#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h0r n LEU 2 N 0.00 0.00 0.13 -0.89 7.94 -1.26 -4.23 117.00 118.69 3h0r n LEU 2 Ca 0.00 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 55.01 3h0r n LEU 2 Cb 0.00 0.00 0.50 0.00 0.53 0.00 0.00 43.42 44.45 3h0r n LEU 2 CO 0.00 0.00 0.84 -2.67 -1.11 0.00 0.00 177.39 174.45 3h0r n TRP 3 N 0.00 0.76 1.52 1.96 4.27 -1.26 -1.55 117.44 123.14 3h0r n TRP 3 Ca 0.00 0.31 0.14 0.00 -3.89 0.00 0.00 57.50 54.07 3h0r n TRP 3 Cb 0.00 -1.01 0.55 0.00 -1.36 0.00 0.00 31.31 29.50 3h0r n TRP 3 CO 0.00 0.00 0.00 1.17 -2.29 0.00 0.00 177.69 176.57 3h0r n LYS 4 N -2.21 1.53 -3.73 -2.67 4.81 -1.26 -4.92 118.16 109.72 3h0r n LYS 4 Ca 0.01 -0.83 -0.31 0.00 -0.87 0.00 0.00 58.31 56.31 3h0r n LYS 4 Cb 0.19 -1.48 -0.05 0.00 0.02 0.00 0.00 35.03 33.71 3h0r n LYS 4 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 3h0r s LYS 5 N -2.04 3.58 0.91 1.64 1.02 -0.60 -4.84 119.74 119.41 3h0r s LYS 5 Ca 0.38 -0.16 -0.13 0.00 0.02 0.00 0.00 55.97 56.08 3h0r s LYS 5 Cb 0.21 -2.89 0.14 0.00 -0.52 0.00 0.00 37.83 34.77 3h0r s LYS 5 CO 0.35 0.50 1.15 -1.54 -0.92 0.00 0.00 175.35 174.89 3h0r s SER 6 N -2.44 3.50 0.48 2.83 1.04 -1.26 -4.80 113.70 113.05 3h0r s SER 6 Ca 0.40 0.90 0.26 0.00 0.48 0.00 0.00 55.95 57.99 3h0r s SER 6 Cb -0.12 -1.43 1.13 0.00 0.10 0.00 0.00 66.02 65.69 3h0r s SER 6 CO 0.25 -2.55 1.91 -0.07 0.98 0.00 0.00 173.24 173.76 3h0r h LEU 7 N -1.50 0.00 -0.07 2.42 3.38 -1.97 0.20 115.31 117.76 3h0r h LEU 7 Ca -0.50 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.44 3h0r h LEU 7 Cb 1.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 3h0r h LEU 7 CO 0.60 0.17 -0.07 0.28 0.09 0.00 0.00 178.44 179.51 3h0r h SER 8 N 0.00 0.19 -0.35 -0.43 0.02 -1.98 0.12 113.55 111.11 3h0r h SER 8 Ca -0.00 -0.48 -0.01 0.00 -0.84 0.00 0.00 61.79 60.46 3h0r h SER 8 Cb 0.61 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.08 3h0r h SER 8 CO 0.02 0.63 0.18 -0.33 -1.14 0.00 0.00 176.83 176.19 3h0r h GLU 9 N -0.25 0.50 -0.45 3.45 5.08 -1.85 -2.24 114.58 118.82 3h0r h GLU 9 Ca 0.01 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3h0r h GLU 9 Cb 0.58 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 3h0r h GLU 9 CO 0.02 0.44 0.21 -0.07 -1.00 0.00 0.00 179.01 178.61 3h0r h LEU 10 N 0.44 0.59 -0.36 1.33 4.07 -0.64 -2.84 115.31 117.90 3h0r h LEU 10 Ca 0.12 -0.13 -0.03 0.00 0.08 0.00 0.00 57.88 57.92 3h0r h LEU 10 Cb 0.10 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.67 3h0r h LEU 10 CO -0.02 0.56 0.10 -0.09 -1.08 0.00 0.00 178.44 177.91 3h0r h ARG 11 N 0.58 0.56 -0.67 1.13 2.43 -0.65 -1.12 114.38 116.64 3h0r h ARG 11 Ca 0.15 -0.13 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 3h0r h ARG 11 Cb 0.13 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.55 3h0r h ARG 11 CO -0.02 0.59 0.39 1.49 -1.51 0.00 0.00 179.97 180.91 3h0r h GLU 12 N 0.43 0.70 -0.26 0.20 4.81 -1.43 0.12 114.58 119.15 3h0r h GLU 12 Ca 0.11 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 3h0r h GLU 12 Cb 0.27 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 3h0r h GLU 12 CO -0.00 0.47 -0.14 -0.07 -0.73 0.00 0.00 179.01 178.53 3h0r h LEU 13 N 0.72 0.43 0.13 1.64 4.07 -1.24 -2.81 115.31 118.26 3h0r h LEU 13 Ca 0.29 -0.11 -0.30 0.00 0.08 0.00 0.00 57.88 57.84 3h0r h LEU 13 Cb 0.14 -0.11 0.03 0.00 1.08 0.00 0.00 40.66 41.79 3h0r h LEU 13 CO -0.16 0.60 -1.28 -0.07 -1.08 0.00 0.00 178.44 176.46 3h0r h LEU 14 N 0.41 0.84 -0.87 1.67 3.38 -0.41 -1.18 115.31 119.16 3h0r h LEU 14 Ca 0.08 -0.80 -0.08 0.00 0.09 0.00 0.00 57.88 57.16 3h0r h LEU 14 Cb 0.50 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3h0r h LEU 14 CO 0.03 1.61 -0.05 0.11 0.09 0.00 0.00 178.44 180.22 3h0r h LYS 15 N 0.25 0.78 -0.62 1.13 1.57 -0.78 -2.76 116.57 116.14 3h0r h LYS 15 Ca -0.19 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 3h0r h LYS 15 Cb 1.95 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 34.19 3h0r h LYS 15 CO 0.24 0.82 0.00 0.54 -0.57 0.00 0.00 179.45 180.48 3h0r n ARG 16 N -4.19 3.05 -0.53 3.15 1.74 -1.06 -4.94 116.66 113.87 3h0r n ARG 16 Ca 0.02 -2.16 0.00 0.00 -0.77 0.00 0.00 57.85 54.94 3h0r n ARG 16 Cb 0.33 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 3h0r n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0r n GLY 17 N 0.95 0.67 0.42 -0.13 0.00 -1.04 -4.81 105.19 101.25 3h0r n GLY 17 Ca 0.20 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.44 3h0r n GLY 17 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h0r h GLU 18 N 1.22 0.12 -4.40 1.61 5.08 -1.51 -3.42 114.58 113.28 3h0r h GLU 18 Ca 0.00 -0.01 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 3h0r h GLU 18 Cb 0.00 -0.03 -0.17 0.00 0.50 0.00 0.00 28.75 29.05 3h0r h GLU 18 CO 0.00 0.08 -0.70 0.54 -1.00 0.00 0.00 179.01 177.93 3h0r s VAL 19 N -5.13 0.42 0.22 3.13 0.11 -0.87 -5.03 120.40 113.26 3h0r s VAL 19 Ca -0.06 -1.51 0.07 0.00 -2.93 0.00 0.00 61.98 57.55 3h0r s VAL 19 Cb 0.21 -1.13 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 3h0r s VAL 19 CO 0.76 -0.73 0.09 -0.94 -3.33 0.00 0.00 175.10 170.95 3h0r s SER 20 N -2.38 5.08 0.43 3.54 1.04 -1.26 -4.38 113.70 115.77 3h0r s SER 20 Ca 0.00 -0.37 0.13 0.00 0.48 0.00 0.00 55.95 56.19 3h0r s SER 20 Cb -0.00 -1.17 1.00 0.00 0.10 0.00 0.00 66.02 65.95 3h0r s SER 20 CO -0.04 0.02 1.98 -0.65 0.98 0.00 0.00 173.24 175.53 3h0r h PRO 21 N 2.05 0.43 -0.77 4.02 0.11 -1.89 -1.56 132.00 134.39 3h0r h PRO 21 Ca -0.47 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 3h0r h PRO 21 Cb 1.23 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 3h0r h PRO 21 CO 0.60 0.28 0.40 -0.22 -0.21 0.00 0.00 178.00 178.86 3h0r h LYS 22 N 0.44 1.09 -0.25 1.05 3.64 -1.89 -1.95 116.57 118.70 3h0r h LYS 22 Ca 0.27 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 3h0r h LYS 22 Cb 0.48 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3h0r h LYS 22 CO -0.08 0.83 0.06 0.93 -2.27 0.00 0.00 179.45 178.92 3h0r h GLU 23 N 1.08 0.41 -0.27 1.90 5.08 -1.70 0.08 114.58 121.16 3h0r h GLU 23 Ca 0.27 -0.10 0.06 0.00 -1.00 0.00 0.00 59.36 58.59 3h0r h GLU 23 Cb 0.07 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.21 3h0r h GLU 23 CO -0.04 0.51 -0.10 0.28 -1.00 0.00 0.00 179.01 178.66 3h0r h VAL 24 N 0.24 0.65 -0.38 3.13 2.07 -1.32 0.13 116.25 120.77 3h0r h VAL 24 Ca 0.08 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.61 3h0r h VAL 24 Cb 0.29 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3h0r h VAL 24 CO 0.00 0.00 0.23 0.58 0.02 0.00 0.00 177.57 178.40 3h0r h VAL 25 N -0.06 1.05 -0.79 2.57 2.07 -1.17 -2.23 116.25 117.69 3h0r h VAL 25 Ca 0.14 -0.16 0.12 0.00 0.82 0.00 0.00 66.70 67.62 3h0r h VAL 25 Cb 0.26 0.55 -0.08 0.00 -1.52 0.00 0.00 31.29 30.50 3h0r h VAL 25 CO -0.31 0.08 0.41 -0.33 0.02 0.00 0.00 177.57 177.44 3h0r h GLU 26 N 0.46 0.62 0.32 1.57 5.08 -0.27 0.79 114.58 123.15 3h0r h GLU 26 Ca 0.15 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 3h0r h GLU 26 Cb -0.01 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3h0r h GLU 26 CO -0.06 0.41 -0.21 1.03 -1.00 0.00 0.00 179.01 179.18 3h0r h SER 27 N 0.64 -0.53 -0.01 1.42 0.87 -0.20 -0.07 113.55 115.68 3h0r h SER 27 Ca 0.41 0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.94 3h0r h SER 27 Cb 0.49 0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.60 3h0r h SER 27 CO -0.31 -0.33 -0.15 -0.26 -0.53 0.00 0.00 176.83 175.25 3h0r h PHE 28 N -0.51 0.34 -0.35 2.24 0.04 -1.12 -2.65 116.94 114.92 3h0r h PHE 28 Ca -0.03 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.68 3h0r h PHE 28 Cb 0.43 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.47 3h0r h PHE 28 CO -0.10 0.47 0.15 -0.92 -0.60 0.00 0.00 178.31 177.30 3h0r h TYR 29 N 0.30 0.53 -0.78 -0.55 3.20 -0.46 0.19 116.97 119.39 3h0r h TYR 29 Ca 0.06 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 3h0r h TYR 29 Cb 0.45 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.53 3h0r h TYR 29 CO 0.01 0.48 0.37 -0.44 -1.64 0.00 0.00 178.16 176.94 3h0r h ASP 30 N 0.42 1.04 1.07 -2.11 3.32 -0.74 0.28 116.42 119.71 3h0r h ASP 30 Ca 0.12 -0.14 -0.13 0.00 0.02 0.00 0.00 57.03 56.90 3h0r h ASP 30 Cb 0.17 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 3h0r h ASP 30 CO -0.01 0.89 -0.60 -0.09 -1.72 0.00 0.00 179.24 177.71 3h0r h ARG 31 N 1.11 0.00 -0.08 3.56 2.43 -1.31 -0.11 114.38 119.98 3h0r h ARG 31 Ca 0.27 