 31.24 1h2t n PRO 481 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1h2t s THR 482 N 4.98 5.43 0.97 0.52 -4.23 -1.26 -4.77 115.64 117.28 1h2t s THR 482 Ca 0.48 0.12 -0.11 0.00 -1.18 0.00 0.00 61.69 61.00 1h2t s THR 482 Cb 0.12 -3.39 0.17 0.00 1.34 0.00 0.00 72.50 70.73 1h2t s THR 482 CO 0.11 0.57 1.08 0.00 -0.54 0.00 0.00 174.62 175.84 1h2t s ILE 484 N -2.59 0.72 -0.13 0.00 1.01 -0.50 -5.04 121.20 114.67 1h2t s ILE 484 Ca 0.67 -0.15 0.03 0.00 0.00 0.00 0.00 60.65 61.19 1h2t s ILE 484 Cb -0.23 -0.77 0.00 0.00 0.01 0.00 0.00 42.46 41.48 1h2t s ILE 484 CO 0.60 0.30 -0.21 -0.47 0.00 0.00 0.00 174.94 175.15 1h2t s TYR 485 N 1.43 2.66 -0.27 3.97 6.04 -1.26 -4.47 117.35 125.44 1h2t s TYR 485 Ca -0.02 -1.16 0.18 0.00 0.04 0.00 0.00 57.07 56.11 1h2t s TYR 485 Cb -0.13 -1.79 0.17 0.00 -1.04 0.00 0.00 41.96 39.17 1h2t s TYR 485 CO -0.03 -0.50 1.51 -0.22 -1.54 0.00 0.00 175.55 174.76 1h2t h LYS 486 N 7.08 0.00 -0.98 4.97 3.64 -1.93 -3.27 116.57 126.07 1h2t h LYS 486 Ca -0.27 0.00 -0.61 0.00 -1.27 0.00 0.00 60.65 58.50 1h2t h LYS 486 Cb 1.21 0.00 -0.38 0.00 -0.41 0.00 0.00 32.23 32.65 1h2t h LYS 486 CO 0.53 0.30 -0.19 0.66 -2.27 0.00 0.00 179.45 178.48 1h2t n TYR 487 N -3.17 2.98 -0.97 1.91 0.53 -1.26 -4.32 117.16 112.85 1h2t n TYR 487 Ca 0.03 -2.57 0.00 0.00 -1.02 0.00 0.00 57.90 54.34 1h2t n TYR 487 Cb 0.66 -0.69 0.00 0.00 -1.03 0.00 0.00 39.34 38.27 1h2t n TYR 487 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1h2t n GLY 488 N -0.74 1.57 0.34 2.72 0.00 -1.23 -4.85 105.19 102.99 1h2t n GLY 488 Ca 0.50 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.68 1h2t n GLY 488 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h2t n ASP 489 N 0.00 0.70 0.00 1.61 8.00 -1.26 -2.65 116.55 122.95 1h2t n ASP 489 Ca 0.00 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.50 1h2t n ASP 489 Cb 0.00 -0.34 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 1h2t n ASP 489 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1h2t n GLU 490 N -0.16 1.94 -0.20 -1.24 2.13 -1.26 -5.07 120.64 116.78 1h2t n GLU 490 Ca 0.00 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.61 1h2t n GLU 490 Cb 0.17 -0.92 0.20 0.00 0.27 0.00 0.00 31.44 31.17 1h2t n GLU 490 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1h2t n SER 491 N -1.45 -3.45 -4.18 4.31 3.41 -1.08 -5.07 113.62 106.11 1h2t n SER 491 Ca 0.00 -0.59 -0.11 0.00 -0.26 0.00 0.00 58.87 57.90 1h2t n SER 491 Cb 0.17 -0.71 -0.10 0.00 -0.26 0.00 0.00 64.21 63.31 1h2t n SER 491 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1h2t s SER 492 N -2.64 1.25 0.10 4.04 1.04 -1.26 -4.96 113.70 111.27 1h2t s SER 492 Ca 0.45 -0.99 0.19 0.00 0.48 0.00 0.00 55.95 56.08 1h2t s SER 492 Cb -0.08 0.07 0.79 0.00 0.10 0.00 0.00 66.02 66.90 1h2t s SER 492 CO 0.38 -0.43 1.59 -0.46 0.98 0.00 0.00 173.24 175.29 1h2t n ASN 493 N -0.03 0.27 -2.98 7.02 2.04 -1.26 -3.53 115.26 116.79 1h2t n ASN 493 Ca -0.12 0.56 -0.35 0.00 -0.44 0.00 0.00 54.58 54.23 1h2t n ASN 493 Cb 0.61 -0.62 -0.01 0.00 -2.53 0.00 0.00 39.78 37.23 1h2t n ASN 493 CO 0.00 0.00 0.00 -1.54 -0.44 0.00 0.00 177.26 175.28 1h2t n SER 494 N -1.79 7.21 -4.11 0.53 3.41 -1.26 -4.90 113.62 112.72 1h2t n SER 494 Ca 0.03 -3.46 -0.23 0.00 -0.26 0.00 0.00 58.87 54.95 1h2t n SER 494 Cb 0.21 -1.20 -0.15 0.00 -0.26 0.00 0.00 64.21 62.81 1h2t n SER 494 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1h2t s LEU 495 N -3.09 1.99 -0.05 1.04 1.43 -1.23 -5.09 118.68 113.69 1h2t s LEU 495 Ca 0.53 -0.27 -0.35 0.00 -1.03 0.00 0.00 54.13 53.01 1h2t s LEU 495 Cb 0.34 -0.76 -0.13 0.00 0.03 0.00 0.00 46.19 45.67 1h2t s LEU 495 CO -0.25 0.17 1.74 -2.65 0.23 0.00 0.00 176.35 175.59 1h2t n PRO 496 N 2.82 1.90 -1.69 1.29 -0.02 -1.26 -0.94 135.00 137.10 1h2t n PRO 496 Ca -0.15 0.69 -0.20 0.00 -2.02 0.00 0.00 63.50 61.82 1h2t n PRO 496 Cb 0.55 -2.48 -0.08 0.00 -0.02 0.00 0.00 33.50 31.47 1h2t n PRO 496 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h2t n GLY 497 N 3.97 1.65 0.20 -1.23 0.00 -1.26 -4.90 105.19 103.62 1h2t n GLY 497 Ca 0.22 -0.04 -0.07 0.00 0.00 0.00 0.00 46.02 46.13 1h2t n GLY 497 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1h2t h HIS 498 N 0.00 -0.62 -0.09 1.61 2.76 -1.39 -2.55 115.15 114.87 1h2t h HIS 498 Ca -0.42 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 57.79 1h2t h HIS 498 Cb 1.33 0.26 -0.00 0.00 1.55 0.00 0.00 27.41 30.55 1h2t h HIS 498 CO 0.57 -0.24 0.07 0.66 -1.30 0.00 0.00 177.93 177.68 1h2t h SER 499 N -0.31 0.00 -0.42 3.26 4.64 -1.90 -2.16 113.55 116.64 1h2t h SER 499 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1h2t h SER 499 Cb 0.31 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.38 1h2t h SER 499 CO -0.11 0.00 0.10 0.58 -0.87 0.00 0.00 176.83 176.53 1h2t h VAL 500 N 0.00 1.22 -0.03 0.95 2.07 -1.82 -2.08 116.25 116.55 1h2t h VAL 500 Ca 0.04 -0.80 -0.21 0.00 0.82 0.00 0.00 66.70 66.55 1h2t h VAL 500 Cb 0.19 0.74 0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1h2t h VAL 500 CO -0.00 0.29 -0.80 0.00 0.02 0.00 0.00 177.57 177.08 1h2t h ALA 501 N 1.38 0.14 -0.31 1.67 0.00 -1.02 -2.81 119.26 118.30 1h2t h ALA 501 Ca 0.16 -0.62 0.09 0.00 0.00 0.00 0.00 54.91 54.54 1h2t h ALA 501 Cb 0.30 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1h2t h ALA 501 CO 0.00 0.53 0.22 -0.07 0.00 0.00 0.00 179.25 179.94 1h2t h LEU 502 N 0.21 0.00 -0.09 0.00 3.38 -1.24 0.35 115.31 117.92 1h2t h LEU 502 Ca -0.09 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.71 1h2t h LEU 502 Cb 1.47 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.20 1h2t h LEU 502 CO 0.16 0.00 -0.80 0.00 0.09 0.00 0.00 178.44 177.89 1h2t h LEU 504 N 0.00 0.81 -0.90 0.00 3.38 -0.14 -2.38 115.31 116.07 1h2t h LEU 504 Ca -0.01 -0.49 0.16 0.00 0.09 0.00 0.00 57.88 57.63 1h2t h LEU 504 Cb 1.58 -0.24 -0.10 0.00 0.09 0.00 0.00 40.66 41.99 1h2t h LEU 504 CO 0.10 1.26 0.50 0.00 0.09 0.00 0.00 178.44 180.40 1h2t h ALA 505 N 0.73 1.40 0.00 1.53 0.00 -0.99 0.27 119.26 122.20 1h2t h ALA 505 Ca -0.02 0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.79 1h2t h ALA 505 Cb 1.27 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1h2t h ALA 505 CO 0.13 -0.05 -0.82 0.28 0.00 0.00 0.00 179.25 178.79 1h2t h VAL 506 N 0.69 1.54 -0.54 0.00 2.07 -1.60 -2.73 116.25 115.68 1h2t h VAL 506 Ca 0.50 -2.68 -0.05 0.00 0.82 0.00 0.00 66.70 65.28 1h2t h VAL 506 Cb 0.70 2.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.92 1h2t h VAL 506 CO -0.36 0.77 0.13 0.00 0.02 0.00 0.00 177.57 178.14 1h2t h ALA 507 N 1.12 0.71 -0.35 1.67 0.00 -0.07 0.13 119.26 122.47 1h2t h ALA 507 Ca -0.02 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 1h2t h ALA 507 Cb 1.44 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1h2t h ALA 507 CO 0.11 0.41 -0.32 0.74 0.00 0.00 0.00 179.25 180.19 1h2t h PHE 508 N 0.76 1.00 -0.50 0.00 0.05 -0.82 -2.93 116.94 114.51 1h2t h PHE 508 Ca 0.17 -0.29 -0.03 0.00 3.82 0.00 0.00 57.97 61.64 1h2t h PHE 508 Cb 0.34 -0.21 -0.02 0.00 2.00 0.00 0.00 35.95 38.05 1h2t h PHE 508 CO 0.02 1.08 0.21 0.87 -0.18 0.00 0.00 178.31 180.32 1h2t h LYS 509 N 0.62 0.74 0.00 1.51 1.57 -1.30 -1.97 116.57 117.73 1h2t h LYS 509 Ca 0.06 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1h2t h LYS 509 Cb 0.91 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.09 1h2t h LYS 509 CO 0.08 0.65 0.00 -1.13 -0.57 0.00 0.00 179.45 178.48 1h2t n SER 510 N -4.57 0.00 -3.01 0.86 3.41 0.02 -4.90 113.62 105.43 1h2t n SER 510 Ca 0.02 -1.33 -0.10 0.00 -0.26 0.00 0.00 58.87 57.20 1h2t n SER 510 Cb 0.14 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.11 1h2t n SER 510 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1h2t n LYS 511 N -0.52 -2.23 -3.54 4.33 3.00 -0.74 -5.03 118.16 113.42 1h2t n LYS 511 Ca 0.01 1.93 -0.24 0.00 -0.00 0.00 0.00 58.31 60.01 1h2t n LYS 511 Cb 0.00 -3.95 0.02 0.00 0.00 0.00 0.00 35.03 31.11 1h2t n LYS 511 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1h2t n ALA 512 N 0.36 0.98 -2.36 3.14 0.00 -1.11 -5.04 120.51 116.47 1h2t n ALA 512 Ca 0.02 -2.17 -0.24 0.00 0.00 0.00 0.00 53.44 51.05 1h2t n ALA 512 Cb 0.37 0.80 -0.04 0.00 0.00 0.00 0.00 19.45 20.57 1h2t n ALA 512 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1h2t s THR 513 N -2.69 2.24 0.12 0.00 -1.32 -1.26 -4.99 115.64 107.74 1h2t s THR 513 Ca 0.41 -1.54 -0.25 0.00 -1.21 0.00 0.00 61.69 59.10 1h2t s THR 513 Cb -0.03 -2.78 -0.05 0.00 -1.51 0.00 0.00 72.50 68.12 1h2t s THR 513 CO 0.26 0.00 1.64 0.78 -2.21 0.00 0.00 174.62 175.09 1h2t h ASN 514 N 1.14 -0.70 -0.98 8.08 2.35 -1.99 -1.41 115.58 122.06 1h2t h ASN 514 Ca -0.41 0.10 0.23 0.00 -0.55 0.00 0.00 56.30 55.66 1h2t h ASN 514 Cb 1.27 0.29 -0.08 0.00 0.05 0.00 0.00 38.32 39.85 1h2t h ASN 514 CO 0.63 -0.31 0.63 0.44 -1.65 0.00 0.00 177.43 177.17 1h2t h ASP 515 N -0.37 0.49 0.00 5.81 5.19 -1.99 0.21 116.42 125.76 1h2t h ASP 515 Ca 0.06 0.07 -0.00 0.00 -0.62 0.00 0.00 57.03 56.54 1h2t h ASP 515 Cb 0.46 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.95 1h2t h ASP 515 CO -0.21 0.16 -0.00 -0.33 -3.12 0.00 0.00 179.24 175.73 1h2t h GLU 516 N 0.47 -0.00 -0.19 3.56 5.08 -1.68 -2.65 114.58 119.16 1h2t h GLU 516 Ca 0.54 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.86 1h2t h GLU 516 Cb 1.