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.47 3h0r h ARG 31 Cb 0.14 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.65 3h0r h ARG 31 CO -0.03 0.60 -0.13 -0.92 -1.51 0.00 0.00 179.97 177.98 3h0r h TYR 32 N 0.00 -0.32 -0.56 2.20 3.20 -0.24 -2.60 116.97 118.65 3h0r h TYR 32 Ca -0.01 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.90 3h0r h TYR 32 Cb 1.30 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 39.69 3h0r h TYR 32 CO 0.00 -0.19 0.37 -0.91 -1.64 0.00 0.00 178.16 175.79 3h0r h ASN 33 N -0.17 0.60 -0.75 -2.11 2.35 -0.35 -0.26 115.58 114.89 3h0r h ASN 33 Ca 0.07 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 3h0r h ASN 33 Cb 0.28 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.47 3h0r h ASN 33 CO -0.19 0.42 0.44 1.56 -1.65 0.00 0.00 177.43 178.01 3h0r h GLN 34 N 0.70 1.05 0.00 0.81 4.20 -0.83 -3.38 115.11 117.65 3h0r h GLN 34 Ca 0.22 -0.10 -0.13 0.00 0.06 0.00 0.00 58.65 58.69 3h0r h GLN 34 Cb 0.02 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.56 3h0r h GLN 34 CO -0.05 0.75 -1.51 0.25 -0.67 0.00 0.00 178.83 177.60 3h0r n THR 35 N -4.37 0.49 0.07 -0.54 -2.24 -0.74 -4.75 114.28 102.20 3h0r n THR 35 Ca 0.08 -0.31 -0.05 0.00 -2.27 0.00 0.00 64.05 61.50 3h0r n THR 35 Cb 0.08 -0.75 0.14 0.00 -2.10 0.00 0.00 70.33 67.70 3h0r n THR 35 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3h0r h GLU 36 N 0.00 0.30 -0.58 -0.78 4.57 -1.25 -1.45 114.58 115.39 3h0r h GLU 36 Ca -0.19 -0.18 0.05 0.00 -1.18 0.00 0.00 59.36 57.85 3h0r h GLU 36 Cb 1.41 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.99 3h0r h GLU 36 CO 0.01 0.76 0.38 1.49 -1.18 0.00 0.00 179.01 180.48 3h0r h GLU 37 N 0.24 0.58 0.00 1.92 4.81 -1.84 0.21 114.58 120.49 3h0r h GLU 37 Ca 0.00 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3h0r h GLU 37 Cb 1.02 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.27 3h0r h GLU 37 CO 0.09 0.38 -0.02 0.87 -0.73 0.00 0.00 179.01 179.60 3h0r h LYS 38 N 0.59 0.00 0.01 1.92 1.57 -1.63 -3.41 116.57 115.62 3h0r h LYS 38 Ca 0.24 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3h0r h LYS 38 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 3h0r h LYS 38 CO -0.07 0.83 -0.00 0.28 -0.57 0.00 0.00 179.45 179.91 3h0r h VAL 39 N -1.00 1.62 -5.61 0.50 2.07 -1.22 -3.42 116.25 109.19 3h0r h VAL 39 Ca -0.01 -2.02 -0.30 0.00 0.82 0.00 0.00 66.70 65.20 3h0r h VAL 39 Cb 0.83 2.96 0.17 0.00 -1.52 0.00 0.00 31.29 33.74 3h0r h VAL 39 CO -0.00 0.51 -0.83 0.29 0.02 0.00 0.00 177.57 177.56 3h0r n LYS 40 N -4.68 -3.97 0.08 1.57 5.02 0.72 -0.87 118.16 116.04 3h0r n LYS 40 Ca -0.09 0.82 -0.07 0.00 -2.02 0.00 0.00 58.31 56.95 3h0r n LYS 40 Cb 0.41 -5.71 0.05 0.00 -0.02 0.00 0.00 35.03 29.75 3h0r n LYS 40 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h0r h ALA 41 N 0.39 0.65 -3.07 7.82 0.00 -1.88 -3.38 119.26 119.79 3h0r h ALA 41 Ca -0.61 -0.64 -0.66 0.00 0.00 0.00 0.00 54.91 53.01 3h0r h ALA 41 Cb 1.33 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 3h0r h ALA 41 CO 0.47 0.82 -0.57 0.71 0.00 0.00 0.00 179.25 180.69 3h0r s TYR 42 N -3.47 3.31 -0.17 0.00 1.51 -1.26 0.59 117.35 117.86 3h0r s TYR 42 Ca -0.04 0.24 -0.17 0.00 -1.01 0.00 0.00 57.07 56.09 3h0r s TYR 42 Cb 0.11 -1.77 -0.22 0.00 -0.11 0.00 0.00 41.96 39.97 3h0r s TYR 42 CO 0.82 0.56 0.31 0.82 -1.11 0.00 0.00 175.55 176.95 3h0r h ILE 43 N 3.37 0.88 -3.06 2.71 2.04 -0.85 -3.43 117.51 119.18 3h0r h ILE 43 Ca -0.50 -2.25 -0.57 0.00 1.00 0.00 0.00 64.86 62.54 3h0r h ILE 43 Cb 1.19 2.38 -0.40 0.00 -0.74 0.00 0.00 36.82 39.25 3h0r h ILE 43 CO 0.61 0.51 -0.76 -0.89 0.00 0.00 0.00 178.15 177.62 3h0r s THR 44 N -2.42 0.65 0.27 -0.27 2.01 -0.63 -4.99 115.64 110.25 3h0r s THR 44 Ca -0.26 -1.26 -0.29 0.00 0.31 0.00 0.00 61.69 60.19 3h0r s THR 44 Cb 0.06 -1.50 -0.09 0.00 0.01 0.00 0.00 72.50 70.97 3h0r s THR 44 CO 0.66 -0.70 1.16 -2.16 -0.69 0.00 0.00 174.62 172.90 3h0r s PRO 45 N 1.71 4.55 -0.06 4.92 0.04 -1.26 0.45 135.00 145.35 3h0r s PRO 45 Ca 0.10 1.90 0.09 0.00 0.04 0.00 0.00 61.00 63.13 3h0r s PRO 45 Cb -0.17 -3.18 0.13 0.00 0.04 0.00 0.00 34.50 31.32 3h0r s PRO 45 CO -0.28 0.06 1.01 1.28 0.04 0.00 0.00 177.00 179.12 3h0r n LEU 46 N 1.44 1.52 -0.29 -3.56 4.77 0.11 -4.79 117.00 116.21 3h0r n LEU 46 Ca 0.00 -2.07 0.03 0.00 -0.03 0.00 0.00 56.01 53.95 3h0r n LEU 46 Cb 0.44 -0.19 0.16 0.00 -2.33 0.00 0.00 43.42 41.50 3h0r n LEU 46 CO 0.55 0.49 1.13 1.88 -1.33 0.00 0.00 177.39 180.11 3h0r h TYR 47 N 0.00 0.83 -0.37 -1.77 -1.99 -1.75 0.13 116.97 112.05 3h0r h TYR 47 Ca 0.00 0.03 0.07 0.00 2.00 0.00 0.00 58.73 60.83 3h0r h TYR 47 Cb 0.97 -0.25 -0.07 0.00 2.00 0.00 0.00 36.73 39.38 3h0r h TYR 47 CO 0.02 0.33 -0.05 0.78 -0.00 0.00 0.00 178.16 179.24 3h0r h GLY 48 N 0.77 0.31 1.69 3.88 0.00 -1.90 0.20 103.07 108.01 3h0r h GLY 48 Ca 0.39 0.09 -0.13 0.00 0.00 0.00 0.00 47.33 47.68 3h0r h GLY 48 CO -0.25 -0.12 -0.51 1.70 0.00 0.00 0.00 176.54 177.36 3h0r h LYS 49 N 0.04 0.33 -0.41 4.80 3.64 -1.62 -2.96 116.57 120.39 3h0r h LYS 49 Ca 0.18 -0.19 -0.14 0.00 -1.27 0.00 0.00 60.65 59.23 3h0r h LYS 49 Cb 0.27 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3h0r h LYS 49 CO -0.35 0.76 -0.28 0.00 -2.27 0.00 0.00 179.45 177.31 3h0r h ALA 50 N 1.20 0.73 -0.56 5.00 0.00 -0.06 -1.63 119.26 123.94 3h0r h ALA 50 Ca 0.01 -0.41 0.08 0.00 0.00 0.00 0.00 54.91 54.60 3h0r h ALA 50 Cb 0.99 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.57 3h0r h ALA 50 CO 0.08 0.66 0.20 -0.07 0.00 0.00 0.00 179.25 180.12 3h0r h LEU 51 N 0.75 0.18 -0.59 0.00 4.07 -0.48 -0.46 115.31 118.78 3h0r h LEU 51 Ca 0.09 0.07 -0.08 0.00 0.08 0.00 0.00 57.88 58.04 3h0r h LEU 51 Cb 0.84 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.62 3h0r h LEU 51 CO 0.07 0.12 0.04 0.11 -1.08 0.00 0.00 178.44 177.70 3h0r h LYS 52 N 0.37 1.01 0.00 1.13 1.57 -1.40 -2.96 116.57 116.29 3h0r h LYS 52 Ca 0.28 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 3h0r h LYS 52 Cb 0.33 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3h0r h LYS 52 CO -0.29 0.98 -0.25 1.96 -0.57 0.00 0.00 179.45 181.28 3h0r h GLN 53 N 0.90 0.00 -0.25 3.15 4.20 -0.86 -2.99 115.11 119.25 3h0r h GLN 53 Ca 0.17 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.79 3h0r h GLN 53 Cb 0.50 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 3h0r h GLN 53 CO 0.02 0.25 -0.24 0.00 -0.67 0.00 0.00 178.83 178.19 3h0r h ALA 54 N 1.75 1.12 -0.90 3.87 0.00 -0.92 -2.96 119.26 121.22 3h0r h ALA 54 Ca -0.00 -0.34 0.13 0.00 0.00 0.00 0.00 54.91 54.70 3h0r h ALA 54 Cb 0.53 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.13 3h0r h ALA 54 CO 0.03 0.55 0.58 0.93 0.00 0.00 0.00 179.25 181.34 3h0r h GLU 55 N 0.42 0.75 -0.02 0.00 5.08 -1.54 -1.88 114.58 117.39 3h0r h GLU 55 Ca 0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3h0r h GLU 55 Cb 0.65 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3h0r h GLU 55 CO 0.05 0.49 -0.06 -1.13 -1.00 0.00 0.00 179.01 177.36 3h0r n SER 56 N -4.57 1.84 -4.66 1.42 3.41 -1.12 -4.86 113.62 105.08 3h0r n SER 56 Ca 0.17 -1.54 -0.42 0.00 -0.26 0.00 0.00 58.87 56.82 3h0r n SER 56 Cb 0.42 0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 64.38 3h0r n SER 56 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3h0r s LEU 57 N -2.09 4.12 0.00 1.04 0.20 -0.71 -4.90 118.68 116.34 3h0r s LEU 57 Ca 0.33 1.16 0.00 0.00 0.69 0.00 0.00 54.13 56.31 3h0r s LEU 57 Cb 0.20 -3.28 0.00 0.00 -0.43 0.00 0.00 46.19 42.68 3h0r s LEU 57 CO 0.36 -0.51 0.00 0.29 -0.29 0.00 0.00 176.35 176.20 3h0r n LYS 58 N 5.81 0.00 -2.12 1.98 5.02 -1.26 -4.95 118.16 122.64 3h0r n LYS 58 Ca 0.07 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.95 3h0r n LYS 58 Cb 0.48 -0.51 -0.03 0.00 -0.02 0.00 0.00 35.03 34.95 3h0r n LYS 58 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3h0r s GLU 59 N -1.87 3.08 0.48 1.97 2.12 -1.26 -4.86 118.70 118.36 3h0r s GLU 59 Ca 0.00 0.88 0.27 0.00 0.36 0.00 0.00 54.97 56.48 3h0r s GLU 59 Cb 0.00 -4.24 0.72 0.00 0.26 0.00 0.00 34.13 30.87 3h0r s GLU 59 CO 0.00 -2.18 1.75 0.00 -0.54 0.00 0.00 175.26 174.29 3h0r h ARG 60 N 13.12 0.00 0.00 4.30 3.08 -1.95 -3.18 114.38 129.76 3h0r h ARG 60 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.76 3h0r h ARG 60 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.20 3h0r h ARG 60 CO 1.14 0.00 0.00 -1.91 -1.07 0.00 0.00 179.97 178.13 3h0r n GLU 61 N -3.09 0.80 -1.90 0.04 2.13 -1.26 -4.67 120.64 112.69 3h0r n GLU 61 Ca 0.03 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.43 3h0r n GLU 61 Cb 0.45 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.63 3h0r n GLU 61 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3h0r s LEU 62 N -2.20 4.37 0.40 4.31 1.02 -1.20 -4.90 118.68 120.47 3h0r s LEU 62 Ca 0.41 2.72 0.18 0.00 0.02 0.00 0.00 54.13 57.46 3h0r s LEU 62 Cb 0.21 -3.61 1.09 0.00 0.02 0.00 0.00 46.19 43.90 3h0r s LEU 62 CO 0.40 -0.83 1.78 -0.65 0.02 0.00 0.00 176.35 177.07 3h0r h PRO 63 N 6.00 0.40 -0.33 1.29 0.11 -1.87 0.11 132.00 137.70 3h0r h PRO 63 Ca -0.44 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 65.42 3h0r h PRO 63 Cb 1.21 -0.09 -0.15 0.00 0.11 0.00 0.00 31.00 32.08 3h0r h PRO 63 CO 0.86 0.26 -0.42 1.28 -0.21 0.00 0.00 178.00 179.77 3h0r n LEU 64 N -4.63 3.87 -0.20 2.35 4.77 0.63 -4.98 117.00 118.81 3h0r n LEU 64 Ca 0.25 -4.12 -0.02 0.00 -0.03 0.00 0.00 56.01 52.09 3h0r n LEU 64 Cb 0.86 -0.53 -0.00 0.00 -2.33 0.00 0.00 43.42 41.42 3h0r n LEU 64 CO 0.26 1.57 0.27 0.33 -1.33 0.00 0.00 177.39 178.48 3h0r n PHE 65 N -1.01 -0.06 -1.39 -1.77 7.35 0.37 -1.25 117.46 119.71 3h0r n PHE 65 Ca 0.31 0.61 0.08 0.00 -0.76 0.00 0.00 57.45 57.69 3h0r n PHE 65 Cb 0.85 -0.64 0.14 0.00 0.35 0.00 0.00 39.48 40.19 3h0r n PHE 65 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3h0r n GLY 66 N -1.20 4.40 3.66 7.13 0.00 -1.26 -4.40 105.19 113.51 3h0r n GLY 66 Ca 0.04 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.57 3h0r n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h0r s ILE 67 N -2.60 4.91 0.42 -0.61 -1.09 -0.38 -4.77 121.20 117.08 3h0r s ILE 67 Ca 0.31 1.47 -0.25 0.00 -2.23 0.00 0.00 60.65 59.95 3h0r s ILE 67 Cb 0.29 -4.07 -0.08 0.00 -1.58 0.00 0.00 42.46 37.02 3h0r s ILE 67 CO -0.01 0.02 1.21 -2.84 -1.23 0.00 0.00 174.94 172.09 3h0r s PRO 68 N 2.28 3.92 -0.06 2.79 0.02 -1.26 -0.32 135.00 142.37 3h0r s PRO 68 Ca 0.34 1.91 -0.02 0.00 0.02 0.00 0.00 61.00 63.25 3h0r s PRO 68 Cb -0.16 -2.61 0.04 0.00 0.02 0.00 0.00 34.50 31.79 3h0r s PRO 68 CO 0.10 -0.45 0.12 -1.50 -0.33 0.00 0.00 177.00 174.94 3h0r s ILE 69 N -1.40 -0.12 0.44 2.83 2.07 -0.22 -4.41 121.20 120.39 3h0r s ILE 69 Ca 0.59 0.26 -0.14 0.00 -1.41 0.00 0.00 60.65 59.95 3h0r s ILE 69 Cb -0.32 -0.22 -0.08 0.00 0.13 0.00 0.00 42.46 41.97 3h0r s ILE 69 CO 0.40 0.11 0.87 0.00 -1.91 0.00 0.00 174.94 174.41 3h0r s ALA 70 N 1.58 3.20 -0.02 1.50 0.00 -1.14 -1.58 121.76 125.30 3h0r s ALA 70 Ca -0.04 0.03 0.00 0.00 0.00 0.00 0.00 51.96 51.95 3h0r s ALA 70 Cb -0.12 -2.92 0.02 0.00 0.00 0.00 0.00 23.12 20.11 3h0r s ALA 70 CO -0.05 -0.06 0.01 0.08 0.00 0.00 0.00 175.76 175.74 3h0r s VAL 71 N -2.43 0.11 0.44 0.00 1.01 -0.56 -1.55 120.40 117.42 3h0r s VAL 71 Ca 0.56 0.10 -0.26 0.00 0.00 0.00 0.00 61.98 62.38 3h0r s VAL 71 Cb -0.10 -0.20 -0.09 0.00 0.00 0.00 0.00 36.38 35.99 3h0r s VAL 71 CO 0.29 0.12 1.44 1.17 0.00 0.00 0.00 175.10 178.11 3h0r n LYS 72 N 4.00 2.31 -0.13 2.72 4.81 -0.75 -0.12 118.16 131.00 3h0r n LYS 72 Ca -0.25 0.82 -0.02 0.00 -0.87 0.00 0.00 58.31 57.98 3h0r n LYS 72 Cb 0.51 -2.63 0.02 0.00 0.02 0.00 0.00 35.03 32.95 3h0r n LYS 72 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 3h0r n ASP 73 N -0.07 3.02 -0.06 3.14 2.03 -0.93 -1.47 116.55 122.20 3h0r n ASP 73 Ca 0.05 -2.16 0.01 0.00 0.52 0.00 0.00 54.79 53.20 3h0r n ASP 73 Cb 0.41 -0.53 0.01 0.00 -0.72 0.00 0.00 41.12 40.29 3h0r n ASP 73 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 3h0r n ASN 74 N 0.32 1.88 -4.59 1.67 6.94 -1.26 -0.45 115.26 119.76 3h0r n ASN 74 Ca 0.06 -1.79 -0.34 0.00 -0.02 0.00 0.00 54.58 52.49 3h0r n ASN 74 Cb 0.61 -0.02 -0.10 0.00 -2.36 0.00 0.00 39.78 37.91 3h0r n ASN 74 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3h0r s ILE 75 N -0.80 4.50 -0.07 1.53 1.01 -0.55 -0.76 121.20 126.06 3h0r s ILE 75 Ca 0.02 -0.14 -0.30 0.00 0.00 0.00 0.00 60.65 60.23 3h0r s ILE 75 Cb 0.01 -3.01 -0.03 0.00 0.01 0.00 0.00 42.46 39.45 3h0r s ILE 75 CO 0.02 0.47 1.14 -0.76 0.00 0.00 0.00 174.94 175.81 3h0r s LEU 76 N 0.35 4.27 -0.17 2.97 1.02 -0.28 -4.90 118.68 121.95 3h0r s LEU 76 Ca 0.01 1.74 0.01 0.00 0.02 0.00 0.00 54.13 55.90 3h0r s LEU 76 Cb -0.13 -3.56 0.02 0.00 0.02 0.00 0.00 46.19 42.54 3h0r s LEU 76 CO 0.01 -0.54 -0.18 -0.69 0.02 0.00 0.00 176.35 174.97 3h0r s VAL 77 N 2.11 1.91 0.33 -1.59 1.01 -1.26 -1.12 120.40 121.80 3h0r s VAL 77 Ca 0.54 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 3h0r s VAL 77 Cb -0.23 -1.74 -0.10 0.00 0.00 0.00 0.00 36.38 34.31 3h0r s VAL 77 CO 0.21 0.52 1.29 -0.70 0.00 0.00 0.00 175.10 176.42 3h0r s GLU 78 N 1.34 4.36 0.00 2.72 2.12 -1.24 -2.60 118.70 125.40 3h0r s GLU 78 Ca 0.05 2.18 0.00 0.00 0.36 0.00 0.00 54.97 57.56 3h0r s GLU 78 Cb -0.13 -3.06 0.00 0.00 0.26 0.00 0.00 34.13 31.20 3h0r s GLU 78 CO -0.12 -0.17 0.00 0.41 -0.54 0.00 0.00 175.26 174.83 3h0r n GLY 79 N 0.81 2.66 3.48 -1.50 0.00 -0.17 -4.96 105.19 105.52 3h0r n GLY 79 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 3h0r n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h0r s GLU 80 N -0.48 1.73 0.23 1.61 0.41 -1.07 -4.82 118.70 116.32 3h0r s GLU 80 Ca 0.00 -1.27 -0.31 0.00 -0.41 0.00 0.00 54.97 52.98 3h0r s GLU 80 Cb 0.00 -2.05 -0.13 0.00 -1.78 0.00 0.00 34.13 30.16 3h0r s GLU 80 CO 0.00 0.46 1.42 1.63 -0.49 0.00 0.00 175.26 178.28 3h0r n LYS 81 N 0.62 2.04 -3.96 1.61 5.02 -1.26 -2.03 118.16 120.21 3h0r n LYS 81 Ca -0.15 0.73 -0.31 0.00 -2.02 0.00 0.00 58.31 56.56 3h0r n LYS 81 Cb 0.54 -2.39 -0.15 0.00 -0.02 0.00 0.00 35.03 33.00 3h0r n LYS 81 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3h0r s THR 82 N -0.00 1.88 -0.11 -0.18 2.01 -0.49 -4.86 115.64 113.89 3h0r s THR 82 Ca 0.69 -1.92 0.21 0.00 0.31 0.00 0.00 61.69 60.97 3h0r s THR 82 Cb -0.65 -2.32 -0.23 0.00 0.01 0.00 0.00 72.50 69.31 3h0r s THR 82 CO 0.49 -0.48 0.57 0.35 -0.69 0.00 0.00 174.62 174.85 3h0r n THR 83 N 4.45 0.54 -2.15 -0.82 -2.24 -1.22 -4.68 114.28 108.16 3h0r n THR 83 Ca -0.01 -0.60 -0.13 0.00 -2.27 0.00 0.00 64.05 61.04 3h0r n THR 83 Cb 0.42 -0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.38 3h0r n THR 83 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h0r n ALA 85 N -1.50 -1.22 -2.37 0.00 0.00 -1.26 -1.11 120.51 113.05 3h0r n ALA 85 Ca -0.15 0.10 -0.29 0.00 0.00 0.00 0.00 53.44 53.10 3h0r n ALA 85 Cb 0.56 -3.79 -0.15 0.00 0.00 0.00 0.00 19.45 16.08 3h0r n ALA 85 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3h0r s SER 86 N -3.17 2.93 0.35 0.00 0.15 0.47 -1.58 113.70 112.85 3h0r s SER 86 Ca 0.65 -0.53 0.05 0.00 0.70 0.00 0.00 55.95 56.83 3h0r s SER 86 Cb -0.34 -0.28 0.72 0.00 -1.71 0.00 0.00 66.02 64.40 3h0r s SER 86 CO 0.80 0.25 1.95 0.11 1.20 0.00 0.00 173.24 177.55 3h0r h LYS 87 N 5.04 0.77 0.00 5.44 1.79 -1.84 -1.11 116.57 126.65 3h0r h LYS 87 Ca -0.44 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 3h0r h LYS 87 Cb 1.14 -0.17 0.00 0.00 -1.58 0.00 0.00 32.23 31.62 3h0r h LYS 87 CO 0.45 0.51 0.00 0.97 -1.08 0.00 0.00 179.45 180.29 3h0r h ILE 88 N 0.79 0.00 0.00 1.86 2.10 -1.76 -3.10 117.51 117.40 3h0r h ILE 88 Ca 0.33 -0.27 0.00 0.00 1.08 0.00 0.00 64.86 65.99 3h0r h ILE 88 Cb 0.27 1.06 0.00 0.00 -1.09 0.00 0.00 36.82 37.05 3h0r h ILE 88 CO -0.11 0.00 -0.08 0.18 -1.08 0.00 0.00 178.15 177.06 3h0r n LEU 89 N -2.45 1.02 -4.76 2.19 4.32 -0.96 -0.98 117.00 115.37 3h0r n LEU 89 Ca 0.01 -1.28 -0.40 0.00 -0.02 0.00 0.00 56.01 54.33 3h0r n LEU 89 Cb 0.23 -0.06 -0.04 0.00 -1.62 0.00 0.00 43.42 41.93 3h0r n LEU 89 CO 0.21 0.31 0.81 -1.83 -1.22 0.00 0.00 177.39 175.67 3h0r s GLU 90 N -0.75 4.50 0.00 3.23 -1.05 -0.46 -2.35 118.70 121.82 3h0r s GLU 90 Ca 0.05 1.81 0.00 0.00 -0.15 0.00 0.00 54.97 56.68 3h0r s GLU 90 Cb 0.04 -3.05 0.00 0.00 -0.44 0.00 0.00 34.13 30.68 3h0r s GLU 90 CO 0.00 0.08 0.00 0.09 0.95 0.00 0.00 175.26 176.39 3h0r n ASN 91 N 0.90 0.00 -4.61 0.83 3.02 -1.26 -4.68 115.26 109.46 3h0r n ASN 91 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.12 3h0r n ASN 91 Cb 0.45 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.60 3h0r n ASN 91 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3h0r s PHE 92 N -3.31 2.53 -0.12 3.10 5.36 -0.99 -4.92 117.98 119.64 3h0r s PHE 92 Ca 0.00 0.73 -0.19 0.00 -0.96 0.00 0.00 56.93 56.52 3h0r s PHE 92 Cb 0.00 -4.21 -0.04 0.00 -0.34 0.00 0.00 43.02 38.43 3h0r s PHE 92 CO 0.00 -1.81 0.51 0.08 -1.46 0.00 0.00 175.22 172.54 3h0r