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 1h2t h GLU 516 CO -0.26 0.40 -0.07 0.82 -1.00 0.00 0.00 179.01 178.89 1h2t h ILE 517 N -0.40 1.17 0.30 3.13 5.03 -0.41 -2.50 117.51 123.83 1h2t h ILE 517 Ca -0.00 -0.70 -0.01 0.00 -0.12 0.00 0.00 64.86 64.03 1h2t h ILE 517 Cb 0.40 1.11 -0.00 0.00 -3.03 0.00 0.00 36.82 35.29 1h2t h ILE 517 CO 0.00 0.23 -0.18 -0.26 -0.68 0.00 0.00 178.15 177.25 1h2t h PHE 518 N 0.28 -0.48 0.00 1.37 0.04 -0.54 -1.52 116.94 116.09 1h2t h PHE 518 Ca 0.06 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 1h2t h PHE 518 Cb 0.32 0.17 -0.00 0.00 2.20 0.00 0.00 35.95 38.63 1h2t h PHE 518 CO 0.01 -0.29 -0.10 1.03 -0.60 0.00 0.00 178.31 178.36 1h2t h SER 519 N -0.47 0.00 0.98 2.17 0.87 -1.27 -1.60 113.55 114.23 1h2t h SER 519 Ca -0.03 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.39 1h2t h SER 519 Cb 0.38 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 1h2t h SER 519 CO 0.03 0.10 -0.64 0.40 -0.53 0.00 0.00 176.83 176.19 1h2t h ILE 520 N 0.00 1.25 -0.01 2.23 2.04 -0.99 -2.88 117.51 119.16 1h2t h ILE 520 Ca -0.00 -2.36 0.00 0.00 1.00 0.00 0.00 64.86 63.49 1h2t h ILE 520 Cb 0.25 2.35 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 1h2t h ILE 520 CO 0.01 0.63 -0.00 0.18 0.00 0.00 0.00 178.15 178.97 1h2t n LEU 521 N -3.48 0.54 -0.08 1.44 4.77 -0.61 -3.66 117.00 115.91 1h2t n LEU 521 Ca 0.00 -0.17 -0.12 0.00 -0.03 0.00 0.00 56.01 55.69 1h2t n LEU 521 Cb 0.71 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.78 1h2t n LEU 521 CO 0.42 0.09 0.52 0.11 -1.33 0.00 0.00 177.39 177.20 1h2t h LYS 522 N 0.84 0.84 -1.60 3.23 1.79 -1.37 -3.20 116.57 117.09 1h2t h LYS 522 Ca 0.00 -0.47 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 1h2t h LYS 522 Cb 0.19 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.87 1h2t h LYS 522 CO 0.00 1.11 0.00 -0.25 -1.08 0.00 0.00 179.45 179.23 1h2t n ASP 523 N -4.03 2.24 -4.26 0.86 8.00 -1.24 -4.74 116.55 113.38 1h2t n ASP 523 Ca -0.03 -1.40 -0.33 0.00 0.71 0.00 0.00 54.79 53.74 1h2t n ASP 523 Cb 0.57 -0.42 -0.15 0.00 -0.02 0.00 0.00 41.12 41.10 1h2t n ASP 523 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1h2t s VAL 524 N 0.54 2.68 0.73 2.53 1.01 -1.21 -4.92 120.40 121.76 1h2t s VAL 524 Ca 0.00 -0.76 -0.13 0.00 0.00 0.00 0.00 61.98 61.09 1h2t s VAL 524 Cb 0.00 -2.13 0.04 0.00 0.00 0.00 0.00 36.38 34.28 1h2t s VAL 524 CO 0.00 0.51 1.11 -2.16 0.00 0.00 0.00 175.10 174.57 1h2t s PRO 525 N 0.84 2.37 -0.75 2.72 0.04 -1.26 -4.97 135.00 133.99 1h2t s PRO 525 Ca -0.05 1.35 -0.05 0.00 0.04 0.00 0.00 61.00 62.29 1h2t s PRO 525 Cb -0.15 -1.90 0.19 0.00 0.04 0.00 0.00 34.50 32.68 1h2t s PRO 525 CO -0.00 -1.58 0.61 1.21 0.04 0.00 0.00 177.00 177.27 1h2t s ASN 526 N -2.87 5.75 0.00 6.66 3.84 -1.26 -4.75 114.94 122.31 1h2t s ASN 526 Ca 0.65 -3.08 0.10 0.00 0.21 0.00 0.00 52.86 50.75 1h2t s ASN 526 Cb -0.20 -1.94 0.53 0.00 -0.55 0.00 0.00 41.25 39.09 1h2t s ASN 526 CO 0.49 -0.35 1.17 -0.81 -2.79 0.00 0.00 177.10 174.81 1h2t n PRO 527 N 3.24 0.18 -0.88 0.43 -0.04 -1.26 -5.10 135.00 131.57 1h2t n PRO 527 Ca 0.13 0.15 -0.30 0.00 -0.04 0.00 0.00 63.50 63.44 1h2t n PRO 527 Cb 0.39 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.52 1h2t n PRO 527 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1h2t s SER 538 N -2.44 2.75 -0.20 3.54 1.04 -1.26 -5.66 113.70 111.46 1h2t s SER 538 Ca 0.11 1.74 -0.05 0.00 0.48 0.00 0.00 55.95 58.24 1h2t s SER 538 Cb 0.07 -2.36 0.10 0.00 0.10 0.00 0.00 66.02 63.93 1h2t s SER 538 CO 0.15 -3.13 0.35 0.12 0.98 0.00 0.00 173.24 171.70 1h2t s PHE 539 N -2.72 -0.67 -0.31 5.02 5.36 -1.26 -4.63 117.98 118.77 1h2t s PHE 539 Ca 0.65 1.02 0.02 0.00 -0.96 0.00 0.00 56.93 57.66 1h2t s PHE 539 Cb -0.21 0.06 0.08 0.00 -0.34 0.00 0.00 43.02 42.60 1h2t s PHE 539 CO 0.59 -0.55 0.00 1.21 -1.46 0.00 0.00 175.22 175.01 1h2t s ASN 540 N 2.52 4.74 0.22 6.13 3.84 -1.26 -5.01 114.94 126.11 1h2t s ASN 540 Ca 0.05 -1.69 -0.07 0.00 0.21 0.00 0.00 52.86 51.36 1h2t s ASN 540 Cb -0.14 -1.64 0.31 0.00 -0.55 0.00 0.00 41.25 39.23 1h2t s ASN 540 CO -0.13 -0.31 1.80 1.55 -2.79 0.00 0.00 177.10 177.23 1h2t h PRO 541 N 7.80 0.68 -0.35 0.43 0.13 -1.98 -2.95 132.00 135.76 1h2t h PRO 541 Ca -0.14 -0.04 -0.13 0.00 -0.87 0.00 0.00 66.00 64.82 1h2t h PRO 541 Cb 1.04 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 1h2t h PRO 541 CO 0.52 0.45 -0.30 1.25 -0.23 0.00 0.00 178.00 179.70 1h2t h LEU 542 N 0.70 0.86 -0.74 1.56 5.85 -1.95 -2.22 115.31 119.36 1h2t h LEU 542 Ca 0.34 -0.45 0.07 0.00 0.84 0.00 0.00 57.88 58.68 1h2t h LEU 542 Cb 0.28 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.01 1h2t h LEU 542 CO -0.22 1.13 0.43 0.11 -0.34 0.00 0.00 178.44 179.54 1h2t h LYS 543 N 0.59 0.74 -0.37 1.25 1.57 -1.83 -1.13 116.57 117.40 1h2t h LYS 543 Ca 0.06 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 1h2t h LYS 543 Cb 0.87 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 1h2t h LYS 543 CO 0.08 0.49 -0.23 0.82 -0.57 0.00 0.00 179.45 180.04 1h2t h ILE 544 N 0.76 1.28 -0.06 1.86 2.04 -1.50 -2.47 117.51 119.44 1h2t h ILE 544 Ca 0.34 -1.37 0.00 0.00 1.00 0.00 0.00 64.86 64.83 1h2t h ILE 544 Cb 0.23 1.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1h2t h ILE 544 CO -0.20 0.45 0.04 -0.08 0.00 0.00 0.00 178.15 178.36 1h2t h GLU 545 N 0.61 0.08 -0.04 2.37 4.81 -0.80 -1.21 114.58 120.39 1h2t h GLU 545 Ca 0.08 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.21 1h2t h GLU 545 Cb 0.79 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 1h2t h GLU 545 CO 0.06 0.06 -0.38 -0.39 -0.73 0.00 0.00 179.01 177.64 1h2t h VAL 546 N 0.07 1.28 -0.30 0.32 -1.51 -1.27 0.11 116.25 114.94 1h2t h VAL 546 Ca 0.02 -1.36 -0.17 0.00 -1.23 0.00 0.00 66.70 63.96 1h2t h VAL 546 Cb 0.00 1.68 -0.00 0.00 -2.13 0.00 0.00 31.29 30.84 1h2t h VAL 546 CO -0.00 0.39 -0.49 0.15 -1.23 0.00 0.00 177.57 176.39 1h2t h PHE 547 N 0.08 1.04 0.00 5.19 3.57 -1.17 -2.85 116.94 122.79 1h2t h PHE 547 Ca 0.01 -0.35 -0.01 0.00 3.53 0.00 0.00 57.97 61.15 1h2t h PHE 547 Cb 0.71 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 1h2t h PHE 547 CO 0.00 1.16 -0.07 0.28 -2.23 0.00 0.00 178.31 177.46 1h2t h VAL 548 N 0.66 1.27 -0.19 1.41 2.07 -1.08 -1.81 116.25 118.57 1h2t h VAL 548 Ca 0.03 -1.97 0.06 0.00 0.82 0.00 0.00 66.70 65.63 1h2t h VAL 548 Cb 1.09 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 33.27 1h2t h VAL 548 CO 0.11 0.43 0.40 1.56 0.02 0.00 0.00 177.57 180.09 1h2t h GLN 549 N -1.00 0.00 0.00 1.57 1.08 -0.90 0.71 115.11 116.57 1h2t h GLN 549 Ca -0.02 0.00 -0.39 0.00 -1.45 0.00 0.00 58.65 56.79 1h2t h GLN 549 Cb 0.75 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 28.11 1h2t h GLN 549 CO -0.01 0.00 -2.47 2.41 -0.95 0.00 0.00 178.83 177.81 1h2t n THR 550 N -3.27 1.50 0.04 -0.54 -1.04 -1.08 -3.67 114.28 106.23 1h2t n THR 550 Ca 0.02 -0.56 -0.03 0.00 -2.04 0.00 0.00 64.05 61.44 1h2t n THR 550 Cb 0.50 -1.46 0.21 0.00 -1.82 0.00 0.00 70.33 67.76 1h2t n THR 550 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1h2t h LEU 551 N -0.07 0.41 0.02 -4.42 5.85 -0.69 -2.59 115.31 113.83 1h2t h LEU 551 Ca -0.58 -0.15 -0.18 0.00 0.84 0.00 0.00 57.88 57.81 1h2t h LEU 551 Cb 1.88 -0.11 0.02 0.00 0.37 0.00 0.00 40.66 42.82 1h2t h LEU 551 CO -0.11 0.71 -0.70 -0.07 -0.34 0.00 0.00 178.44 177.93 1h2t h LEU 552 N 0.35 0.58 -0.84 2.25 3.38 -1.10 -3.33 115.31 116.60 1h2t h LEU 552 Ca 0.04 -0.79 0.02 0.00 0.09 0.00 0.00 57.88 57.25 1h2t h LEU 552 Cb 0.73 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 1h2t h LEU 552 CO 0.06 1.29 0.55 -0.74 0.09 0.00 0.00 178.44 179.69 1h2t h HIS 553 N -0.07 1.04 0.00 1.13 2.76 -1.62 -1.33 115.15 117.06 1h2t h HIS 553 Ca -0.09 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.10 1h2t h HIS 553 Cb 1.42 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 30.03 1h2t h HIS 553 CO 0.15 0.63 0.00 1.28 -1.30 0.00 0.00 177.93 178.69 1h2t n LEU 554 N -4.52 0.78 -0.16 0.26 4.77 -0.98 -2.62 117.00 114.52 1h2t n LEU 554 Ca 0.09 -0.39 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 1h2t n LEU 554 Cb 0.04 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 1h2t n LEU 554 CO 0.35 0.20 0.19 0.00 -1.33 0.00 0.00 177.39 176.80 1h2t n ALA 555 N -0.06 1.32 0.44 -1.18 0.00 -0.58 -4.89 120.51 115.56 1h2t n ALA 555 