s VAL 93 N 5.01 5.17 -0.08 3.12 1.01 -1.26 -1.40 120.40 131.97 3h0r s VAL 93 Ca 0.58 1.01 -0.30 0.00 0.00 0.00 0.00 61.98 63.27 3h0r s VAL 93 Cb -0.14 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 3h0r s VAL 93 CO 0.30 0.31 1.50 0.00 0.00 0.00 0.00 175.10 177.21 3h0r s ALA 94 N 0.72 3.63 -1.45 5.51 0.00 -0.86 -4.90 121.76 124.41 3h0r s ALA 94 Ca 0.27 0.80 0.30 0.00 0.00 0.00 0.00 51.96 53.33 3h0r s ALA 94 Cb -0.15 -3.69 1.51 0.00 0.00 0.00 0.00 23.12 20.79 3h0r s ALA 94 CO 0.11 -1.25 2.04 -2.30 0.00 0.00 0.00 175.76 174.36 3h0r n PRO 95 N 6.68 0.44 -3.64 0.00 -0.02 -1.26 -1.00 135.00 136.20 3h0r n PRO 95 Ca 0.16 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.54 3h0r n PRO 95 Cb 0.43 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.39 3h0r n PRO 95 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3h0r s TYR 96 N -2.55 -0.30 -0.10 6.00 1.13 -1.26 -4.93 117.35 115.34 3h0r s TYR 96 Ca 0.29 -0.02 -0.21 0.00 -1.41 0.00 0.00 57.07 55.72 3h0r s TYR 96 Cb 0.20 0.53 -0.04 0.00 -1.10 0.00 0.00 41.96 41.55 3h0r s TYR 96 CO 0.45 -0.96 0.61 -0.51 -2.51 0.00 0.00 175.55 172.62 3h0r s ASP 97 N -2.83 6.84 0.55 -0.18 1.01 -1.26 -3.65 116.67 117.15 3h0r s ASP 97 Ca 0.06 1.01 -0.19 0.00 0.71 0.00 0.00 52.55 54.14 3h0r s ASP 97 Cb -0.02 -2.36 -0.08 0.00 1.01 0.00 0.00 42.92 41.47 3h0r s ASP 97 CO -0.05 -0.09 0.65 0.00 0.21 0.00 0.00 175.17 175.90 3h0r n ALA 98 N 3.86 -0.81 -0.35 5.23 0.00 -0.27 -4.80 120.51 123.37 3h0r n ALA 98 Ca -0.04 0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.44 3h0r n ALA 98 Cb 0.51 -1.90 0.17 0.00 0.00 0.00 0.00 19.45 18.23 3h0r n ALA 98 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3h0r h THR 99 N 0.43 1.06 -0.83 0.00 2.02 -1.44 -1.90 112.91 112.25 3h0r h THR 99 Ca -0.46 -0.37 -0.00 0.00 0.77 0.00 0.00 66.41 66.35 3h0r h THR 99 Cb 1.39 -0.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.64 3h0r h THR 99 CO 0.49 0.20 0.51 -0.37 0.37 0.00 0.00 175.52 176.72 3h0r h VAL 100 N 1.08 1.23 -0.22 3.16 -1.51 -1.86 -1.42 116.25 116.71 3h0r h VAL 100 Ca 0.41 -0.48 -0.15 0.00 -1.23 0.00 0.00 66.70 65.26 3h0r h VAL 100 Cb 0.19 0.04 -0.01 0.00 -2.13 0.00 0.00 31.29 29.39 3h0r h VAL 100 CO -0.18 0.23 -0.48 0.40 -1.23 0.00 0.00 177.57 176.32 3h0r h ILE 101 N 1.14 1.31 -0.46 7.19 1.08 -1.69 -0.19 117.51 125.88 3h0r h ILE 101 Ca 0.30 -1.68 0.05 0.00 -0.39 0.00 0.00 64.86 63.14 3h0r h ILE 101 Cb -0.07 1.65 -0.05 0.00 -3.07 0.00 0.00 36.82 35.29 3h0r h ILE 101 CO -0.06 0.53 0.19 -0.08 -0.69 0.00 0.00 178.15 178.04 3h0r h GLU 102 N 0.47 0.36 -0.00 2.37 4.81 -0.90 -1.23 114.58 120.46 3h0r h GLU 102 Ca 0.03 -0.02 -0.17 0.00 -0.13 0.00 0.00 59.36 59.06 3h0r h GLU 102 Cb 1.01 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 3h0r h GLU 102 CO 0.09 0.24 -0.79 0.00 -0.73 0.00 0.00 179.01 177.82 3h0r h ARG 103 N 0.37 0.03 -0.21 1.92 3.08 -0.86 -1.69 114.38 117.02 3h0r h ARG 103 Ca 0.21 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 60.09 3h0r h ARG 103 Cb 0.18 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.24 3h0r h ARG 103 CO -0.19 0.80 -0.42 -0.07 -1.07 0.00 0.00 179.97 179.02 3h0r h LEU 104 N 0.02 0.72 -0.82 3.04 3.38 -0.89 -2.65 115.31 118.11 3h0r h LEU 104 Ca -0.01 -0.55 -0.02 0.00 0.09 0.00 0.00 57.88 57.39 3h0r h LEU 104 Cb 1.40 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.90 3h0r h LEU 104 CO 0.11 1.14 0.43 0.11 0.09 0.00 0.00 178.44 180.32 3h0r h LYS 105 N 0.34 1.16 0.00 1.13 1.57 -1.16 -0.72 116.57 118.89 3h0r h LYS 105 Ca 0.01 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 3h0r h LYS 105 Cb 1.02 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.11 3h0r h LYS 105 CO 0.09 0.87 -0.04 -0.22 -0.57 0.00 0.00 179.45 179.58 3h0r h LYS 106 N 1.15 0.00 -0.26 3.15 3.64 -1.33 -2.19 116.57 120.74 3h0r h LYS 106 Ca 0.29 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 3h0r h LYS 106 Cb 0.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 3h0r h LYS 106 CO -0.04 0.04 0.00 0.00 -2.27 0.00 0.00 179.45 177.18 3h0r n ALA 107 N -2.13 2.48 -0.37 5.00 0.00 -0.37 -4.93 120.51 120.19 3h0r n ALA 107 Ca -0.00 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.73 3h0r n ALA 107 Cb 0.27 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.72 3h0r n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0r n GLY 108 N 1.28 0.88 3.69 0.00 0.00 -0.82 -0.27 105.19 109.95 3h0r n GLY 108 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3h0r n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0r s ALA 109 N -2.83 1.62 -0.22 4.61 0.00 -0.62 -4.14 121.76 120.18 3h0r s ALA 109 Ca 0.00 0.54 0.01 0.00 0.00 0.00 0.00 51.96 52.51 3h0r s ALA 109 Cb 0.00 -3.42 0.05 0.00 0.00 0.00 0.00 23.12 19.75 3h0r s ALA 109 CO 0.00 -2.59 -0.07 -0.51 0.00 0.00 0.00 175.76 172.59 3h0r s LEU 110 N -6.48 2.41 -0.12 0.00 1.43 0.56 -4.59 118.68 111.89 3h0r s LEU 110 Ca 0.66 -1.04 -0.29 0.00 -1.03 0.00 0.00 54.13 52.42 3h0r s LEU 110 Cb -0.22 -1.18 -0.05 0.00 0.03 0.00 0.00 46.19 44.78 3h0r s LEU 110 CO 0.57 -0.20 1.68 -0.63 0.23 0.00 0.00 176.35 178.00 3h0r s ILE 111 N 1.41 3.58 -0.79 -0.59 1.09 -1.26 -1.05 121.20 123.59 3h0r s ILE 111 Ca -0.04 0.68 0.16 0.00 -1.10 0.00 0.00 60.65 60.35 3h0r s ILE 111 Cb -0.18 -3.51 -0.16 0.00 -1.06 0.00 0.00 42.46 37.55 3h0r s ILE 111 CO -0.07 -0.14 0.68 0.55 -0.10 0.00 0.00 174.94 175.87 3h0r n VAL 112 N 5.92 0.00 0.00 2.92 3.14 -0.62 -4.56 118.33 125.13 3h0r n VAL 112 Ca 0.18 -0.14 0.00 0.00 -2.96 0.00 0.00 64.34 61.43 3h0r n VAL 112 Cb 0.44 1.01 0.00 0.00 -1.06 0.00 0.00 33.84 34.23 3h0r n VAL 112 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3h0r n GLY 113 N 1.36 1.78 3.52 7.55 0.00 -1.26 0.07 105.19 118.22 3h0r n GLY 113 Ca 0.03 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 44.79 3h0r n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h0r s LYS 114 N -2.00 3.76 0.05 1.61 -0.14 0.17 -1.50 119.74 121.69 3h0r s LYS 114 Ca 0.00 -0.46 -0.05 0.00 -1.36 0.00 0.00 55.97 54.10 3h0r s LYS 114 Cb 0.00 -3.12 -0.05 0.00 -1.68 0.00 0.00 37.83 32.98 3h0r s LYS 114 CO 0.00 0.13 0.29 -0.08 -0.76 0.00 0.00 175.35 174.93 3h0r s THR 115 N 0.72 5.27 0.68 2.17 -1.32 0.83 -0.22 115.64 123.77 3h0r s THR 115 Ca 0.01 0.07 -0.16 0.00 -1.21 0.00 0.00 61.69 60.40 3h0r s THR 115 Cb -0.14 -3.59 0.01 0.00 -1.51 0.00 0.00 72.50 67.27 3h0r s THR 115 CO 0.02 0.26 1.20 0.21 -2.21 0.00 0.00 174.62 174.09 3h0r s ASN 116 N -1.98 4.58 0.19 8.08 2.47 0.20 -2.19 114.94 126.29 3h0r s ASN 116 Ca 0.32 2.32 -0.17 0.00 0.42 0.00 0.00 52.86 55.75 3h0r s ASN 116 Cb -0.13 -2.59 0.02 0.00 -1.45 0.00 0.00 41.25 37.11 3h0r s ASN 116 CO 0.20 -2.00 0.51 -1.48 -3.72 0.00 0.00 177.10 170.60 3h0r s LEU 117 N -4.82 0.15 0.57 3.21 2.34 -1.26 -2.22 118.68 116.64 3h0r s LEU 117 Ca 0.74 -0.52 -0.20 0.00 0.06 0.00 0.00 54.13 54.21 3h0r s LEU 117 Cb -0.28 2.07 -0.04 0.00 -0.56 0.00 0.00 46.19 47.37 3h0r s LEU 117 CO 0.42 -1.05 1.28 -1.81 -1.06 0.00 0.00 176.35 174.13 3h0r s ASP 118 N -2.88 5.21 0.10 1.48 1.01 -1.12 -3.40 116.67 117.06 3h0r s ASP 118 Ca 0.10 2.58 -0.31 0.00 0.71 0.00 0.00 52.55 55.63 3h0r s ASP 118 Cb -0.01 -2.62 -0.10 0.00 1.01 0.00 0.00 42.92 41.21 3h0r s ASP 118 CO -0.02 -1.59 1.86 -0.70 0.21 0.00 0.00 175.17 174.92 3h0r s GLU 119 N -3.10 4.14 -1.41 8.23 2.12 -0.74 -0.53 118.70 127.42 3h0r s GLU 119 Ca 0.75 2.59 -0.01 0.00 0.36 0.00 0.00 54.97 58.65 3h0r s GLU 119 Cb -0.36 -3.75 0.01 0.00 0.26 0.00 0.00 34.13 30.29 3h0r s GLU 119 CO 0.40 -0.87 0.12 1.19 -0.54 0.00 0.00 175.26 175.57 3h0r n PHE 120 N 6.18 -1.37 -1.65 5.30 3.72 -0.27 -2.56 117.46 126.81 3h0r n PHE 120 Ca 0.18 0.11 -0.15 0.00 -0.05 0.00 0.00 57.45 57.54 3h0r n PHE 120 Cb 0.39 -3.46 -0.05 0.00 -0.94 0.00 0.00 39.48 35.42 3h0r n PHE 120 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3h0r n ALA 121 N -2.44 -0.29 -3.38 4.37 0.00 0.32 -4.82 120.51 114.27 3h0r n ALA 121 Ca -0.17 0.22 -0.40 0.00 0.00 0.00 0.00 53.44 53.09 3h0r n ALA 121 Cb 0.64 -1.68 -0.10 0.00 0.00 0.00 0.00 19.45 18.31 3h0r n ALA 121 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3h0r s MET 122 N -3.66 2.53 0.00 0.00 -1.94 -1.06 -4.65 119.30 110.51 3h0r s MET 122 Ca 0.00 -1.54 0.00 0.00 -1.71 0.00 0.00 55.69 52.44 3h0r s MET 122 Cb 0.00 -3.77 0.00 0.00 2.01 0.00 0.00 34.83 33.07 3h0r s MET 122 CO 0.00 -0.99 0.00 0.41 -0.01 0.00 0.00 175.02 174.43 3h0r n GLY 123 N 4.88 1.91 1.06 -0.03 0.00 -1.26 -4.44 105.19 107.31 3h0r n GLY 123 Ca -0.09 -1.69 0.04 0.00 0.00 0.00 0.00 46.02 44.29 3h0r n GLY 123 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h0r n SER 124 N 0.00 1.16 0.00 1.61 7.64 -1.26 -2.55 113.62 120.22 3h0r n SER 124 Ca 0.00 -2.58 0.00 0.00 1.01 0.00 0.00 58.87 57.30 3h0r n SER 124 Cb 0.00 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 3h0r n SER 124 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3h0r n SER 125 N -0.11 0.00 0.00 6.43 3.41 -1.24 -2.60 113.62 119.51 3h0r n SER 125 Ca 0.09 -0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 3h0r n SER 125 Cb 0.94 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.89 3h0r n SER 125 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3h0r n THR 126 N 0.00 0.00 0.02 6.66 -1.04 -1.18 -4.25 114.28 114.50 3h0r n THR 126 Ca 0.00 0.00 0.22 0.00 -2.04 0.00 0.00 64.05 62.23 3h0r n THR 126 Cb 0.08 -0.02 0.73 0.00 -1.82 0.00 0.00 70.33 69.29 3h0r n THR 126 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3h0r h GLU 127 N 1.77 0.00 -0.22 -2.82 5.08 -1.89 -1.49 114.58 115.00 3h0r h GLU 127 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3h0r h GLU 127 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3h0r h GLU 127 CO 0.00 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.67 3h0r n TYR 128 N -3.97 0.30 -1.67 4.33 4.01 -1.26 -4.76 117.16 114.13 3h0r n TYR 128 Ca 0.10 -0.15 -0.46 0.00 -0.16 0.00 0.00 57.90 57.23 3h0r n TYR 128 Cb 0.67 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.66 3h0r n TYR 128 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3h0r n SER 129 N 0.19 3.15 0.00 7.72 2.88 -0.56 -1.79 113.62 125.21 3h0r n SER 129 Ca 0.10 1.08 0.08 0.00 -1.33 0.00 0.00 58.87 58.80 3h0r n SER 129 Cb 0.22 -1.43 0.37 0.00 -0.75 0.00 0.00 64.21 62.62 3h0r n SER 129 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h0r n ALA 130 N 3.55 1.80 -0.09 -1.46 0.00 -0.62 -3.94 120.51 119.76 3h0r n ALA 130 Ca 0.17 -0.06 -0.17 0.00 0.00 0.00 0.00 53.44 53.38 3h0r n ALA 130 Cb 0.29 -1.26 -0.07 0.00 0.00 0.00 0.00 19.45 18.42 3h0r n ALA 130 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3h0r n PHE 131 N -1.40 0.00 0.00 0.00 3.72 -1.26 -4.91 117.46 113.60 3h0r n PHE 131 Ca 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.46 3h0r n PHE 131 Cb 0.16 -0.63 0.00 0.00 -0.94 0.00 0.00 39.48 38.06 3h0r n PHE 131 CO 0.00 0.00 0.00 1.97 -0.05 0.00 0.00 176.76 178.68 3h0r n PHE 132 N -3.54 0.00 -2.18 1.38 -1.74 -1.25 -5.15 117.46 104.97 3h0r n PHE 132 Ca -0.33 0.00 -0.41 0.00 -0.56 0.00 0.00 57.45 56.15 3h0r n PHE 132 Cb 0.77 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.74 3h0r n PHE 132 CO 0.00 0.00 0.00 -1.25 -0.56 0.00 0.00 176.76 174.95 3h0r s PRO 133 N -2.00 4.41 0.28 3.97 0.04 -1.26 -4.68 135.00 135.75 3h0r s PRO 133 Ca 0.00 2.14 -0.18 0.00 0.04 0.00 0.00 61.00 63.00 3h0r s PRO 133 Cb 0.00 -3.10 -0.09 0.00 0.04 0.00 0.00 34.50 31.36 3h0r s PRO 133 CO 0.00 -0.12 0.74 0.99 0.04 0.00 0.00 177.00 178.65 3h0r s THR 134 N -1.10 4.60 0.04 1.26 2.01 -1.26 -4.80 115.64 116.40 3h0r s THR 134 Ca 0.48 1.16 0.07 0.00 0.31 0.00 0.00 61.69 63.71 3h0r s THR 134 Cb -0.38 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 3h0r s THR 134 CO 0.50 0.01 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.74 3h0r s LYS 135 N -2.47 2.11 -0.14 4.92 1.02 -0.05 -4.36 119.74 120.77 3h0r s LYS 135 Ca 0.49 -0.96 -0.29 0.00 0.02 0.00 0.00 55.97 55.22 3h0r s LYS 135 Cb -0.14 -2.22 -0.05 0.00 -0.52 0.00 0.00 37.83 34.91 3h0r s LYS 135 CO 0.19 0.54 1.75 1.21 -0.92 0.00 0.00 175.35 178.12 3h0r s ASN 136 N -1.47 6.34 0.00 2.83 3.84 -0.05 -4.70 114.94 121.74 3h0r s ASN 136 Ca 0.15 1.95 0.08 0.00 0.21 0.00 0.00 52.86 55.26 3h0r s ASN 136 Cb -0.11 -2.53 0.42 0.00 -0.55 0.00 0.00 41.25 38.48 3h0r s ASN 136 CO 0.06 -1.24 1.12 -0.81 -2.79 0.00 0.00 177.10 173.44 3h0r n PRO 137 N 7.65 0.12 0.02 0.43 -0.04 -1.26 -1.04 135.00 140.88 3h0r n PRO 137 Ca 0.20 0.20 0.11 0.00 -0.04 0.00 0.00 63.50 63.97 3h0r n PRO 137 Cb 0.44 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.43 3h0r n PRO 137 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 3h0r n TRP 138 N -1.27 0.20 -3.15 0.54 7.02 -1.26 -3.95 117.44 115.58 3h0r n TRP 138 Ca 0.04 0.06 0.05 0.00 -1.02 0.00 0.00 57.50 56.63 3h0r n TRP 138 Cb 0.06 -0.37 -0.01 0.00 -2.42 0.00 0.00 31.31 28.57 3h0r n TRP 138 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 3h0r s ASP 139 N -3.74 -0.64 0.00 -0.99 2.15 -0.21 -4.91 116.67 108.34 3h0r s ASP 139 Ca 0.05 0.25 0.19 0.00 0.43 0.00 0.00 52.55 53.46 3h0r s ASP 139 Cb 0.15 1.48 1.12 0.00 -0.30 0.00 0.00 42.92 45.36 3h0r s ASP 139 CO 0.80 -0.12 1.53 0.18 -0.17 0.00 0.00 175.17 177.39 3h0r n LEU 140 N 5.35 0.00 -0.03 -1.34 4.77 -0.95 0.42 117.00 125.22 3h0r n LEU 140 Ca 0.00 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.13 3h0r n LEU 140 Cb 0.55 0.00 0.72 0.00 -2.33 0.00 0.00 43.42 42.36 3h0r n LEU 140 CO -0.11 0.00 0.98 -0.62 -1.33 0.00 0.00 177.39 176.31 3h0r n GLU 141 N -0.95 0.52 -4.40 3.23 1.02 -1.26 -4.76 120.64 114.04 3h0r n GLU 141 Ca 0.14 -0.06 -0.27 0.00 -0.02 0.00 0.00 57.16 56.95 3h0r n GLU 141 Cb 0.06 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 29.87 3h0r n GLU 141 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3h0r s ARG 142 N -2.53 1.46 0.39 3.49 0.52 0.17 -3.37 118.95 119.08 3h0r s ARG 142 Ca 0.29 -1.46 -0.24 0.00 -0.52 0.00 0.00 55.73 53.80 3h0r s ARG 142 Cb 0.20 -1.81 -0.09 0.00 0.52 0.00 0.00 34.95 33.77 3h0r s ARG 142 CO 0.46 0.40 1.02 0.14 0.02 0.00 0.00 175.30 177.35 3h0r s VAL 143 N -1.52 3.86 -2.20 3.52 -7.23 -0.55 -0.87 120.40 115.42 3h0r s VAL 143 Ca 0.18 1.42 0.27 0.00 -1.81 0.00 0.00 61.98 62.04 3h0r s VAL 143 Cb -0.08 -3.73 0.67 0.00 0.56 0.00 0.00 36.38 33.80 3h0r s VAL 143 CO 0.08 0.01 1.90 -0.81 -0.31 0.00 0.00 175.10 175.97 3h0r n PRO 144 N -0.00 1.32 0.00 4.82 -0.04 -1.26 -4.47 135.00 135.36 3h0r n PRO 144 Ca 0.05 -0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.04 3h0r n PRO 144 Cb 0.50 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 3h0r n PRO 144 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h0r n GLY 145 N 1.04 0.24 3.59 0.55 0.00 -1.26 -4.35 105.19 105.01 3h0r n GLY 145 Ca 0.20 -1.94 -0.09 0.00 0.00 0.00 0.00 46.02 44.19 3h0r n GLY 145 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h0r s GLY 146 N -0.78 -0.40 0.19 -0.02 0.00 -1.07 -3.07 107.32 102.17 3h0r s GLY 146 Ca 0.00 0.39 0.23 0.00 0.00 0.00 0.00 44.72 45.34 3h0r s GLY 146 CO 0.00 0.13 1.15 1.48 0.00 0.00 0.00 173.10 175.86 3h0r h SER 147 N 2.00 0.00 0.00 1.64 4.64 -1.60 -3.38 113.55 116.85 3h0r h SER 147 Ca -0.26 -0.07 -0.14 0.00 -0.47 0.00 0.00 61.79 60.85 3h0r h SER 147 Cb 1.27 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.30 3h0r h SER 147 CO 0.31 0.04 -0.22 -1.20 -0.87 0.00 0.00 176.83 174.88 3h0r n SER 148 N -2.52 4.50 -0.00 4.97 7.64 -0.99 -2.80 113.62 124.42 3h0r n SER 148 Ca 0.01 -2.32 -0.11 0.00 1.01 0.00 0.00 58.87 57.46 3h0r n SER 148 Cb 0.51 -1.18 -0.05 0.00 -1.01 0.00 0.00 64.21 62.48 3h0r n SER 148 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3h0r h GLY 149 N 4.85 0.14 1.48 0.23 0.00 -1.69 -2.48 103.07 105.59 3h0r h GLY 149 Ca 0.14 -0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 3h0r h GLY 149 CO 0.23 0.05 0.11 -1.33 0.00 0.00 0.00 176.54 175.60 3h0r h GLY 150 N 0.11 0.71 1.34 4.60 0.00 -1.65 -1.64 103.07 106.55 3h0r h GLY 150 Ca 0.03 -0.39 -0.09 0.00 0.00 0.00 0.00 47.33 46.89 3h0r h GLY 150 CO -0.01 0.37 -0.09 1.76 0.00 0.00 0.00 176.54 178.57 3h0r h SER 151 N 0.65 0.77 -0.05 0.19 0.02 -1.69 -1.30 113.55 112.13 3h0r h SER 151 Ca 0.15 -0.22 -0.05 0.00 -0.84 0.00 0.00 61.79 60.83 3h0r h SER 151 Cb 0.24 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.58 3h0r h SER 151 CO -0.00 0.89 -0.16 0.00 -1.14 0.00 0.00 176.83 176.41 3h0r h ALA 152 N 1.19 0.09 0.01 3.77 0.00 -1.40 -3.20 119.26 119.72 3h0r h ALA 152 Ca 0.12 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 3h0r h ALA 152 Cb 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3h0r h ALA 152 CO 0.03 0.02 -0.00 0.00 0.00 0.00 0.00 179.25 179.30 3h0r h ALA 153 N 0.44 -0.01 0.00 0.00 0.00 -1.19 -0.60 119.26 117.90 3h0r h ALA 153 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3h0r h ALA 153 Cb 0.78 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3h0r h ALA 153 CO 0.04 -0.50 -0.16 0.66 0.00 0.00 0.00 179.25 179.28 3h0r h SER 154 N -0.02 0.00 0.71 0.00 4.64 -1.38 -0.11 113.55 117.38 3h0r h SER 154 Ca -0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.12 3h0r h SER 154 Cb 0.02 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.09 3h0r h SER 154 CO 0.00 0.16 -0.89 0.58 -0.87 0.00 0.00 176.83 175.82 3h0r h VAL 155 N 0.00 1.55 0.02 0.95 2.07 -1.46 -0.47 116.25 118.90 3h0r h VAL 155 Ca -0.00 -2.78 -0.00 0.00 0.82 0.00 0.00 66.70 64.73 3h0r h VAL 155 Cb 0.32 2.