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1h2t n ALA 555 Cb 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.54 1h2t n ALA 555 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h2t n ALA 556 N 0.00 1.71 -0.08 0.00 0.00 -0.72 -3.70 120.51 117.71 1h2t n ALA 556 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1h2t n ALA 556 Cb 0.54 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1h2t n ALA 556 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1h2t n LYS 557 N -0.46 0.00 -4.40 0.00 4.81 -1.26 -4.97 118.16 111.88 1h2t n LYS 557 Ca 0.00 0.46 -0.21 0.00 -0.87 0.00 0.00 58.31 57.69 1h2t n LYS 557 Cb 0.00 -1.09 -0.09 0.00 0.02 0.00 0.00 35.03 33.87 1h2t n LYS 557 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1h2t s SER 558 N -2.61 1.97 0.17 3.14 1.04 -1.24 -5.03 113.70 111.14 1h2t s SER 558 Ca 0.00 -1.55 -0.12 0.00 0.48 0.00 0.00 55.95 54.76 1h2t s SER 558 Cb 0.00 0.34 0.06 0.00 0.10 0.00 0.00 66.02 66.51 1h2t s SER 558 CO 0.00 -0.85 1.69 -0.26 0.98 0.00 0.00 173.24 174.80 1h2t h PHE 559 N 2.10 0.93 0.00 5.02 0.04 -1.95 -2.33 116.94 120.75 1h2t h PHE 559 Ca -0.35 -0.10 -0.04 0.00 2.80 0.00 0.00 57.97 60.28 1h2t h PHE 559 Cb 1.25 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 39.13 1h2t h PHE 559 CO 1.06 0.79 -0.17 0.77 -0.60 0.00 0.00 178.31 180.16 1h2t h SER 560 N 0.80 0.00 0.08 2.17 0.02 -1.97 0.21 113.55 114.86 1h2t h SER 560 Ca 0.18 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.03 1h2t h SER 560 Cb 0.31 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 1h2t h SER 560 CO -0.00 0.17 -0.34 0.45 -1.14 0.00 0.00 176.83 175.97 1h2t h HIS 561 N 0.00 0.42 0.10 3.45 3.86 -1.71 -0.57 115.15 120.71 1h2t h HIS 561 Ca -0.00 -0.10 -0.15 0.00 -1.16 0.00 0.00 60.37 58.96 1h2t h HIS 561 Cb 0.33 -0.10 0.01 0.00 1.06 0.00 0.00 27.41 28.71 1h2t h HIS 561 CO 0.00 0.67 -0.66 0.77 0.86 0.00 0.00 177.93 179.56 1h2t h SER 562 N 0.32 0.33 -0.87 2.45 0.02 -1.08 -3.07 113.55 111.65 1h2t h SER 562 Ca 0.04 -0.95 0.02 0.00 -0.84 0.00 0.00 61.79 60.06 1h2t h SER 562 Cb 0.75 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.13 1h2t h SER 562 CO 0.06 1.31 0.58 -0.26 -1.14 0.00 0.00 176.83 177.38 1h2t h PHE 563 N -0.54 1.08 0.00 3.45 0.05 -0.96 -0.68 116.94 119.34 1h2t h PHE 563 Ca -0.12 0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.67 1h2t h PHE 563 Cb 1.48 -0.36 -0.00 0.00 2.00 0.00 0.00 35.95 39.06 1h2t h PHE 563 CO 0.21 0.66 -0.09 0.66 -0.18 0.00 0.00 178.31 179.57 1h2t h SER 564 N 1.14 0.00 0.14 2.17 4.64 -1.20 -2.02 113.55 118.42 1h2t h SER 564 Ca 0.33 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.47 1h2t h SER 564 Cb -0.07 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.04 1h2t h SER 564 CO -0.08 0.09 -0.80 0.00 -0.87 0.00 0.00 176.83 175.16 1h2t h ALA 565 N 1.91 -0.08 -0.79 5.18 0.00 -1.11 -2.53 119.26 121.84 1h2t h ALA 565 Ca -0.00 -0.70 -0.05 0.00 0.00 0.00 0.00 54.91 54.16 1h2t h ALA 565 Cb 0.70 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1h2t h ALA 565 CO 0.01 0.38 0.30 -0.07 0.00 0.00 0.00 179.25 179.87 1h2t h LEU 566 N -0.39 1.10 -0.70 0.00 3.38 -1.10 -1.63 115.31 115.97 1h2t h LEU 566 Ca -0.14 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.51 1h2t h LEU 566 Cb 1.63 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 42.08 1h2t h LEU 566 CO 0.15 0.98 -0.45 0.00 0.09 0.00 0.00 178.44 179.21 1h2t h ALA 567 N 1.16 0.88 0.65 1.53 0.00 -1.47 -1.96 119.26 120.06 1h2t h ALA 567 Ca 0.26 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1h2t h ALA 567 Cb 0.24 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1h2t h ALA 567 CO -0.02 0.65 -0.31 -0.22 0.00 0.00 0.00 179.25 179.35 1h2t h LYS 568 N 0.37 -0.84 -1.63 0.00 3.64 -1.07 -3.22 116.57 113.82 1h2t h LYS 568 Ca 0.03 0.06 -0.52 0.00 -1.27 0.00 0.00 60.65 58.95 1h2t h LYS 568 Cb 0.94 0.19 -0.20 0.00 -0.41 0.00 0.00 32.23 32.75 1h2t h LYS 568 CO 0.08 -0.56 0.60 1.19 -2.27 0.00 0.00 179.45 178.49 1h2t n PHE 569 N -5.22 2.12 -0.01 1.91 3.01 -0.65 -4.51 117.46 114.12 1h2t n PHE 569 Ca -0.11 -2.24 -0.08 0.00 1.01 0.00 0.00 57.45 56.04 1h2t n PHE 569 Cb 0.35 -1.23 0.10 0.00 -0.01 0.00 0.00 39.48 38.68 1h2t n PHE 569 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1h2t h HIS 570 N 2.28 0.68 -0.48 1.38 2.76 -1.36 -2.41 115.15 118.01 1h2t h HIS 570 Ca 0.43 -0.20 -0.06 0.00 -2.20 0.00 0.00 60.37 58.34 1h2t h HIS 570 Cb 0.70 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.49 1h2t h HIS 570 CO 1.20 0.90 0.06 1.49 -1.30 0.00 0.00 177.93 180.28 1h2t h GLU 571 N 0.47 0.76 -0.34 5.26 4.81 -1.87 -1.93 114.58 121.74 1h2t h GLU 571 Ca 0.04 -0.17 -0.10 0.00 -0.13 0.00 0.00 59.36 59.00 1h2t h GLU 571 Cb 0.92 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 1h2t h GLU 571 CO 0.08 0.72 -0.18 0.28 -0.73 0.00 0.00 179.01 179.19 1h2t h VAL 572 N 0.72 1.29 0.29 0.32 2.07 -1.86 -2.77 116.25 116.30 1h2t h VAL 572 Ca 0.15 -1.30 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 1h2t h VAL 572 Cb 0.35 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1h2t h VAL 572 CO 0.01 0.42 -0.15 -0.26 0.02 0.00 0.00 177.57 177.61 1h2t h PHE 573 N 0.50 -0.39 -0.77 1.57 -1.00 -1.11 -1.00 116.94 114.75 1h2t h PHE 573 Ca 0.07 -0.01 0.15 0.00 2.81 0.00 0.00 57.97 60.99 1h2t h PHE 573 Cb 0.72 0.13 -0.10 0.00 3.61 0.00 0.00 35.95 40.32 1h2t h PHE 573 CO 0.06 -0.24 0.31 0.87 -1.61 0.00 0.00 178.31 177.70 1h2t h LYS 574 N -0.41 0.43 0.40 1.51 1.79 -1.38 0.34 116.57 119.26 1h2t h LYS 574 Ca -0.04 -0.03 -0.02 0.00 -2.18 0.00 0.00 60.65 58.39 1h2t h LYS 574 Cb 0.32 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 1h2t h LYS 574 CO 0.05 0.28 -0.19 1.15 -1.08 0.00 0.00 179.45 179.66 1h2t h THR 575 N 0.44 0.58 0.00 -0.16 2.02 -1.24 -1.64 112.91 112.91 1h2t h THR 575 Ca 0.42 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 1h2t h THR 575 Cb 0.65 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1h2t h THR 575 CO -0.41 0.07 -0.14 -0.07 0.37 0.00 0.00 175.52 175.33 1h2t h LEU 576 N -0.76 0.00 -3.36 2.58 4.07 -0.66 -3.03 115.31 114.15 1h2t h LEU 576 Ca -0.06 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.72 1h2t h LEU 576 Cb 0.52 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 42.16 1h2t h LEU 576 CO 0.09 0.14 -0.07 0.00 -1.08 0.00 0.00 178.44 177.52 1h2t n ALA 577 N -2.37 4.31 0.06 1.53 0.00 0.12 -4.64 120.51 119.52 1h2t n ALA 577 Ca -0.02 -3.13 -0.01 0.00 0.00 0.00 0.00 53.44 50.28 1h2t n ALA 577 Cb 0.24 -0.75 0.28 0.00 0.00 0.00 0.00 19.45 19.22 1h2t n ALA 577 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1h2t h GLU 578 N 1.02 0.37 -7.45 0.00 4.81 -1.17 -3.37 114.58 108.79 1h2t h GLU 578 Ca 0.22 -0.12 -0.49 0.00 -0.13 0.00 0.00 59.36 58.85 1h2t h GLU 578 Cb 1.67 -0.03 0.09 0.00 0.63 0.00 0.00 28.75 31.11 1h2t h GLU 578 CO 0.39 0.56 0.38 0.45 -0.73 0.00 0.00 179.01 180.07 1h2t s SER 579 N -6.83 5.06 0.09 1.04 0.15 -1.26 -4.95 113.70 107.00 1h2t s SER 579 Ca -0.06 1.20 -0.06 0.00 0.70 0.00 0.00 55.95 57.73 1h2t s SER 579 Cb 0.14 -1.97 -0.21 0.00 -1.71 0.00 0.00 66.02 62.28 1h2t s SER 579 CO 0.77 -1.59 1.20 0.44 1.20 0.00 0.00 173.24 175.25 1h2t h ASP 580 N -0.83 0.54 0.56 5.45 3.32 -1.98 -2.32 116.42 121.17 1h2t h ASP 580 Ca -0.46 -0.51 -0.06 0.00 0.02 0.00 0.00 57.03 56.03 1h2t h ASP 580 Cb 1.26 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 1h2t h ASP 580 CO 0.62 1.35 -0.28 -0.33 -1.72 0.00 0.00 179.24 178.87 1h2t h GLU 581 N 0.16 0.00 -0.14 3.56 5.08 -1.95 -1.06 114.58 120.24 1h2t h GLU 581 Ca -0.12 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 1h2t h GLU 581 Cb 1.82 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.06 1h2t h GLU 581 CO 0.20 0.28 -0.09 0.78 -1.00 0.00 0.00 179.01 179.18 1h2t h GLY 582 N 1.41 0.34 0.90 -3.84 0.00 -1.80 -1.66 103.07 98.42 1h2t h GLY 582 Ca -0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 1h2t h GLY 582 CO 0.04 0.30 0.09 0.50 0.00 0.00 0.00 176.54 177.46 1h2t h LYS 583 N -0.04 0.46 0.00 4.80 1.57 -1.12 -1.34 116.57 120.90 1h2t h LYS 583 Ca 0.03 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1h2t h LYS 583 Cb 0.59 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 1h2t h LYS 583 CO 0.03 0.52 -0.05 -0.07 -0.57 0.00 0.00 179.45 179.31 1h2t h LEU 584 N 0.32 0.00 0.19 2.94 3.38 -1.19 -2.13 115.31 118.81 1h2t h LEU 584 Ca 0.09 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.75 1h2t h LEU 584 Cb 0.26 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.03 1h2t h LEU 584 CO -0.00 0.05 -1.48 -0.74 0.09 0.00 0.00 178.44 176.36 1h2t h HIS 585 N 0.00 0.72 -0.94 1.13 2.76 -0.89 -2.50 115.15 115.43 1h2t h HIS 585 Ca -0.00 -0.53 0.06 0.00 -2.20 0.00 0.00 60.37 57.71 1h2t h HIS 585 Cb 0.11 -0.03 -0.06 0.00 1.55 0.00 0.00 27.41 28.98 1h2t h HIS 585 CO 0.00 1.48 0.61 0.28 -1.30 0.00 