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 3h0r h VAL 155 CO 0.02 0.80 -0.01 0.00 0.02 0.00 0.00 177.57 178.41 3h0r h ALA 156 N 1.03 -0.02 0.00 1.67 0.00 0.36 -2.92 119.26 119.38 3h0r h ALA 156 Ca -0.03 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3h0r h ALA 156 Cb 1.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.33 3h0r h ALA 156 CO 0.13 -0.30 0.00 1.33 0.00 0.00 0.00 179.25 180.41 3h0r n VAL 157 N -4.90 0.54 -2.55 0.00 0.24 -0.20 -4.44 118.33 107.02 3h0r n VAL 157 Ca -0.08 0.07 -0.15 0.00 -2.04 0.00 0.00 64.34 62.14 3h0r n VAL 157 Cb 0.22 -0.77 0.01 0.00 -1.47 0.00 0.00 33.84 31.83 3h0r n VAL 157 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3h0r n LEU 158 N -1.73 -2.02 0.06 1.34 4.77 -0.69 -4.89 117.00 113.84 3h0r n LEU 158 Ca 0.05 -0.11 0.10 0.00 -0.03 0.00 0.00 56.01 56.01 3h0r n LEU 158 Cb 0.28 -2.17 0.41 0.00 -2.33 0.00 0.00 43.42 39.61 3h0r n LEU 158 CO 0.22 0.02 0.80 -1.54 -1.33 0.00 0.00 177.39 175.57 3h0r n SER 159 N -0.95 0.30 -3.76 -1.43 3.41 -0.27 -4.66 113.62 106.26 3h0r n SER 159 Ca -0.12 0.57 -0.13 0.00 -0.26 0.00 0.00 58.87 58.93 3h0r n SER 159 Cb 0.60 -0.63 -0.10 0.00 -0.26 0.00 0.00 64.21 63.82 3h0r n SER 159 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h0r s ALA 160 N -3.13 -0.79 0.22 7.33 0.00 -0.96 -4.69 121.76 119.75 3h0r s ALA 160 Ca 0.07 0.65 0.06 0.00 0.00 0.00 0.00 51.96 52.74 3h0r s ALA 160 Cb 0.10 -0.27 0.18 0.00 0.00 0.00 0.00 23.12 23.13 3h0r s ALA 160 CO 0.35 -0.20 1.50 -1.00 0.00 0.00 0.00 175.76 176.42 3h0r h PRO 161 N 4.87 0.13 -3.70 0.00 0.13 -1.83 -3.33 132.00 128.27 3h0r h PRO 161 Ca -0.28 -0.11 -0.11 0.00 -0.87 0.00 0.00 66.00 64.64 3h0r h PRO 161 Cb 1.18 0.02 -0.16 0.00 0.13 0.00 0.00 31.00 32.17 3h0r h PRO 161 CO 0.34 0.79 -0.42 0.08 -0.23 0.00 0.00 178.00 178.56 3h0r s VAL 162 N -3.47 0.13 -0.02 1.56 1.01 -1.26 -4.23 120.40 114.12 3h0r s VAL 162 Ca -0.02 -1.04 -0.18 0.00 0.00 0.00 0.00 61.98 60.74 3h0r s VAL 162 Cb 0.12 -1.06 0.03 0.00 0.00 0.00 0.00 36.38 35.47 3h0r s VAL 162 CO 0.80 -0.58 0.37 -0.55 0.00 0.00 0.00 175.10 175.14 3h0r s SER 163 N -2.35 -0.27 -0.12 3.32 0.15 -0.46 -2.90 113.70 111.06 3h0r s SER 163 Ca -0.02 0.21 -0.02 0.00 0.70 0.00 0.00 55.95 56.82 3h0r s SER 163 Cb 0.01 0.36 -0.03 0.00 -1.71 0.00 0.00 66.02 64.65 3h0r s SER 163 CO -0.06 -0.47 -0.05 -0.76 1.20 0.00 0.00 173.24 173.10 3h0r s LEU 164 N -1.27 3.22 0.00 3.45 1.02 -0.60 -1.22 118.68 123.28 3h0r s LEU 164 Ca -0.13 -0.09 0.01 0.00 0.02 0.00 0.00 54.13 53.94 3h0r s LEU 164 Cb -0.04 -1.75 -0.00 0.00 0.02 0.00 0.00 46.19 44.41 3h0r s LEU 164 CO 0.05 0.24 0.03 0.61 0.02 0.00 0.00 176.35 177.30 3h0r n GLY 165 N 3.06 3.94 3.13 -3.19 0.00 -0.80 -1.81 105.19 109.51 3h0r n GLY 165 Ca -0.18 -1.95 -0.10 0.00 0.00 0.00 0.00 46.02 43.79 3h0r n GLY 165 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h0r s SER 166 N -1.47 0.92 -0.18 1.61 1.04 -1.26 -1.47 113.70 112.89 3h0r s SER 166 Ca 0.04 -0.90 -0.03 0.00 0.48 0.00 0.00 55.95 55.54 3h0r s SER 166 Cb 0.00 0.10 0.06 0.00 0.10 0.00 0.00 66.02 66.28 3h0r s SER 166 CO 0.03 -0.44 0.05 -0.62 0.98 0.00 0.00 173.24 173.24 3h0r s ASP 167 N -2.68 2.65 -0.22 7.02 -1.08 0.24 -3.22 116.67 119.39 3h0r s ASP 167 Ca 0.06 -0.71 0.09 0.00 -0.52 0.00 0.00 52.55 51.46 3h0r s ASP 167 Cb 0.02 -0.47 -0.19 0.00 -1.46 0.00 0.00 42.92 40.82 3h0r s ASP 167 CO -0.05 -0.32 -0.09 0.41 0.52 0.00 0.00 175.17 175.65 3h0r n THR 168 N 5.13 1.35 -2.07 1.71 -1.04 -1.26 -2.28 114.28 115.82 3h0r n THR 168 Ca -0.08 -0.66 -0.01 0.00 -2.04 0.00 0.00 64.05 61.26 3h0r n THR 168 Cb 0.48 -0.96 -0.01 0.00 -1.82 0.00 0.00 70.33 68.02 3h0r n THR 168 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3h0r n GLY 169 N 2.10 0.76 0.00 3.41 0.00 -1.26 -4.66 105.19 105.54 3h0r n GLY 169 Ca -0.38 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.52 3h0r n GLY 169 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h0r n GLY 170 N 0.07 0.57 0.00 -0.02 0.00 -1.26 -3.08 105.19 101.47 3h0r n GLY 170 Ca -0.04 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.07 3h0r n GLY 170 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h0r n SER 171 N 0.00 0.00 -0.12 1.61 7.64 -1.26 -1.19 113.62 120.30 3h0r n SER 171 Ca 0.00 0.46 -0.23 0.00 1.01 0.00 0.00 58.87 60.10 3h0r n SER 171 Cb 0.00 -0.48 -0.09 0.00 -1.01 0.00 0.00 64.21 62.63 3h0r n SER 171 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3h0r n ILE 172 N -1.48 1.52 -0.07 0.44 5.41 -1.20 -2.34 119.36 121.65 3h0r n ILE 172 Ca 0.05 -0.17 -0.10 0.00 1.00 0.00 0.00 62.75 63.53 3h0r n ILE 172 Cb 0.23 -2.02 -0.03 0.00 -0.71 0.00 0.00 39.64 37.11 3h0r n ILE 172 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 3h0r h ARG 173 N -1.00 0.35 -0.24 0.38 3.08 -1.75 -0.80 114.38 114.40 3h0r h ARG 173 Ca -0.47 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 59.36 3h0r h ARG 173 Cb 1.37 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.36 3h0r h ARG 173 CO -0.28 0.34 -0.55 -0.56 -1.07 0.00 0.00 179.97 177.85 3h0r h GLN 174 N 0.27 0.73 -0.50 0.04 -0.00 -1.46 0.53 115.11 114.72 3h0r h GLN 174 Ca 0.08 -0.46 -0.00 0.00 -0.00 0.00 0.00 58.65 58.27 3h0r h GLN 174 Cb 0.10 0.05 -0.02 0.00 -0.00 0.00 0.00 27.48 27.61 3h0r h GLN 174 CO -0.01 1.09 0.30 -1.35 -0.00 0.00 0.00 178.83 178.85 3h0r h PRO 175 N 0.56 0.67 -0.47 0.06 0.11 -1.74 -0.52 132.00 130.67 3h0r h PRO 175 Ca 0.01 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.02 3h0r h PRO 175 Cb 1.13 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 3h0r h PRO 175 CO 0.11 0.48 0.09 0.00 -0.21 0.00 0.00 178.00 178.47 3h0r h ALA 176 N 1.64 1.27 0.30 -0.75 0.00 -0.41 -0.88 119.26 120.44 3h0r h ALA 176 Ca 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3h0r h ALA 176 Cb -0.02 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.58 3h0r h ALA 176 CO -0.03 0.50 -0.14 1.03 0.00 0.00 0.00 179.25 180.60 3h0r h SER 177 N 0.70 -0.34 0.00 0.00 0.87 -0.52 -0.81 113.55 113.44 3h0r h SER 177 Ca 0.15 -0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.54 3h0r h SER 177 Cb 0.30 0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 3h0r h SER 177 CO 0.00 0.00 -0.00 -0.26 -0.53 0.00 0.00 176.83 176.04 3h0r h PHE 178 N -0.72 0.00 -0.14 2.24 -1.00 -0.98 -2.89 116.94 113.45 3h0r h PHE 178 Ca -0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.74 3h0r h PHE 178 Cb 0.49 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.05 3h0r h PHE 178 CO 0.02 0.00 0.00 0.00 -1.61 0.00 0.00 178.31 176.72 3h0r n GLY 180 N 1.20 0.05 3.08 0.00 0.00 -0.69 -4.74 105.19 104.08 3h0r n GLY 180 Ca 0.14 -0.17 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 3h0r n GLY 180 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h0r s VAL 181 N -3.19 0.26 0.11 1.61 1.01 -0.40 -4.89 120.40 114.92 3h0r s VAL 181 Ca 0.09 -1.68 -0.30 0.00 0.00 0.00 0.00 61.98 60.09 3h0r s VAL 181 Cb -0.04 -1.34 -0.06 0.00 0.00 0.00 0.00 36.38 34.94 3h0r s VAL 181 CO 0.39 -0.90 0.95 -0.63 0.00 0.00 0.00 175.10 174.91 3h0r s ILE 182 N -3.49 4.50 -0.05 2.22 1.01 0.46 -4.36 121.20 121.50 3h0r s ILE 182 Ca 0.04 2.04 -0.02 0.00 0.00 0.00 0.00 60.65 62.71 3h0r s ILE 182 Cb 0.05 -4.31 0.04 0.00 0.01 0.00 0.00 42.46 38.24 3h0r s ILE 182 CO -0.08 0.33 0.10 -0.83 0.00 0.00 0.00 174.94 174.46 3h0r s GLY 183 N -0.05 0.09 -0.11 6.18 0.00 -0.72 -0.40 107.32 112.32 3h0r s GLY 183 Ca 0.46 0.42 0.00 0.00 0.00 0.00 0.00 44.72 45.60 3h0r s GLY 183 CO 0.29 1.26 -0.12 -1.50 0.00 0.00 0.00 173.10 173.04 3h0r s ILE 184 N 1.80 3.22 -0.29 0.90 2.07 0.03 -1.07 121.20 127.86 3h0r s ILE 184 Ca -0.01 -0.62 -0.07 0.00 -1.41 0.00 0.00 60.65 58.54 3h0r s ILE 184 Cb -0.12 -2.34 -0.00 0.00 0.13 0.00 0.00 42.46 40.13 3h0r s ILE 184 CO -0.04 0.54 0.09 -0.75 -1.91 0.00 0.00 174.94 172.87 3h0r s LYS 185 N -0.02 3.24 0.97 3.50 2.20 -0.27 -1.95 119.74 127.42 3h0r s LYS 185 Ca -0.03 -0.76 -0.16 0.00 -0.36 0.00 0.00 55.97 54.66 3h0r s LYS 185 Cb -0.14 -3.39 0.23 0.00 -1.51 0.00 0.00 37.83 33.02 3h0r s LYS 185 CO 0.04 -0.39 1.18 -0.35 -0.36 0.00 0.00 175.35 175.47 3h0r n PRO 186 N 4.90 -1.66 -1.72 4.03 -0.04 -1.26 -0.91 135.00 138.34 3h0r n PRO 186 Ca -0.15 -1.84 -0.41 0.00 -0.04 0.00 0.00 63.50 61.06 3h0r n PRO 186 Cb 0.49 -1.34 0.01 0.00 -0.04 0.00 0.00 33.50 32.62 3h0r n PRO 186 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3h0r n THR 187 N -3.96 2.39 -1.70 0.52 -1.04 -1.26 -4.32 114.28 104.91 3h0r n THR 187 Ca 0.15 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 61.24 3h0r n THR 187 Cb 0.54 -1.66 -0.03 0.00 -1.82 0.00 0.00 70.33 67.36 3h0r n THR 187 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 3h0r s TYR 188 N -1.16 1.49 0.00 -1.42 5.04 -0.69 -1.10 117.35 119.50 3h0r s TYR 188 Ca 0.59 -0.34 0.00 0.00 -2.44 0.00 0.00 57.07 54.88 3h0r s TYR 188 Cb -0.51 -4.21 0.00 0.00 0.35 0.00 0.00 41.96 37.59 3h0r s TYR 188 CO 0.60 -5.33 0.00 0.41 -1.34 0.00 0.00 175.55 169.89 3h0r n GLY 189 N 4.46 1.65 0.14 8.97 0.00 -1.26 -4.93 105.19 114.20 3h0r n GLY 189 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 3h0r n GLY 189 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3h0r h ARG 190 N 2.00 0.07 -5.69 1.61 2.43 -1.44 -1.32 114.38 112.04 3h0r h ARG 190 Ca 0.00 -0.06 -0.62 0.00 -0.81 0.00 0.00 59.98 58.49 3h0r h ARG 190 Cb 0.00 0.01 -0.31 0.00 -0.42 0.00 0.00 29.97 29.25 3h0r h ARG 190 CO 0.00 0.71 -0.86 0.08 -1.51 0.00 0.00 179.97 178.39 3h0r s VAL 191 N -3.53 1.73 0.42 0.20 1.01 -1.26 -0.72 120.40 118.24 3h0r s VAL 191 Ca -0.02 -0.89 -0.26 0.00 0.00 0.00 0.00 61.98 60.81 3h0r s VAL 191 Cb 0.12 -1.47 -0.10 0.00 0.00 0.00 0.00 36.38 34.93 3h0r s VAL 191 CO 0.78 0.49 1.30 -0.24 0.00 0.00 0.00 175.10 177.43 3h0r n SER 192 N 3.00 2.70 -1.21 3.32 2.88 -1.26 -4.76 113.62 118.29 3h0r n SER 192 Ca -0.18 1.12 0.11 0.00 -1.33 0.00 0.00 58.87 58.59 3h0r n SER 192 Cb 0.52 -1.51 0.29 0.00 -0.75 0.00 0.00 64.21 62.76 3h0r n SER 192 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3h0r n ARG 193 N 0.07 2.73 -2.13 -1.46 1.74 -1.26 -4.75 116.66 111.61 3h0r n ARG 193 Ca 0.06 -2.53 -0.43 0.00 -0.77 0.00 0.00 57.85 54.18 3h0r n ARG 193 Cb 0.39 -1.51 -0.02 0.00 -1.02 0.00 0.00 32.46 30.30 3h0r n ARG 193 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3h0r s TYR 194 N -1.03 2.05 0.00 -1.55 5.04 -1.26 -1.98 117.35 118.63 3h0r s TYR 194 Ca 0.44 0.62 0.00 0.00 -2.44 0.00 0.00 57.07 55.69 3h0r s TYR 194 Cb 0.23 -4.15 0.00 0.00 0.35 0.00 0.00 41.96 38.39 3h0r s TYR 194 CO 0.30 -2.65 0.00 0.41 -1.34 0.00 0.00 175.55 172.27 3h0r n GLY 195 N 5.16 0.77 3.58 8.97 0.00 -1.26 -1.04 105.19 121.36 3h0r n GLY 195 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 3h0r n GLY 195 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h0r s LEU 196 N 0.00 4.23 -0.02 0.99 2.96 -0.84 -1.12 118.68 124.89 3h0r s LEU 196 Ca 0.00 0.07 -0.30 0.00 -0.22 0.00 0.00 54.13 53.69 3h0r s LEU 196 Cb 0.00 -2.46 -0.08 0.00 0.50 0.00 0.00 46.19 44.15 3h0r s LEU 196 CO 0.00 -0.31 2.03 0.52 -1.32 0.00 0.00 176.35 177.26 3h0r n VAL 197 N 5.24 0.68 -2.19 1.68 0.31 0.06 -4.86 118.33 119.25 3h0r n VAL 197 Ca -0.07 -0.20 -0.42 0.00 -0.01 0.00 0.00 64.34 63.63 3h0r n VAL 197 Cb 0.50 -2.36 -0.03 0.00 -0.91 0.00 0.00 33.84 31.04 3h0r n VAL 197 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h0r s ALA 198 N 5.24 3.58 0.00 3.52 0.00 -1.26 -4.95 121.76 127.89 3h0r s ALA 198 Ca 0.92 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.97 3h0r s ALA 198 Cb -0.42 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.16 3h0r s ALA 198 CO 0.41 -0.61 0.00 0.34 0.00 0.00 0.00 175.76 175.90 3h0r n PHE 199 N 4.00 0.00 -4.03 0.00 7.35 -1.26 -4.76 117.46 118.76 3h0r n PHE 199 Ca 0.11 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.48 3h0r n PHE 199 Cb 0.43 0.00 -0.15 0.00 0.35 0.00 0.00 39.48 40.11 3h0r n PHE 199 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3h0r s ALA 200 N -3.91 2.65 0.42 3.13 0.00 -1.26 -2.61 121.76 120.18 3h0r s ALA 200 Ca 0.00 -1.83 0.08 0.00 0.00 0.00 0.00 51.96 50.21 3h0r s ALA 200 Cb 0.00 -1.69 0.91 0.00 0.00 0.00 0.00 23.12 22.34 3h0r s ALA 200 CO 0.00 -1.26 2.06 0.77 0.00 0.00 0.00 175.76 177.34 3h0r h SER 201 N 7.80 0.40 0.50 0.00 0.02 -1.93 0.12 113.55 120.46 3h0r h SER 201 Ca -0.18 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 3h0r h SER 201 Cb 1.04 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.48 3h0r h SER 201 CO 0.48 0.30 -0.10 -1.54 -1.14 0.00 0.00 176.83 174.84 3h0r n SER 202 N -4.47 0.29 0.00 3.07 3.41 -1.26 -4.13 113.62 110.52 3h0r n SER 202 Ca 0.02 -0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 3h0r n SER 202 Cb 0.07 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 3h0r n SER 202 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h0r n LEU 203 N -1.15 0.00 -4.67 1.04 4.77 -0.62 -4.97 117.00 111.40 3h0r n LEU 203 Ca 0.13 0.00 -0.44 0.00 -0.03 0.00 0.00 56.01 55.66 3h0r n LEU 203 Cb 0.28 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.34 3h0r n LEU 203 CO 0.25 0.00 0.99 0.47 -1.33 0.00 0.00 177.39 177.76 3h0r n ASP 204 N -1.65 2.72 -3.70 -1.43 8.00 0.32 -4.40 116.55 116.40 3h0r n ASP 204 Ca 0.00 1.15 -0.11 0.00 0.71 0.00 0.00 54.79 56.55 3h0r n ASP 204 Cb 0.30 -1.43 -0.11 0.00 -0.02 0.00 0.00 41.12 39.86 3h0r n ASP 204 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3h0r s GLN 205 N -0.64 0.35 0.38 -1.24 -1.52 -0.97 -4.88 119.66 111.14 3h0r s GLN 205 Ca 0.66 0.76 -0.28 0.00 -1.95 0.00 0.00 55.36 54.55 3h0r s GLN 205 Cb -0.64 -0.02 -0.11 0.00 -0.22 0.00 0.00 33.01 32.02 3h0r s GLN 205 CO 0.52 -0.17 1.49 -0.89 -0.25 0.00 0.00 175.29 175.99 3h0r n ILE 206 N 4.35 1.99 -3.47 1.08 5.41 -1.26 -0.59 119.36 126.87 3h0r n ILE 206 Ca -0.22 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.03 3h0r n ILE 206 Cb 0.54 -1.98 0.00 0.00 -0.71 0.00 0.00 39.64 37.49 3h0r n ILE 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3h0r n GLY 207 N 0.46 3.59 2.98 7.39 0.00 -0.54 -4.47 105.19 114.60 3h0r n GLY 207 Ca 0.01 -1.40 -0.20 0.00 0.00 0.00 0.00 46.02 44.44 3h0r n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h0r s VAL 208 N -2.19 0.69 -0.03 1.61 1.01 -0.82 -1.91 120.40 118.76 3h0r s VAL 208 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 3h0r s VAL 208 Cb 0.00 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.72 3h0r s VAL 208 CO 0.00 0.22 0.09 -0.36 0.00 0.00 0.00 175.10 175.05 3h0r s PHE 209 N 0.23 3.34 0.29 5.22 0.08 -0.36 -0.79 117.98 126.00 3h0r s PHE 209 Ca -0.03 0.27 -0.19 0.00 0.12 0.00 0.00 56.93 57.09 3h0r s PHE 209 Cb -0.08 -1.78 0.06 0.00 -0.57 0.00 0.00 43.02 40.64 3h0r s PHE 209 CO 0.00 0.58 0.87 0.20 -0.10 0.00 0.00 175.22 176.77 3h0r s GLY 210 N -1.54 0.16 -0.07 4.36 0.00 0.46 -1.35 107.32 109.33 3h0r s GLY 210 Ca 0.21 -0.46 0.10 0.00 0.00 0.00 0.00 44.72 44.56 3h0r s GLY 210 CO 0.11 0.50 0.10 0.54 0.00 0.00 0.00 173.10 174.36 3h0r n ARG 211 N -0.56 1.68 -5.11 2.90 1.74 -1.26 -0.40 116.66 115.65 3h0r n ARG 211 Ca -0.06 -0.04 -0.31 0.00 -0.77 0.00 0.00 57.85 56.67 3h0r n ARG 211 Cb 0.60 -1.26 -0.15 0.00 -1.02 0.00 0.00 32.46 30.63 3h0r n ARG 211 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3h0r s ARG 212 N -2.42 2.09 0.45 5.56 0.52 -1.26 -4.42 118.95 119.48 3h0r s ARG 212 Ca -0.05 -0.94 0.12 0.00 -0.52 0.00 0.00 55.73 54.34 3h0r s ARG 212 Cb 0.04 -2.09 1.02 0.00 0.52 0.00 0.00 34.95 34.45 3h0r s ARG 212 CO 0.43 0.56 2.06 1.15 0.02 0.00 0.00 175.30 179.52 3h0r h THR 213 N 4.36 1.08 -0.47 0.02 2.02 -1.93 -1.85 112.91 116.15 3h0r h THR 213 Ca -0.45 -0.27 -0.10 0.00 0.77 0.00 0.00 66.41 66.36 3h0r h THR 213 Cb 1.13 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 68.45 3h0r h THR 213 CO 0.47 0.10 -0.12 -0.33 0.37 0.00 0.00 175.52 176.00 3h0r h GLU 214 N 0.22 0.86 -0.05 6.66 5.08 -1.95 -0.70 114.58 124.69 3h0r h GLU 214 Ca 0.05 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 3h0r h GLU 214 Cb 0.09 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 3h0r h GLU 214 CO -0.00 0.94 0.03 -0.44 -1.00 0.00 0.00 179.01 178.53 3h0r h ASP 215 N 0.77 0.05 -0.36 1.42 3.32 -1.77 -2.07 116.42 117.78 3h0r h ASP 215 Ca 0.12 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 3h0r h ASP 215 Cb 0.63 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 3h0r h ASP 215 CO 0.04 0.06 0.19 0.58 -1.72 