0.00 177.93 179.00 1h2t h VAL 586 N 0.11 1.08 -0.26 5.26 2.07 -0.65 0.11 116.25 123.97 1h2t h VAL 586 Ca -0.24 -0.37 -0.18 0.00 0.82 0.00 0.00 66.70 66.73 1h2t h VAL 586 Cb 2.08 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1h2t h VAL 586 CO 0.22 0.20 -0.54 -0.07 0.02 0.00 0.00 177.57 177.40 1h2t h LEU 587 N 1.09 0.93 -0.94 2.57 3.38 -1.45 -1.63 115.31 119.27 1h2t h LEU 587 Ca 0.40 -0.54 -0.09 0.00 0.09 0.00 0.00 57.88 57.74 1h2t h LEU 587 Cb 0.18 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1h2t h LEU 587 CO -0.15 1.30 -0.15 -0.09 0.09 0.00 0.00 178.44 179.44 1h2t h ARG 588 N 0.60 0.61 0.08 1.13 2.43 -0.86 -1.43 114.38 116.95 1h2t h ARG 588 Ca 0.01 -0.20 -0.00 0.00 -0.81 0.00 0.00 59.98 58.97 1h2t h ARG 588 Cb 1.15 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 1h2t h ARG 588 CO 0.12 0.74 -0.04 0.28 -1.51 0.00 0.00 179.97 179.56 1h2t h VAL 589 N 0.55 1.06 -1.06 0.20 2.07 -0.83 -2.84 116.25 115.40 1h2t h VAL 589 Ca 0.09 -1.44 0.28 0.00 0.82 0.00 0.00 66.70 66.45 1h2t h VAL 589 Cb 0.58 1.87 -0.09 0.00 -1.52 0.00 0.00 31.29 32.13 1h2t h VAL 589 CO 0.04 0.31 0.69 -0.03 0.02 0.00 0.00 177.57 178.60 1h2t h MET 590 N -0.87 0.32 -0.23 1.57 1.85 -1.26 0.75 114.93 117.06 1h2t h MET 590 Ca -0.01 -0.02 -0.13 0.00 -0.61 0.00 0.00 59.70 58.93 1h2t h MET 590 Cb 0.59 -0.07 -0.00 0.00 0.43 0.00 0.00 31.60 32.54 1h2t h MET 590 CO 0.02 0.21 -0.36 0.35 -0.40 0.00 0.00 176.91 176.73 1h2t h PHE 591 N 0.33 0.81 0.00 1.39 3.57 -1.28 -1.76 116.94 120.01 1h2t h PHE 591 Ca 0.60 -0.27 0.00 0.00 3.53 0.00 0.00 57.97 61.82 1h2t h PHE 591 Cb 1.63 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 40.22 1h2t h PHE 591 CO -0.00 1.03 0.00 0.39 -2.23 0.00 0.00 178.31 177.49 1h2t n GLU 592 N -4.25 0.07 -0.08 1.11 1.02 0.17 -0.43 120.64 118.25 1h2t n GLU 592 Ca -0.05 0.35 -0.11 0.00 -0.02 0.00 0.00 57.16 57.33 1h2t n GLU 592 Cb 0.51 -1.64 -0.15 0.00 -0.02 0.00 0.00 31.44 30.14 1h2t n GLU 592 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1h2t n VAL 593 N -1.77 1.48 -2.22 2.62 0.31 -0.66 -4.61 118.33 113.48 1h2t n VAL 593 Ca 0.02 -0.81 -0.06 0.00 -0.01 0.00 0.00 64.34 63.49 1h2t n VAL 593 Cb 0.16 -0.76 0.07 0.00 -0.91 0.00 0.00 33.84 32.40 1h2t n VAL 593 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1h2t n TRP 594 N -2.91 1.29 0.98 3.52 5.03 -0.68 -1.42 117.44 123.25 1h2t n TRP 594 Ca -0.30 -1.75 0.11 0.00 3.03 0.00 0.00 57.50 58.59 1h2t n TRP 594 Cb 1.11 -0.26 0.53 0.00 -1.03 0.00 0.00 31.31 31.66 1h2t n TRP 594 CO 0.00 0.00 0.00 2.89 -0.03 0.00 0.00 177.69 180.55 1h2t n ARG 595 N -0.57 0.25 -0.04 -0.99 1.85 0.43 -2.28 116.66 115.30 1h2t n ARG 595 Ca 0.23 0.09 0.09 0.00 -1.00 0.00 0.00 57.85 57.25 1h2t n ARG 595 Cb 0.89 -1.50 0.10 0.00 -1.05 0.00 0.00 32.46 30.90 1h2t n ARG 595 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1h2t n ASN 596 N -1.33 2.58 -3.30 2.89 3.02 -1.26 -4.62 115.26 113.25 1h2t n ASN 596 Ca 0.09 -1.76 -0.25 0.00 -0.03 0.00 0.00 54.58 52.63 1h2t n ASN 596 Cb 0.19 -0.05 -0.07 0.00 -0.61 0.00 0.00 39.78 39.23 1h2t n ASN 596 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1h2t n HIS 597 N 0.98 1.66 -0.32 3.10 -0.00 -0.97 -3.74 115.22 115.95 1h2t n HIS 597 Ca 0.11 -3.86 0.34 0.00 0.46 0.00 0.00 57.72 54.77 1h2t n HIS 597 Cb 0.44 -0.45 0.72 0.00 -0.12 0.00 0.00 29.99 30.58 1h2t n HIS 597 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1h2t h PRO 598 N 4.04 0.04 -0.07 1.57 0.11 -1.82 -0.02 132.00 135.85 1h2t h PRO 598 Ca 0.13 -0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.04 1h2t h PRO 598 Cb 0.77 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1h2t h PRO 598 CO 0.65 0.03 -0.80 0.37 -0.21 0.00 0.00 178.00 178.03 1h2t h GLN 599 N 0.04 0.49 -0.51 1.05 4.15 -1.93 -2.67 115.11 115.72 1h2t h GLN 599 Ca 0.56 -0.43 -0.10 0.00 0.77 0.00 0.00 58.65 59.45 1h2t h GLN 599 Cb 2.16 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 29.93 1h2t h GLN 599 CO -0.04 1.07 -0.08 1.98 -1.93 0.00 0.00 178.83 179.83 1h2t h MET 600 N 0.32 0.96 -0.26 1.69 4.05 -1.36 -2.35 114.93 117.98 1h2t h MET 600 Ca -0.05 -0.35 0.03 0.00 -0.28 0.00 0.00 59.70 59.06 1h2t h MET 600 Cb 1.40 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 32.11 1h2t h MET 600 CO 0.14 1.01 0.06 0.82 0.23 0.00 0.00 176.91 179.18 1h2t h ILE 601 N 0.83 0.90 0.10 1.77 2.04 -1.38 -0.33 117.51 121.43 1h2t h ILE 601 Ca 0.14 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 65.96 1h2t h ILE 601 Cb 0.63 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 1h2t h ILE 601 CO 0.04 0.03 -0.27 0.00 0.00 0.00 0.00 178.15 177.95 1h2t h ALA 602 N 1.18 -0.45 -0.10 1.87 0.00 -1.33 0.34 119.26 120.78 1h2t h ALA 602 Ca 0.12 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1h2t h ALA 602 Cb 0.11 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1h2t h ALA 602 CO -0.15 -0.80 -0.16 -0.39 0.00 0.00 0.00 179.25 177.75 1h2t h VAL 603 N -0.47 1.17 -0.11 0.00 -1.51 -1.25 -1.35 116.25 112.73 1h2t h VAL 603 Ca 0.03 -0.78 -0.09 0.00 -1.23 0.00 0.00 66.70 64.64 1h2t h VAL 603 Cb 0.51 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 30.95 1h2t h VAL 603 CO -0.17 0.24 -0.28 -0.07 -1.23 0.00 0.00 177.57 176.06 1h2t h LEU 604 N 0.15 0.43 -0.64 4.19 3.38 -0.63 -2.19 115.31 119.99 1h2t h LEU 604 Ca 0.03 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1h2t h LEU 604 Cb 0.38 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1h2t h LEU 604 CO 0.02 0.94 0.41 0.58 0.09 0.00 0.00 178.44 180.48 1h2t h VAL 605 N -0.05 1.18 -0.63 1.22 2.07 -0.69 -1.06 116.25 118.28 1h2t h VAL 605 Ca -0.00 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 1h2t h VAL 605 Cb 0.89 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 1h2t h VAL 605 CO 0.06 0.18 0.19 -0.78 0.02 0.00 0.00 177.57 177.24 1h2t h ASP 606 N 0.87 0.88 -0.22 0.57 1.82 -1.27 -2.29 116.42 116.79 1h2t h ASP 606 Ca 0.23 -0.15 -0.09 0.00 -0.39 0.00 0.00 57.03 56.64 1h2t h ASP 606 Cb -0.07 -0.23 -0.00 0.00 0.68 0.00 0.00 39.33 39.71 1h2t h ASP 606 CO -0.05 0.83 -0.20 0.50 -1.61 0.00 0.00 179.24 178.71 1h2t h LYS 607 N 0.92 0.52 -0.79 0.28 1.63 -0.94 -2.31 116.57 115.87 1h2t h LYS 607 Ca 0.21 -0.27 0.02 0.00 -0.85 0.00 0.00 60.65 59.76 1h2t h LYS 607 Cb 0.26 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.86 1h2t h LYS 607 CO -0.01 0.84 0.52 0.52 -3.45 0.00 0.00 179.45 177.87 1h2t h MET 608 N 0.20 1.00 0.18 1.90 2.86 -1.07 -1.57 114.93 118.44 1h2t h MET 608 Ca 0.04 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1h2t h MET 608 Cb 0.74 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1h2t h MET 608 CO 0.05 0.66 -0.09 0.82 1.06 0.00 0.00 176.91 179.41 1h2t h ILE 609 N 1.03 0.88 -0.02 -1.22 2.04 -1.41 0.75 117.51 119.57 1h2t h ILE 609 Ca 0.30 -0.29 0.01 0.00 1.00 0.00 0.00 64.86 65.88 1h2t h ILE 609 Cb -0.06 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1h2t h ILE 609 CO -0.09 0.07 0.02 0.03 0.00 0.00 0.00 178.15 178.19 1h2t h ARG 610 N -0.39 0.00 -0.56 2.37 3.08 -1.11 -1.18 114.38 116.59 1h2t h ARG 610 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1h2t h ARG 610 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1h2t h ARG 610 CO 0.04 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.19 1h2t n THR 611 N -3.90 1.33 -1.70 2.04 -2.24 -0.62 -4.96 114.28 104.22 1h2t n THR 611 Ca -0.02 -1.12 -0.14 0.00 -2.27 0.00 0.00 64.05 60.49 1h2t n THR 611 Cb 0.11 0.34 -0.04 0.00 -2.10 0.00 0.00 70.33 68.64 1h2t n THR 611 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h2t n GLN 612 N 1.02 -1.05 0.03 -0.78 3.00 -0.44 -4.88 117.38 114.27 1h2t n GLN 612 Ca 0.21 0.90 -0.10 0.00 -0.01 0.00 0.00 57.00 58.00 1h2t n GLN 612 Cb 0.66 -5.07 0.04 0.00 0.00 0.00 0.00 30.24 25.87 1h2t n GLN 612 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 1h2t h ILE 613 N 0.00 1.35 -4.57 5.09 1.08 0.26 -3.46 117.51 117.25 1h2t h ILE 613 Ca -0.31 -1.98 -0.33 0.00 -0.39 0.00 0.00 64.86 61.85 1h2t h ILE 613 Cb 1.04 1.96 -0.13 0.00 -3.07 0.00 0.00 36.82 36.63 1h2t h ILE 613 CO 0.42 0.60 -0.45 0.68 -0.69 0.00 0.00 178.15 178.71 1h2t s VAL 614 N -3.78 0.00 0.39 1.67 -7.23 -1.14 -4.85 120.40 105.46 1h2t s VAL 614 Ca -0.06 -1.89 0.06 0.00 -1.81 0.00 0.00 61.98 58.28 1h2t s VAL 614 Cb 0.11 -2.51 -0.08 0.00 0.56 0.00 0.00 36.38 34.47 1h2t s VAL 614 CO 0.84 0.00 0.02 1.51 -0.31 0.00 0.00 175.10 177.16 1h2t s ASP 615 N -3.25 3.59 0.32 4.85 1.47 -1.26 -4.16 116.67 118.21 1h2t s ASP 615 Ca 0.37 -1.37 0.00 0.00 1.18 0.00 0.00 52.55 52.74 1h2t s ASP 615 Cb 0.03 -0.34 0.53 0.00 -0.34 0.00 0.00 42.92 42.80 1h2t s ASP 615 CO 0.20 -0.48 1.94 0.00 0.68 0.00 0.00 175.17 177.51 1h2t h ALA 617 N 1.50 0.79 -0.48 0.00 0.00 -1.96 -0.19 119.26 118.91 1h2t h ALA 617 Ca 0.22 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1h2t h ALA 617 Cb 0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1h2t h ALA 617 CO -0.04 0.39 -0.06 0.00 0.00 0.00 0.00 179.25 179.55 1h2t h ALA 618 N 1.10 0.99 -0.48 0.00 0.00 -1.90 -1.59 119.26 117.38 1h2t h ALA 618 Ca 0.20 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1h2t h ALA 618 Cb 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1h2t h ALA 618 CO -0.02 0.61 0.02 0.28 0.00 0.00 0.00 179.25 180.14 1h2t h VAL 619 N 0.77 1.26 -0.81 0.00 2.07 -1.08 0.86 116.25 119.33 1h2t h VAL 619 Ca 0.14 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 1h2t h VAL 619 Cb 0.54 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 1h2t h VAL 619 CO 0.03 0.36 0.43 0.00 0.02 0.00 0.00 177.57 178.41 1h2t h ALA 620 N 0.93 1.24 -0.34 1.67 0.00 -0.79 -0.96 119.26 121.02 1h2t h ALA 620 Ca 0.14 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1h2t h ALA 620 Cb 0.48 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1h2t h ALA 620 CO 0.02 0.61 -0.36 -0.91 0.00 0.00 0.00 179.25 178.61 1h2t h ASN 621 N 1.13 0.90 -0.93 0.00 2.35 -1.03 -3.08 115.58 114.92 1h2t h ASN 621 Ca 0.28 -0.48 0.07 0.00 -0.55 0.00 0.00 56.30 55.62 1h2t h ASN 621 Cb 0.04 -0.25 -0.07 0.00 0.05 0.00 0.00 38.32 38.09 1h2t h ASN 621 CO -0.04 1.19 0.59 -0.25 -1.65 0.00 0.00 177.43 177.27 1h2t h TRP 622 N 0.63 1.09 -0.15 1.19 7.01 -0.30 -1.54 115.95 123.87 1h2t h TRP 622 Ca 0.05 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.06 1h2t h TRP 622 Cb 0.95 -0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 27.64 1h2t h TRP 622 CO 0.07 0.55 -0.02 0.82 -2.79 0.00 0.00 178.44 177.07 1h2t h ILE 623 N 1.06 1.11 -0.16 2.65 2.04 -1.10 -1.65 117.51 121.47 1h2t h ILE 623 Ca 0.41 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1h2t h ILE 623 Cb 0.18 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1h2t h ILE 623 CO -0.18 0.15 0.00 0.49 0.00 0.00 0.00 178.15 178.61 1h2t n PHE 624 N -4.39 0.19 -1.26 1.37 3.01 -0.72 -4.84 117.46 110.82 1h2t n PHE 624 Ca -0.01 -0.09 -0.33 0.00 1.01 0.00 0.00 57.45 58.03 1h2t n PHE 624 Cb 0.18 0.00 0.10 0.00 -0.01 0.00 0.00 39.48 39.75 1h2t n PHE 624 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1h2t s SER 625 N -1.76 4.08 0.58 4.37 1.04 -0.62 -4.91 113.70 116.48 1h2t s SER 625 Ca 0.34 2.15 0.36 0.00 0.48 0.00 0.00 55.95 59.28 1h2t s SER 625 Cb 0.20 -2.56 1.66 0.00 0.10 0.00 0.00 66.02 65.42 1h2t s SER 625 CO 0.30 -2.33 2.09 0.77 0.98 0.00 0.00 173.24 175.06 1h2t h SER 626 N -0.82 0.00 -0.29 7.02 4.64 -1.92 -2.85 113.55 119.33 1h2t h SER 626 Ca -0.45 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.82 1h2t h SER 626 Cb 1.27 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.34 1h2t h SER 626 CO 0.49 0.01 0.05 -0.33 -0.87 0.00 0.00 176.83 176.18 1h2t h GLU 627 N 0.00 0.57 -0.68 4.77 3.07 -1.90 -2.54 114.58 117.87 1h2t h GLU 627 Ca -0.00 -0.11 0.00 0.00 -0.50 0.00 0.00 59.36 58.75 1h2t h GLU 627 Cb 0.37 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 1h2t h GLU 627 CO 0.00 0.55 0.00 1.28 -1.40 0.00 0.00 179.01 179.45 1h2t n LEU 628 N -4.30 3.94 -0.03 1.33 4.32 -1.08 -4.52 117.00 116.65 1h2t n LEU 628 Ca 0.02 -2.05 0.12 0.00 -0.02 0.00 0.00 56.01 54.07 1h2t n LEU 628 Cb 0.22 -0.47 0.53 0.00 -1.62 0.00 0.00 43.42 42.07 1h2t n LEU 628 CO 0.39 0.94 1.17 -1.28 -1.22 0.00 0.00 177.39 177.39 1h2t h SER 629 N 4.02 0.30 1.23 -1.43 0.87 -1.42 0.74 113.55 117.86 1h2t h SER 629 Ca 0.00 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.46 1h2t h SER 629 Cb 1.02 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.90 1h2t h SER 629 CO 0.03 0.19 -0.52 0.03 -0.53 0.00 0.00 176.83 176.03 1h2t h ARG 630 N 0.34 0.00 -0.40 2.24 3.08 -1.80 -3.22 114.38 114.63 1h2t h ARG 630 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1h2t h ARG 630 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1h2t h ARG 630 CO -0.06 0.52 0.00 -0.25 -1.07 0.00 0.00 179.97 179.11 1h2t n ASP 631 N -3.33 3.74 0.26 7.04 8.00 -0.53 -4.64 116.55 127.09 1h2t n ASP 631 Ca 0.01 -2.46 0.10 0.00 0.71 0.00 0.00 54.79 53.15 1h2t n ASP 631 Cb 0.69 -0.43 0.69 0.00 -0.02 0.00 0.00 41.12 42.05 1h2t n ASP 631 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1h2t h PHE 632 N 2.50 0.00 -0.01 1.24 3.57 -0.91 -2.03 116.94 121.30 1h2t h PHE 632 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1h2t h PHE 632 Cb 1.16 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.90 1h2t h PHE 632 CO 0.46 0.06 -0.34 0.25 -2.23 0.00 0.00 178.31 176.51 1h2t n THR 633 N -4.21 0.00 -2.64 4.41 -2.24 -1.26 -4.87 114.28 103.47 1h2t n THR 633 Ca -0.03 -0.12 -0.40 0.00 -2.27 0.00 0.00 64.05 61.24 1h2t n THR 633 Cb 0.14 0.48 -0.05 0.00 -2.10 0.00 0.00 70.33 68.80 1h2t n THR 633 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1h2t s ARG 634 N -2.59 4.74 0.39 -0.78 0.52 -0.76 -4.97 118.95 115.49 1h2t s ARG 634 Ca 0.21 1.61 0.14 0.00 -0.52 0.00 0.00 55.73 57.17 1h2t s ARG 634 Cb 0.19 -3.19 0.98 0.00 0.52 0.00 0.00 34.95 33.44 1h2t s ARG 634 CO 0.56 0.37 1.86 -0.07 0.02 0.00 0.00 175.30 178.04 1h2t h LEU 635 N 3.91 0.51 -1.78 2.53 4.07 -1.91 -2.53 115.31 120.10 1h2t h LEU 635 Ca -0.46 0.05 -0.02 0.00 0.08 0.00 0.00 57.88 57.53 1h2t h LEU 635 Cb 1.20 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.89 1h2t h LEU 635 CO 0.67 0.22 -0.03 2.19 -1.08 0.00 0.00 178.44 180.41 1h2t h PHE 636 N 0.51 0.09 -0.20 1.13 -0.00 -1.93 -1.45 116.94 115.09 1h2t h PHE 636 Ca 0.47 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 58.43 1h2t h PHE 636 Cb 1.00 -0.03 -0.01 0.00 -0.00 0.00 0.00 35.95 36.91 1h2t h PHE 636 CO -0.00 0.13 0.10 0.28 -0.00 0.00 0.00 178.31 178.82 1h2t h VAL 637 N 0.09 1.13 0.00 0.88 2.07 -1.73 -1.18 116.25 117.51 1h2t h VAL 637 Ca 0.02 -0.37 -0.11 0.00 0.82 0.00 0.00 66.70 67.06 1h2t h VAL 637 Cb 0.12 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1h2t h VAL 637 CO 0.01 0.13 -0.54 -0.50 0.02 0.00 0.00 177.57 176.69 1h2t h TRP 638 N 0.20 0.00 -0.40 1.57 4.06 -1.56 -1.66 115.95 118.15 1h2t h TRP 638 Ca 0.07 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.90 1h2t h TRP 638 Cb 0.11 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.26 1h2t h TRP 638 CO -0.03 0.54 -0.20 0.93 -3.56 0.00 0.00 178.44 176.12 1h2t h GLU 639 N 0.00 0.85 -0.36 0.49 5.08 -1.10 -0.64 114.58 118.90 1h2t h GLU 639 Ca -0.01 -0.37 -0.03 0.00 -1.00 0.00 0.00 59.36 57.96 1h2t h GLU 639 Cb 1.07 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.28 1h2t h GLU 639 CO 0.07 1.01 0.12 0.82 -1.00 0.00 0.00 179.01 180.03 1h2t h ILE 640 N 0.66 1.20 0.31 3.13 2.04 -1.02 0.34 117.51 124.18 1h2t h ILE 640 Ca 0.09 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 1h2t h ILE 640 Cb 0.76 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1h2t h ILE 640 CO 0.06 0.23 -0.22 0.25 0.00 0.00 0.00 178.15 178.47 1h2t h LEU 641 N 0.42 -0.55 -1.49 1.44 5.85 -1.18 0.10 115.31 119.90 1h2t h LEU 641 Ca 0.12 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 1h2t h LEU 641 Cb 0.23 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1h2t h LEU 641 CO -0.01 -0.34 0.14 0.45 -0.34 0.00 0.00 178.44 178.34 1h2t h HIS 642 N -0.52 0.47 -0.27 1.25 3.86 -1.06 0.11 115.15 118.98 1h2t h HIS 642 Ca -0.03 -0.01 -0.12 0.00 -1.16 0.00 0.00 60.37 59.06 1h2t h HIS 642 Cb 0.45 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 1h2t h HIS 642 CO -0.11 0.37 -0.31 1.03 0.86 0.00 0.00 177.93 179.77 1h2t h SER 643 N 0.48 0.59 -0.25 2.45 0.87 -0.52 -1.24 113.55 115.92 1h2t h SER 643 Ca 0.12 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.41 1h2t h SER 643 Cb 0.10 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1h2t h SER 643 CO -0.01 0.87 0.00 0.74 -0.53 0.00 0.00 176.83 177.90 1h2t h THR 644 N 0.49 1.26 -0.86 2.23 2.02 0.54 -2.25 112.91 116.34 1h2t h THR 644 Ca 0.06 -0.91 -0.03 0.00 0.77 0.00 0.00 66.41 66.31 1h2t h THR 644 Cb 0.78 1.35 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 1h2t h THR 644 CO 0.06 0.29 0.43 0.40 0.37 0.00 0.00 175.52 177.07 1h2t h ILE 645 N 0.23 1.26 -0.51 3.11 2.04 -0.90 -1.97 117.51 120.76 1h2t h ILE 645 Ca 0.07 -0.70 0.01 0.00 1.00 0.00 0.00 64.86 65.24 1h2t h ILE 645 Cb 0.42 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 1h2t h ILE 645 CO 0.01 0.30 0.34 0.03 0.00 0.00 0.00 178.15 178.84 1h2t h ARG 646 N 1.21 0.67 -0.77 2.37 3.08 -1.07 0.62 114.38 120.49 1h2t h ARG 646 Ca 0.30 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1h2t h ARG 646 Cb 0.09 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 1h2t h ARG 646 CO -0.04 0.44 0.50 0.87 -1.07 0.00 0.00 179.97 180.67 1h2t h LYS 647 N 0.69 1.02 -0.66 0.04 1.57 -1.06 -2.01 116.57 116.16 1h2t h LYS 647 Ca 0.19 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 1h2t h LYS 647 Cb -0.07 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 31.98 1h2t h LYS 647 CO -0.05 0.69 0.26 1.98 -0.57 0.00 0.00 179.45 181.76 1h2t h MET 648 N 1.04 0.97 0.00 3.15 4.05 -0.72 -1.62 114.93 121.80 1h2t h MET 648 Ca 0.28 -0.16 -0.01 0.00 -0.28 0.00 0.00 59.70 59.53 1h2t h MET 648 Cb -0.10 -0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 30.53 1h2t h MET 648 CO -0.06 0.79 -0.06 -0.91 0.23 0.00 0.00 176.91 176.90 1h2t h ASN 649 N 0.95 0.00 0.65 1.39 -0.26 -0.18 -2.26 115.58 115.88 1h2t h ASN 649 Ca 0.22 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.96 1h2t h ASN 649 Cb 0.19 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.45 1h2t h ASN 649 CO -0.02 0.06 -0.79 0.29 -1.06 0.00 0.00 177.43 175.91 1h2t n LYS 650 N -3.39 0.27 -1.83 0.81 5.02 -0.64 -4.88 118.16 113.52 1h2t n LYS 650 Ca -0.02 0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 55.89 1h2t n LYS 650 Cb 0.21 -1.63 -0.03 0.00 -0.02 0.00 0.00 35.03 33.56 1h2t n LYS 650 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1h2t s HIS 651 N -3.17 1.80 0.14 2.13 3.76 -0.85 -4.95 115.29 114.15 1h2t s HIS 651 Ca 0.05 -0.06 -0.30 0.00 -0.15 0.00 0.00 55.06 54.60 1h2t s HIS 651 Cb 0.14 -4.08 -0.06 0.00 1.11 0.00 0.00 32.58 29.69 1h2t s HIS 651 CO 0.75 -4.63 1.01 0.54 -0.85 0.00 0.00 174.74 171.56 1h2t s VAL 652 N 3.82 4.27 -1.13 -0.90 0.11 -1.26 -3.75 120.40 121.55 1h2t s VAL 652 Ca 0.80 1.92 -0.06 0.00 -2.93 0.00 0.00 61.98 61.71 1h2t s VAL 652 Cb -0.39 -4.23 0.01 0.00 -1.53 0.00 0.00 36.38 30.24 1h2t s VAL 652 CO 0.35 0.31 0.84 0.61 -3.33 0.00 0.00 175.10 173.88 1h2t n GLY 653 N 2.17 -0.26 1.84 6.54 0.00 -1.26 -4.94 105.19 109.28 1h2t n GLY 653 Ca 0.02 0.04 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 1h2t n GLY 653 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2t n ALA 702 N -4.19 3.64 -0.22 4.61 0.00 -1.25 -4.88 120.51 118.22 1h2t n ALA 702 Ca -0.02 -3.17 0.02 0.00 0.00 0.00 0.00 53.44 50.27 1h2t n ALA 702 Cb 0.56 -0.54 0.13 0.00 0.00 0.00 0.00 19.45 19.60 1h2t n ALA 702 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1h2t h GLN 703 N 1.84 0.35 -0.19 0.00 4.20 -1.92 0.98 115.11 120.37 1h2t h GLN 703 Ca 0.05 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 1h2t h GLN 703 Cb 1.41 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 29.10 1h2t h GLN 703 CO 0.33 0.23 0.10 1.03 -0.67 0.00 0.00 178.83 179.85 1h2t h SER 704 N 0.36 0.24 -0.75 1.46 0.87 -1.99 0.71 113.55 114.45 1h2t h SER 704 Ca 0.34 -0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.78 1h2t h SER 704 Cb 0.49 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.36 1h2t h SER 704 CO -0.38 0.25 0.33 -0.08 -0.53 0.00 0.00 176.83 176.42 1h2t h GLU 705 N 0.20 1.10 0.07 2.24 4.81 -1.78 -0.25 114.58 120.97 1h2t h GLU 705 Ca 0.07 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1h2t h GLU 705 Cb 0.07 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.26 1h2t h GLU 705 CO -0.01 0.88 -0.03 0.37 -0.73 0.00 0.00 179.01 179.49 1h2t h GLN 706 N 1.07 -0.09 -0.70 1.92 4.15 -0.64 -0.19 115.11 120.63 1h2t h GLN 706 Ca 0.25 0.01 0.05 0.00 0.77 0.00 0.00 58.65 59.73 1h2t h GLN 706 Cb 0.17 0.02 -0.05 0.00 0.21 0.00 0.00 27.48 27.83 1h2t h GLN 706 CO -0.03 0.12 0.41 -0.22 -1.93 0.00 0.00 178.83 177.18 1h2t h LYS 707 N -0.28 0.73 -0.29 1.69 3.64 -0.68 -1.31 116.57 120.07 1h2t h LYS 707 Ca -0.01 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 1h2t h LYS 707 Cb 0.25 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 1h2t h LYS 707 CO 0.02 0.49 -0.09 -0.91 -2.27 0.00 0.00 179.45 176.68 1h2t h ASN 708 N 0.76 0.46 -0.32 4.20 -0.26 -0.84 -1.12 115.58 118.46 1h2t h ASN 708 Ca 0.31 -0.11 0.01 0.00 -0.56 0.00 0.00 56.30 55.94 1h2t h ASN 708 Cb 0.16 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 37.28 1h2t h ASN 708 CO -0.17 0.60 0.21 0.25 -1.06 0.00 0.00 177.43 177.26 1h2t h LEU 709 N 0.45 0.36 -0.62 1.61 5.85 0.12 -1.47 115.31 121.61 1h2t h LEU 709 Ca 0.09 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.69 1h2t h LEU 709 Cb 0.44 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1h2t h LEU 709 CO 0.02 0.26 -0.08 -0.26 -0.34 0.00 0.00 178.44 178.04 1h2t h PHE 710 N 0.43 1.11 -0.16 1.25 -1.00 -1.01 -2.16 116.94 115.40 1h2t h PHE 710 Ca 0.12 -0.22 0.02 0.00 2.81 0.00 0.00 57.97 60.70 1h2t h PHE 710 Cb -0.04 -0.28 -0.02 0.00 3.61 0.00 0.00 35.95 39.22 1h2t h PHE 710 CO -0.06 1.02 0.04 -0.07 -1.61 0.00 0.00 178.31 177.63 1h2t h LEU 711 N 0.90 0.02 -0.37 1.54 3.38 -0.97 -0.43 115.31 119.39 1h2t h LEU 711 Ca 0.15 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.17 1h2t h LEU 711 Cb 0.64 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 1h2t h LEU 711 CO 0.04 0.04 0.16 0.58 0.09 0.00 0.00 178.44 179.35 1h2t h VAL 712 N 0.11 0.95 -0.23 1.22 2.07 -1.18 0.15 116.25 119.33 1h2t h VAL 712 Ca 0.07 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.49 1h2t h VAL 712 Cb 0.06 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1h2t h VAL 712 CO -0.09 0.06 0.12 0.40 0.02 0.00 0.00 177.57 178.08 1h2t h ILE 713 N 0.34 1.00 -0.82 4.57 2.04 -1.10 -1.10 117.51 122.44 1h2t h ILE 713 Ca 0.16 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.93 1h2t h ILE 713 Cb 0.10 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 1h2t h ILE 713 CO -0.13 0.04 0.50 -0.26 0.00 0.00 0.00 178.15 178.30 1h2t h PHE 714 N 0.24 1.08 0.29 1.37 0.04 -0.71 -1.70 116.94 117.55 1h2t h PHE 714 Ca 0.09 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 1h2t h PHE 714 Cb 0.02 -0.36 -0.00 0.00 2.20 0.00 0.00 35.95 37.81 1h2t h PHE 714 CO -0.09 0.72 -0.17 1.96 -0.60 0.00 0.00 178.31 180.12 1h2t h GLN 715 N 1.13 -0.43 -0.88 1.51 4.20 -0.54 0.10 115.11 120.20 1h2t h GLN 715 Ca 0.30 0.03 0.11 0.00 0.06 0.00 0.00 58.65 59.15 1h2t h GLN 715 Cb -0.05 0.10 -0.08 0.00 0.30 0.00 0.00 27.48 27.75 1h2t h GLN 715 CO -0.06 -0.29 0.51 0.00 -0.67 0.00 0.00 178.83 178.33 1h2t h ARG 716 N -0.45 0.79 -0.03 1.46 2.47 -1.02 0.25 114.38 117.85 1h2t h ARG 716 Ca -0.03 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 58.64 1h2t h ARG 716 Cb 0.37 -0.18 -0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1h2t h ARG 716 CO 0.03 0.52 0.00 0.74 0.56 0.00 0.00 179.97 181.83 1h2t h PHE 717 N 0.81 0.05 -0.86 3.04 0.04 -0.95 -1.57 116.94 117.50 1h2t h PHE 717 Ca 0.44 -0.01 0.09 0.00 2.80 0.00 0.00 57.97 61.29 1h2t h PHE 717 Cb 0.45 -0.01 -0.07 0.00 2.20 0.00 0.00 35.95 38.52 1h2t h PHE 717 CO -0.05 0.30 0.52 0.82 -0.60 0.00 0.00 178.31 179.29 1h2t h ILE 718 N -0.21 0.96 0.11 -0.55 2.04 -0.17 0.24 117.51 119.92 1h2t h ILE 718 Ca 0.01 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 1h2t h ILE 718 Cb 0.28 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.35 1h2t h ILE 718 CO 0.00 0.16 -0.05 -0.03 0.00 0.00 0.00 178.15 178.23 1h2t h MET 719 N 0.88 -0.15 -0.24 2.37 4.05 -0.84 -0.03 114.93 120.98 1h2t h MET 719 Ca 0.40 0.01 -0.10 0.00 -0.28 0.00 0.00 59.70 59.73 1h2t h MET 719 Cb 0.31 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.13 1h2t h MET 719 CO -0.22 0.17 -0.29 -0.84 0.23 0.00 0.00 176.91 175.96 1h2t h ILE 720 N -0.47 1.28 -0.36 1.77 3.07 -1.07 -1.36 117.51 120.35 1h2t h ILE 720 Ca -0.02 -1.35 -0.09 0.00 1.55 0.00 0.00 64.86 64.95 1h2t h ILE 720 Cb 0.39 1.41 -0.01 0.00 -0.27 0.00 0.00 36.82 38.34 1h2t h ILE 720 CO 0.03 0.43 -0.12 -0.07 -1.05 0.00 0.00 178.15 177.36 1h2t h LEU 721 N 0.42 0.74 -0.44 0.16 3.38 -0.95 -2.51 115.31 116.10 1h2t h LEU 721 Ca 0.06 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1h2t h LEU 721 Cb 0.73 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1h2t h LEU 721 CO 0.06 0.95 0.24 0.74 0.09 0.00 0.00 178.44 180.52 1h2t h THR 722 N 0.52 1.16 -0.38 0.22 2.02 -0.76 -0.41 112.91 115.27 1h2t h THR 722 Ca 0.09 -0.41 0.05 0.00 0.77 0.00 0.00 66.41 66.91 1h2t h THR 722 Cb 0.65 0.62 -0.05 0.00 -1.74 0.00 0.00 68.15 67.63 1h2t h THR 722 CO 0.04 0.17 0.11 -0.08 0.37 0.00 0.00 175.52 176.13 1h2t h GLU 723 N 0.58 0.25 0.07 6.66 4.81 -1.22 0.14 114.58 125.86 1h2t h GLU 723 Ca 0.16 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1h2t h GLU 723 Cb 0.05 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.37 1h2t h GLU 723 CO -0.03 0.16 -0.05 1.25 -0.73 0.00 0.00 179.01 179.62 1h2t h HIS 724 N 0.25 -0.12 -0.47 0.92 2.76 -1.15 0.03 115.15 117.37 1h2t h HIS 724 Ca 0.18 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 1h2t h HIS 724 Cb 0.18 0.04 -0.02 0.00 1.55 0.00 0.00 27.41 29.16 1h2t h HIS 724 CO -0.16 -0.08 0.24 -0.07 -1.30 0.00 0.00 177.93 176.56 1h2t h LEU 725 N -0.12 0.58 -0.03 0.26 3.38 -0.63 -0.88 115.31 117.87 1h2t h LEU 725 Ca -0.00 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 1h2t h LEU 725 Cb 0.10 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.72 1h2t h LEU 725 CO 0.00 0.49 -0.45 0.58 0.09 0.00 0.00 178.44 179.15 1h2t h VAL 726 N 0.65 1.44 0.00 1.22 2.07 -0.55 -2.83 116.25 118.25 1h2t h VAL 726 Ca 0.17 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.75 1h2t h VAL 726 Cb 0.05 2.51 -0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1h2t h VAL 726 CO -0.02 0.55 -0.04 -0.09 0.02 0.00 0.00 177.57 177.99 1h2t h ARG 727 N -0.17 0.00 0.00 1.57 2.43 -0.71 0.28 114.38 117.78 1h2t h ARG 727 Ca -0.05 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.05 1h2t h ARG 727 Cb 1.14 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.68 1h2t h ARG 727 CO 0.09 0.04 -0.37 0.00 -1.51 0.00 0.00 179.97 178.22 1h2t h GLU 729 N 0.00 0.00 0.08 0.00 4.81 -0.83 -1.11 114.58 117.53 1h2t h GLU 729 Ca -0.00 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.94 1h2t h GLU 729 Cb 1.27 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.63 1h2t h GLU 729 CO 0.05 0.51 -1.46 1.15 -0.73 0.00 0.00 179.01 178.53 1h2t h THR 730 N 0.00 1.22 -0.27 0.32 2.02 -0.55 -3.32 112.91 112.32 1h2t h THR 730 Ca -0.23 -2.89 0.00 0.00 0.77 0.00 0.00 66.41 64.06 1h2t h THR 730 Cb 1.90 2.74 0.00 0.00 -1.74 0.00 0.00 68.15 71.05 1h2t h THR 730 CO 0.08 0.81 0.00 0.47 0.37 0.00 0.00 175.52 177.24 1h2t n ASP 731 N -3.39 3.06 -3.86 4.18 9.92 -0.18 -4.99 116.55 121.30 1h2t n ASP 731 Ca -0.14 -1.90 -0.27 0.00 -0.53 0.00 0.00 54.79 51.96 1h2t n ASP 731 Cb 1.03 -0.17 0.00 0.00 -0.64 0.00 0.00 41.12 41.34 1h2t n ASP 731 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1h2t n GLY 732 N 1.20 -0.44 3.91 0.44 0.00 -0.72 -4.98 105.19 104.60 1h2t n GLY 732 Ca 0.15 0.23 -0.25 0.00 0.00 0.00 0.00 46.02 46.15 1h2t n GLY 732 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h2t s THR 733 N -3.79 1.85 0.03 2.61 2.01 -0.50 -5.02 115.64 112.82 1h2t s THR 733 Ca 0.13 -1.43 -0.30 0.00 0.31 0.00 0.00 61.69 60.39 1h2t s THR 733 Cb -0.05 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 70.13 1h2t s THR 733 CO 0.87 0.00 1.23 -0.55 -0.69 0.00 0.00 174.62 175.48 1h2t s SER 734 N -4.28 7.04 -0.13 3.53 0.15 -1.26 -4.79 113.70 113.95 1h2t s SER 734 Ca 0.39 1.98 -0.28 0.00 0.70 0.00 0.00 55.95 58.74 1h2t s SER 734 Cb -0.02 -2.57 -0.25 0.00 -1.71 0.00 0.00 66.02 61.47 1h2t s SER 734 CO 0.24 -0.53 0.79 0.58 1.20 0.00 0.00 173.24 175.51 1h2t h VAL 735 N 4.68 1.72 0.00 4.45 2.07 -1.96 -3.39 116.25 123.82 1h2t h VAL 735 Ca -0.39 -2.22 -0.64 0.00 0.82 0.00 0.00 66.70 64.27 1h2t h VAL 735 Cb 1.20 3.21 0.01 0.00 -1.52 0.00 0.00 31.29 34.18 1h2t h VAL 735 CO 0.84 0.57 2.95 0.18 0.02 0.00 0.00 177.57 182.13 1h2t n LEU 736 N -4.63 6.14 -4.95 2.57 4.77 -1.26 -4.67 117.00 114.96 1h2t n LEU 736 Ca -0.10 -3.65 -0.23 0.00 -0.03 0.00 0.00 56.01 52.00 1h2t n LEU 736 Cb 0.45 -1.41 -0.01 0.00 -2.33 0.00 0.00 43.42 40.12 1h2t n LEU 736 CO 0.33 0.79 0.17 0.42 -1.33 0.00 0.00 177.39 177.77 1h2t s THR 737 N 3.57 4.93 0.38 -5.08 -4.23 -1.26 -4.89 115.64 109.06 1h2t s THR 737 Ca 0.53 -0.53 0.13 0.00 -1.18 0.00 0.00 61.69 60.64 1h2t s THR 737 Cb 0.14 -3.79 0.35 0.00 1.34 0.00 0.00 72.50 70.53 1h2t s THR 737 CO -0.02 -0.50 1.86 1.55 -0.54 0.00 0.00 174.62 176.98 1h2t h PRO 738 N 0.74 0.54 -0.43 3.99 0.13 -1.92 0.12 132.00 135.17 1h2t h PRO 738 Ca -0.49 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.57 1h2t h PRO 738 Cb 1.23 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 1h2t h PRO 738 CO 0.60 0.36 0.15 2.35 -0.23 0.00 0.00 178.00 181.23 1h2t h TRP 739 N 0.56 0.68 -0.43 1.56 7.01 -1.93 -2.52 115.95 120.87 1h2t h TRP 739 Ca 0.45 -0.06 -0.06 0.00 2.11 0.00 0.00 58.89 61.33 1h2t h TRP 739 Cb 0.91 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 27.76 1h2t h TRP 739 CO -0.00 0.61 0.03 -0.92 -2.79 0.00 0.00 178.44 175.37 1h2t h TYR 740 N 0.55 0.80 -0.58 2.65 3.20 -1.15 -1.16 116.97 121.28 1h2t h TYR 740 Ca 0.14 -0.13 0.08 0.00 3.14 0.00 0.00 58.73 61.97 1h2t h TYR 740 Cb 0.24 -0.21 -0.07 0.00 1.54 0.00 0.00 36.73 38.23 1h2t h TYR 740 CO 0.01 0.78 0.22 -0.22 -1.64 0.00 0.00 178.16 177.31 1h2t h LYS 741 N 0.58 0.40 0.33 1.82 3.64 -0.83 0.13 116.57 122.65 1h2t h LYS 741 Ca 0.13 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1h2t h LYS 741 Cb 0.44 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1h2t h LYS 741 CO 0.02 0.26 -0.16 -0.97 -2.27 0.00 0.00 179.45 176.33 1h2t h ASN 742 N 0.41 -0.38 -0.15 4.20 -1.24 -1.31 -1.93 115.58 115.18 1h2t h ASN 742 Ca 0.28 -0.15 0.05 0.00 0.71 0.00 0.00 56.30 57.19 1h2t h ASN 742 Cb 0.32 0.10 -0.06 0.00 0.73 0.00 0.00 38.32 39.41 1h2t h ASN 742 CO -0.28 -0.04 -0.26 0.00 -1.29 0.00 0.00 177.43 175.57 1h2t h ILE 744 N -0.32 1.17 0.00 0.00 6.09 -1.06 -2.11 117.51 121.28 1h2t h ILE 744 Ca 0.11 -0.69 -0.12 0.00 -1.37 0.00 0.00 64.86 62.78 1h2t h ILE 744 Cb 0.48 1.05 -0.02 0.00 0.47 0.00 0.00 36.82 38.80 1h2t h ILE 744 CO -0.33 0.23 -0.60 -0.33 -3.07 0.00 0.00 178.15 174.05 1h2t h GLU 745 N 0.34 0.00 0.00 2.19 5.08 -0.46 -2.39 114.58 119.33 1h2t h GLU 745 Ca 0.07 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.33 1h2t h GLU 745 Cb 0.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1h2t h GLU 745 CO 0.01 0.58 -0.50 0.00 -1.00 0.00 0.00 179.01 178.10 1h2t h ARG 746 N 0.00 0.00 -0.05 2.33 2.47 0.29 0.54 114.38 119.95 1h2t h ARG 746 Ca -0.01 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.65 1h2t h ARG 746 Cb 1.45 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.78 1h2t h ARG 746 CO 0.08 0.50 -0.21 1.25 0.56 0.00 0.00 179.97 182.14 1h2t h LEU 747 N 0.00 0.28 -0.77 3.04 5.85 -1.32 -2.62 115.31 119.78 1h2t h LEU 747 Ca -0.00 -0.64 0.10 0.00 0.84 0.00 0.00 57.88 58.17 1h2t h LEU 747 Cb 1.04 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.91 1h2t h LEU 747 CO 0.06 0.87 0.41 -0.61 -0.34 0.00 0.00 178.44 178.83 1h2t h GLN 748 N -0.30 0.66 -0.40 1.25 4.15 -1.24 -1.64 115.11 117.59 1h2t h GLN 748 Ca -0.01 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.37 1h2t h GLN 748 Cb 0.86 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 28.38 1h2t h GLN 748 CO 0.05 0.43 0.24 0.37 -1.93 0.00 0.00 178.83 177.99 1h2t h GLN 749 N 0.68 0.54 -0.25 1.69 4.15 -0.76 -1.13 115.11 120.03 1h2t h GLN 749 Ca 0.38 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.75 1h2t h GLN 749 Cb 0.39 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 1h2t h GLN 749 CO -0.27 0.38 0.14 0.82 -1.93 0.00 0.00 178.83 177.97 1h2t h ILE 750 N 0.55 1.12 -0.25 2.39 1.08 -0.92 0.10 117.51 121.58 1h2t h ILE 750 Ca 0.15 -0.31 -0.01 0.00 -0.39 0.00 0.00 64.86 64.29 1h2t h ILE 750 Cb -0.01 0.87 -0.01 0.00 -3.07 0.00 0.00 36.82 34.60 1h2t h ILE 750 CO -0.03 0.11 0.10 -0.26 -0.69 0.00 0.00 178.15 177.38 1h2t h PHE 751 N 0.29 0.38 0.02 1.37 0.04 -1.31 -1.95 116.94 115.78 1h2t h PHE 751 Ca 0.09 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 1h2t h PHE 751 Cb 0.06 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.10 1h2t h PHE 751 CO -0.04 0.40 -0.01 -0.07 -0.60 0.00 0.00 178.31 177.99 1h2t h LEU 752 N 0.25 -0.02 -1.52 1.54 3.38 -1.04 0.10 115.31 118.00 1h2t h LEU 752 Ca 0.08 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1h2t h LEU 752 Cb 0.18 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1h2t h LEU 752 CO -0.01 -0.01 -0.21 -0.61 0.09 0.00 0.00 178.44 177.69 1h2t h GLN 753 N -0.03 0.00 -0.13 1.13 4.15 -0.74 -3.27 115.11 116.21 1h2t h GLN 753 Ca -0.00 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.26 1h2t h GLN 753 Cb 0.03 0.00 -0.25 0.00 0.21 0.00 0.00 27.48 27.46 1h2t h GLN 753 CO 0.00 0.21 -0.83 0.72 -1.93 0.00 0.00 178.83 177.00 1h2t n HIS 754 N -3.64 0.43 -0.30 3.99 8.25 -0.74 -4.91 115.22 118.30 1h2t n HIS 754 Ca -0.01 -1.24 0.06 0.00 -0.26 0.00 0.00 57.72 56.27 1h2t n HIS 754 Cb 0.34 -0.22 0.21 0.00 1.12 0.00 0.00 29.99 31.45 1h2t n HIS 754 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 1h2t h HIS 755 N 1.31 0.85 -0.32 4.41 2.07 -0.85 -1.67 115.15 120.95 1h2t h HIS 755 Ca -0.07 0.03 0.01 0.00 -2.85 0.00 0.00 60.37 57.49 1h2t h HIS 755 Cb 1.46 -0.25 -0.02 0.00 2.57 0.00 0.00 27.41 31.17 1h2t h HIS 755 CO 0.50 0.26 0.20 0.37 -3.07 0.00 0.00 177.93 176.19 1h2t h GLN 756 N 0.72 0.39 0.07 5.12 4.15 -1.90 -1.26 115.11 122.40 1h2t h GLN 756 Ca 0.45 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.85 1h2t h GLN 756 Cb 0.56 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.17 1h2t h GLN 756 CO -0.32 0.26 -0.03 0.82 -1.93 0.00 0.00 178.83 177.62 1h2t h ILE 757 N 0.40 1.07 -0.19 2.39 2.04 -1.87 -3.12 117.51 118.24 1h2t h ILE 757 Ca 0.12 -0.48 0.05 0.00 1.00 0.00 0.00 64.86 65.55 1h2t h ILE 757 Cb -0.02 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1h2t h ILE 757 CO -0.04 0.12 0.16 0.40 0.00 0.00 0.00 178.15 178.79 1h2t h ILE 758 N -0.32 0.69 -0.12 -0.67 2.04 -1.19 -1.40 117.51 116.55 1h2t h ILE 758 Ca -0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 1h2t h ILE 758 Cb 0.27 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.23 1h2t h ILE 758 CO 0.02 0.00 0.11 1.56 0.00 0.00 0.00 178.15 179.83 1h2t h GLN 759 N 0.00 0.00 0.00 2.37 1.08 -1.16 -0.04 115.11 117.36 1h2t h GLN 759 Ca 0.09 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.29 1h2t h GLN 759 Cb 0.41 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 1h2t h GLN 759 CO -0.00 0.00 0.00 1.04 -0.95 0.00 0.00 178.83 178.92 1h2t n GLN 760 N -4.10 0.20 -0.43 1.46 6.02 -0.53 -2.88 117.38 117.12 1h2t n GLN 760 Ca -0.00 0.35 0.09 0.00 -0.01 0.00 0.00 57.00 57.43 1h2t n GLN 760 Cb 0.22 -1.83 0.30 0.00 1.02 0.00 0.00 30.24 29.95 1h2t n GLN 760 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1h2t n TYR 761 N -2.20 1.07 -0.19 1.08 0.53 -0.03 -4.74 117.16 112.68 1h2t n TYR 761 Ca 0.03 -0.57 -0.01 0.00 -1.02 0.00 0.00 57.90 56.33 1h2t n TYR 761 Cb 0.29 -0.12 0.06 0.00 -1.03 0.00 0.00 39.34 38.53 1h2t n TYR 761 CO 0.00 0.00 0.00 0.52 -1.02 0.00 0.00 176.86 176.36 1h2t h MET 762 N 3.61 0.01 0.21 -0.72 2.86 -1.59 -0.78 114.93 118.54 1h2t h MET 762 Ca 0.00 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1h2t h MET 762 Cb 1.15 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.81 1h2t h MET 762 CO 0.10 0.01 -0.10 0.28 1.06 0.00 0.00 176.91 178.26 1h2t h VAL 763 N 0.02 0.85 -0.86 -2.22 2.07 -1.88 -1.33 116.25 112.89 1h2t h VAL 763 Ca 0.28 -0.32 0.08 0.00 0.82 0.00 0.00 66.70 67.56 1h2t h VAL 763 Cb 0.43 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 1h2t h VAL 763 CO -0.58 0.07 0.56 0.74 0.02 0.00 0.00 177.57 178.39 1h2t h THR 764 N -0.44 1.00 -0.18 2.57 2.02 -1.87 -1.31 112.91 114.70 1h2t h THR 764 Ca -0.03 -0.31 -0.16 0.00 0.77 0.00 0.00 66.41 66.68 1h2t h THR 764 Cb 0.34 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.78 1h2t h THR 764 CO 0.05 0.16 -0.53 -0.07 0.37 0.00 0.00 175.52 175.50 1h2t h LEU 765 N 0.89 0.77 -0.89 2.58 3.38 -0.96 -0.73 115.31 120.36 1h2t h LEU 765 Ca 0.39 -0.59 -0.11 0.00 0.09 0.00 0.00 57.88 57.65 1h2t h LEU 765 Cb 0.33 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1h2t h LEU 765 CO -0.15 1.23 -0.45 -0.33 0.09 0.00 0.00 178.44 178.82 1h2t h GLU 766 N 0.36 0.24 0.14 1.13 5.08 -0.94 0.11 114.58 120.70 1h2t h GLU 766 Ca -0.02 -0.12 -0.29 0.00 -1.00 0.00 0.00 59.36 57.93 1h2t h GLU 766 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1h2t h GLU 766 CO 0.11 0.64 -1.45 -0.91 -1.00 0.00 0.00 179.01 176.40 1h2t h ASN 767 N 0.19 0.48 0.00 1.42 2.35 -1.28 -3.39 115.58 115.36 1h2t h ASN 767 Ca 0.01 -0.89 -0.31 0.00 -0.55 0.00 0.00 56.30 54.56 1h2t h ASN 767 Cb 0.87 -0.16 -0.06 0.00 0.05 0.00 0.00 38.32 39.03 1h2t h ASN 767 CO 0.07 1.65 -2.16 0.18 -1.65 0.00 0.00 177.43 175.52 1h2t n LEU 768 N -3.84 0.21 -0.00 1.61 4.77 -0.28 -4.89 117.00 114.57 1h2t n LEU 768 Ca -0.23 -0.01 -0.03 0.00 -0.03 0.00 0.00 56.01 55.70 1h2t n LEU 768 Cb 0.95 0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 42.36 1h2t n LEU 768 CO 0.46 0.45 -0.25 0.18 -1.33 0.00 0.00 177.39 176.89 1h2t n LEU 769 N -2.66 1.38 -4.18 2.23 4.77 -0.94 -4.86 117.00 112.74 1h2t n LEU 769 Ca -0.28 0.20 -0.44 0.00 -0.03 0.00 0.00 56.01 55.47 1h2t n LEU 769 Cb 1.04 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1h2t n LEU 769 CO 0.35 -0.57 1.36 0.49 -1.33 0.00 0.00 177.39 177.69 1h2t n PHE 770 N -3.82 3.95 -3.09 -1.77 3.01 0.34 -4.88 117.46 111.20 1h2t n PHE 770 Ca -0.05 -3.17 -0.18 0.00 1.01 0.00 0.00 57.45 55.05 1h2t n PHE 770 Cb 0.19 -1.83 0.01 0.00 -0.01 0.00 0.00 39.48 37.85 1h2t n PHE 770 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1h2t s THR 771 N -0.27 2.79 -1.37 4.37 -4.23 -1.26 -4.54 115.64 111.11 1h2t s THR 771 Ca 0.37 -1.05 0.05 0.00 -1.18 0.00 0.00 61.69 59.88 1h2t s THR 771 Cb 0.00 -2.83 0.08 0.00 1.34 0.00 0.00 72.50 71.09 1h2t s THR 771 CO 0.01 0.00 1.01 0.00 -0.54 0.00 0.00 174.62 175.09 1h2t n ALA 772 N -1.89 1.39 0.15 3.99 0.00 -1.26 -1.88 120.51 121.02 1h2t n ALA 772 Ca 0.09 -0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.56 1h2t n ALA 772 Cb 0.60 -1.08 0.06 0.00 0.00 0.00 0.00 19.45 19.03 1h2t n ALA 772 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1h2t h GLU 773 N 0.00 0.00 -7.09 0.00 5.08 -1.95 -3.47 114.58 107.16 1h2t h GLU 773 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 1h2t h GLU 773 Cb 0.05 0.00 0.09 0.00 0.50 0.00 0.00 28.75 29.39 1h2t h GLU 773 CO 0.00 0.30 0.46 -0.51 -1.00 0.00 0.00 179.01 178.26 1h2t s LEU 774 N -6.26 3.71 0.18 1.33 1.43 -0.79 -4.93 118.68 113.36 1h2t s LEU 774 Ca 0.04 2.30 -0.33 0.00 -1.03 0.00 0.00 54.13 55.11 1h2t s LEU 774 Cb 0.07 -4.58 -0.13 0.00 0.03 0.00 0.00 46.19 41.58 1h2t s LEU 774 CO 0.73 -1.41 1.60 -0.67 0.23 0.00 0.00 176.35 176.83 1h2t n ASP 775 N -1.42 3.32 0.00 2.29 -0.08 -1.26 -4.70 116.55 114.70 1h2t n ASP 775 Ca 0.13 1.08 0.22 0.00 -1.51 0.00 0.00 54.79 54.71 1h2t n ASP 775 Cb 0.50 -1.47 0.59 0.00 2.34 0.00 0.00 41.12 43.08 1h2t n ASP 775 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1h2t h PRO 776 N 5.97 0.00 -0.45 -0.67 0.13 -1.93 0.10 132.00 135.16 1h2t h PRO 776 Ca -0.45 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1h2t h PRO 776 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 1h2t h PRO 776 CO 0.89 0.00 0.21 0.45 -0.23 0.00 0.00 178.00 179.32 1h2t h HIS 777 N 0.00 0.65 0.01 1.56 3.86 -2.00 0.08 115.15 119.30 1h2t h HIS 777 Ca 0.29 -0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.46 1h2t h HIS 777 Cb 1.83 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 30.10 1h2t h HIS 777 CO 0.00 0.53 -0.00 0.82 0.86 0.00 0.00 177.93 180.13 1h2t h ILE 778 N 0.58 1.60 -0.76 2.45 2.04 -1.34 -3.29 117.51 118.78 1h2t h ILE 778 Ca 0.15 -1.87 0.13 0.00 1.00 0.00 0.00 64.86 64.27 1h2t h ILE 778 Cb 0.13 2.86 -0.05 0.00 -0.74 0.00 0.00 36.82 39.02 1h2t h ILE 778 CO -0.02 0.48 0.50 0.25 0.00 0.00 0.00 178.15 179.36 1h2t h LEU 779 N -0.82 0.48 -1.39 1.44 5.85 -1.40 -1.42 115.31 118.05 1h2t h LEU 779 Ca -0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1h2t h LEU 779 Cb 0.79 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.72 1h2t h LEU 779 CO 0.00 0.26 0.36 0.00 -0.34 0.00 0.00 178.44 178.72 1h2t h ALA 780 N 1.64 1.55 -0.81 1.25 0.00 -1.04 -1.36 119.26 120.49 1h2t h ALA 780 Ca 0.37 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 1h2t h ALA 780 Cb 0.71 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1h2t h ALA 780 CO -0.13 0.40 0.38 0.28 0.00 0.00 0.00 179.25 180.18 1h2t h VAL 781 N 0.79 1.25 -0.32 0.00 2.07 -1.37 0.28 116.25 118.96 1h2t h VAL 781 Ca 0.21 -0.72 -0.18 0.00 0.82 0.00 0.00 66.70 66.83 1h2t h VAL 781 Cb -0.05 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 29.94 1h2t h VAL 781 CO -0.04 0.31 -0.51 0.15 0.02 0.00 0.00 177.57 177.49 1h2t h PHE 782 N 1.15 1.12 -0.16 1.57 3.57 -1.43 -2.35 116.94 120.40 1h2t h PHE 782 Ca 0.28 -0.38 -0.08 0.00 3.53 0.00 0.00 57.97 61.31 1h2t h PHE 782 Cb 0.13 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 1h2t h PHE 782 CO 0.01 1.22 -0.27 1.96 -2.23 0.00 0.00 178.31 179.00 1h2t h GLN 783 N 0.70 0.31 -0.25 1.11 4.20 -0.92 -1.70 115.11 118.56 1h2t h GLN 783 Ca 0.03 -0.11 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 1h2t h GLN 783 Cb 1.12 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 1h2t h GLN 783 CO 0.12 0.56 -0.02 1.96 -0.67 0.00 0.00 178.83 180.78 1h2t h GLN 784 N 0.27 0.45 -0.69 1.46 4.20 -0.86 -2.18 115.11 117.76 1h2t h GLN 784 Ca 0.04 -0.15 0.07 0.00 0.06 0.00 0.00 58.65 58.67 1h2t h GLN 784 Cb 0.62 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.31 1h2t h GLN 784 CO 0.04 0.64 0.38 0.35 -0.67 0.00 0.00 178.83 179.57 1h2t h PHE 785 N 0.22 0.69 -0.17 2.96 3.57 -1.07 -1.52 116.94 121.63 1h2t h PHE 785 Ca 0.07 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.52 1h2t h PHE 785 Cb 0.45 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1h2t h PHE 785 CO 0.04 0.31 -0.24 0.00 -2.23 0.00 0.00 178.31 176.19 1h2t h ALA 787 N 1.49 1.00 0.00 0.00 0.00 -0.61 -2.59 119.26 118.55 1h2t h ALA 787 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1h2t h ALA 787 Cb 0.57 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1h2t h ALA 787 CO 0.04 0.00 -0.03 -0.07 0.00 0.00 0.00 179.25 179.19 1h2t h LEU 788 N 0.00 0.00 -1.47 0.00 3.38 -1.42 -3.20 115.31 112.61 1h2t h LEU 788 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h2t h LEU 788 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1h2t h LEU 788 CO 0.00 0.03 -0.07 0.00 0.09 0.00 0.00 178.44 178.49 1h2t n GLN 789 N -3.21 0.44 0.00 1.13 1.13 -1.12 -4.23 117.38 111.52 1h2t n GLN 789 Ca -0.01 -0.77 0.15 0.00 -1.94 0.00 0.00 57.00 54.43 1h2t n GLN 789 Cb 0.21 -0.60 0.78 0.00 0.11 0.00 0.00 30.24 30.75 1h2t n GLN 789 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62