0.00 0.00 179.24 178.39 3h0r h VAL 216 N 0.05 1.15 -0.39 -1.35 2.07 -1.26 -2.09 116.25 114.43 3h0r h VAL 216 Ca 0.02 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 3h0r h VAL 216 Cb 0.01 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3h0r h VAL 216 CO -0.00 0.15 0.02 0.00 0.02 0.00 0.00 177.57 177.76 3h0r h ALA 217 N 1.05 1.29 0.06 1.67 0.00 -1.06 -1.79 119.26 120.48 3h0r h ALA 217 Ca 0.13 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3h0r h ALA 217 Cb 0.08 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3h0r h ALA 217 CO -0.02 0.48 -0.03 1.25 0.00 0.00 0.00 179.25 180.94 3h0r h LEU 218 N 0.59 -0.06 -0.55 0.00 5.85 -1.10 -1.60 115.31 118.43 3h0r h LEU 218 Ca 0.13 -0.50 0.01 0.00 0.84 0.00 0.00 57.88 58.36 3h0r h LEU 218 Cb 0.35 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 3h0r h LEU 218 CO 0.01 0.49 0.36 0.58 -0.34 0.00 0.00 178.44 179.54 3h0r h VAL 219 N -0.65 1.12 -0.62 1.05 2.07 -1.29 -1.53 116.25 116.39 3h0r h VAL 219 Ca -0.01 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.29 3h0r h VAL 219 Cb 0.56 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 3h0r h VAL 219 CO 0.01 0.13 0.39 0.25 0.02 0.00 0.00 177.57 178.37 3h0r h LEU 220 N 0.72 0.64 -1.00 2.57 5.85 -1.40 -2.51 115.31 120.17 3h0r h LEU 220 Ca 0.21 -0.00 0.13 0.00 0.84 0.00 0.00 57.88 59.06 3h0r h LEU 220 Cb -0.05 -0.14 -0.09 0.00 0.37 0.00 0.00 40.66 40.75 3h0r h LEU 220 CO -0.06 0.45 0.63 -0.08 -0.34 0.00 0.00 178.44 179.03 3h0r h GLU 221 N 0.76 0.94 0.00 1.25 4.81 -0.32 -2.56 114.58 119.47 3h0r h GLU 221 Ca 0.25 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.32 3h0r h GLU 221 Cb 0.00 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 3h0r h GLU 221 CO -0.09 0.62 -0.47 0.28 -0.73 0.00 0.00 179.01 178.62 3h0r h VAL 222 N 0.97 1.11 -0.00 0.32 2.07 -0.90 -3.30 116.25 116.52 3h0r h VAL 222 Ca 0.51 -1.73 0.00 0.00 0.82 0.00 0.00 66.70 66.30 3h0r h VAL 222 Cb 0.54 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 3h0r h VAL 222 CO -0.28 0.46 -0.31 2.30 0.02 0.00 0.00 177.57 179.75 3h0r n ILE 223 N -3.66 0.00 -4.10 4.57 -5.35 -1.00 -4.79 119.36 105.03 3h0r n ILE 223 Ca -0.01 -0.34 -0.22 0.00 -0.27 0.00 0.00 62.75 61.91 3h0r n ILE 223 Cb 0.54 1.05 -0.05 0.00 -1.74 0.00 0.00 39.64 39.44 3h0r n ILE 223 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3h0r s SER 224 N -1.59 5.04 0.00 7.28 1.04 -1.00 -4.40 113.70 120.08 3h0r s SER 224 Ca 0.05 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 55.97 3h0r s SER 224 Cb 0.07 -1.03 0.00 0.00 0.10 0.00 0.00 66.02 65.16 3h0r s SER 224 CO 0.30 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.99 3h0r n GLY 225 N -1.14 1.20 3.77 7.32 0.00 0.10 -4.83 105.19 111.60 3h0r n GLY 225 Ca -0.05 -2.10 -0.39 0.00 0.00 0.00 0.00 46.02 43.48 3h0r n GLY 225 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3h0r s TRP 226 N -1.59 3.47 -0.11 1.61 -0.00 -1.26 -4.51 118.94 116.55 3h0r s TRP 226 Ca 0.00 1.68 0.01 0.00 -0.00 0.00 0.00 56.10 57.79 3h0r s TRP 226 Cb 0.00 -3.23 0.02 0.00 -0.00 0.00 0.00 33.47 30.26 3h0r s TRP 226 CO 0.00 -0.59 -0.11 0.34 -0.00 0.00 0.00 176.95 176.59 3h0r s ASP 227 N -1.11 2.28 0.55 5.86 2.15 -1.26 -5.01 116.67 120.13 3h0r s ASP 227 Ca 0.49 -0.37 0.34 0.00 0.43 0.00 0.00 52.55 53.44 3h0r s ASP 227 Cb -0.29 -0.96 1.52 0.00 -0.30 0.00 0.00 42.92 42.89 3h0r s ASP 227 CO 0.37 -0.05 2.05 1.05 -0.17 0.00 0.00 175.17 178.41 3h0r h GLU 228 N 7.81 0.00 -0.01 4.34 4.11 -1.96 -1.92 114.58 126.96 3h0r h GLU 228 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.11 3h0r h GLU 228 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3h0r h GLU 228 CO 0.46 0.05 -0.00 1.63 0.07 0.00 0.00 179.01 181.22 3h0r n LYS 229 N -3.21 1.25 -3.85 1.06 5.02 -1.26 -4.70 118.16 112.47 3h0r n LYS 229 Ca -0.00 -0.38 -0.29 0.00 -2.02 0.00 0.00 58.31 55.62 3h0r n LYS 229 Cb 0.27 -1.49 -0.16 0.00 -0.02 0.00 0.00 35.03 33.63 3h0r n LYS 229 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3h0r s ASP 230 N -2.01 3.33 0.46 4.39 -1.08 -0.72 -4.80 116.67 116.25 3h0r s ASP 230 Ca 0.44 -0.97 0.14 0.00 -0.52 0.00 0.00 52.55 51.65 3h0r s ASP 230 Cb 0.22 -0.90 1.07 0.00 -1.46 0.00 0.00 42.92 41.85 3h0r s ASP 230 CO 0.36 -0.26 2.04 0.28 0.52 0.00 0.00 175.17 178.10 3h0r h SER 231 N 8.10 0.02 0.32 -0.34 0.02 -1.84 -2.62 113.55 117.21 3h0r h SER 231 Ca -0.18 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3h0r h SER 231 Cb 1.10 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.63 3h0r h SER 231 CO 0.38 0.14 -0.40 0.35 -1.14 0.00 0.00 176.83 176.16 3h0r n THR 232 N -4.39 0.00 -2.59 -2.27 -2.24 -1.26 -4.88 114.28 96.65 3h0r n THR 232 Ca -0.02 -0.08 -0.40 0.00 -2.27 0.00 0.00 64.05 61.28 3h0r n THR 232 Cb 0.20 0.39 -0.05 0.00 -2.10 0.00 0.00 70.33 68.77 3h0r n THR 232 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3h0r s SER 233 N -2.72 7.37 0.09 3.42 1.04 -0.99 -4.43 113.70 117.48 3h0r s SER 233 Ca 0.18 2.12 -0.16 0.00 0.48 0.00 0.00 55.95 58.57 3h0r s SER 233 Cb 0.18 -2.62 -0.07 0.00 0.10 0.00 0.00 66.02 63.62 3h0r s SER 233 CO 0.61 -0.06 0.52 0.00 0.98 0.00 0.00 173.24 175.30 3h0r s ALA 234 N -1.23 3.61 -1.38 5.32 0.00 -0.50 -4.76 121.76 122.82 3h0r s ALA 234 Ca 0.44 -0.10 -0.11 0.00 0.00 0.00 0.00 51.96 52.20 3h0r s ALA 234 Cb -0.28 -2.53 0.09 0.00 0.00 0.00 0.00 23.12 20.40 3h0r s ALA 234 CO 0.36 0.44 2.13 1.63 0.00 0.00 0.00 175.76 180.32 3h0r n LYS 235 N 1.33 3.34 -4.42 0.00 5.02 -1.26 -3.98 118.16 118.20 3h0r n LYS 235 Ca -0.09 -3.03 -0.23 0.00 -2.02 0.00 0.00 58.31 52.94 3h0r n LYS 235 Cb 0.52 -3.06 -0.16 0.00 -0.02 0.00 0.00 35.03 32.30 3h0r n LYS 235 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3h0r s VAL 236 N 1.64 0.92 0.47 -0.18 1.01 -1.26 -5.08 120.40 117.91 3h0r s VAL 236 Ca 0.45 -0.35 -0.24 0.00 0.00 0.00 0.00 61.98 61.85 3h0r s VAL 236 Cb 0.13 -0.87 -0.07 0.00 0.00 0.00 0.00 36.38 35.57 3h0r s VAL 236 CO -0.05 0.31 1.36 -2.16 0.00 0.00 0.00 175.10 174.56 3h0r s PRO 237 N 0.78 3.58 -0.24 2.72 0.04 -1.26 -4.59 135.00 136.03 3h0r s PRO 237 Ca -0.13 2.26 -0.27 0.00 0.04 0.00 0.00 61.00 62.89 3h0r s PRO 237 Cb -0.15 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 31.86 3h0r s PRO 237 CO 0.02 -0.85 0.96 0.08 0.04 0.00 0.00 177.00 177.25 3h0r s VAL 238 N -1.27 4.74 0.57 -0.36 1.01 -1.26 -5.02 120.40 118.80 3h0r s VAL 238 Ca 0.64 1.84 -0.21 0.00 0.00 0.00 0.00 61.98 64.24 3h0r s VAL 238 Cb -0.40 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.70 3h0r s VAL 238 CO 0.50 -0.15 1.34 -2.84 0.00 0.00 0.00 175.10 173.96 3h0r s PRO 239 N 3.07 3.02 -1.18 2.72 0.02 -1.26 -4.88 135.00 136.51 3h0r s PRO 239 Ca 0.40 2.18 -0.19 0.00 0.02 0.00 0.00 61.00 63.41 3h0r s PRO 239 Cb -0.15 -2.16 -0.03 0.00 0.02 0.00 0.00 34.50 32.18 3h0r s PRO 239 CO 0.07 -1.26 1.94 -1.91 -0.33 0.00 0.00 177.00 175.50 3h0r n GLU 240 N -1.22 2.31 -0.04 5.54 2.13 -1.26 -4.77 120.64 123.33 3h0r n GLU 240 Ca 0.12 -2.59 -0.03 0.00 0.66 0.00 0.00 57.16 55.32 3h0r n GLU 240 Cb 0.46 -3.38 0.22 0.00 0.27 0.00 0.00 31.44 29.00 3h0r n GLU 240 CO 0.00 0.00 0.00 -1.49 -0.41 0.00 0.00 177.13 175.23 3h0r h TRP 241 N 7.87 0.66 -0.23 4.31 6.55 -1.89 -2.36 115.95 130.85 3h0r h TRP 241 Ca 0.41 -0.10 0.04 0.00 0.95 0.00 0.00 58.89 60.20 3h0r h TRP 241 Cb 0.79 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 28.90 3h0r h TRP 241 CO 1.34 0.68 0.16 0.66 -1.05 0.00 0.00 178.44 180.22 3h0r h SER 242 N 0.57 0.10 0.36 -3.49 4.64 -1.86 -0.69 113.55 113.18 3h0r h SER 242 Ca 0.11 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3h0r h SER 242 Cb 0.47 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3h0r h SER 242 CO 0.03 0.07 -0.51 -0.62 -0.87 0.00 0.00 176.83 174.92 3h0r n GLU 243 N -4.49 0.22 -0.02 4.77 -0.58 -0.92 -4.42 120.64 115.20 3h0r n GLU 243 Ca 0.02 -0.14 0.02 0.00 -0.42 0.00 0.00 57.16 56.64 3h0r n GLU 243 Cb 0.23 -1.50 -0.09 0.00 -0.57 0.00 0.00 31.44 29.52 3h0r n GLU 243 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 3h0r n GLU 244 N -1.27 0.98 -0.02 3.49 4.07 -0.38 -4.53 120.64 122.99 3h0r n GLU 244 Ca 0.07 -0.07 -0.01 0.00 -0.06 0.00 0.00 57.16 57.09 3h0r n GLU 244 Cb 0.34 -1.27 0.27 0.00 -0.06 0.00 0.00 31.44 30.73 3h0r n GLU 244 CO 0.00 0.00 0.00 -0.39 -0.06 0.00 0.00 177.13 176.68 3h0r h VAL 245 N 0.00 1.21 0.00 6.31 -1.51 -1.47 -2.86 116.25 117.93 3h0r h VAL 245 Ca -0.09 -0.84 -0.07 0.00 -1.23 0.00 0.00 66.70 64.47 3h0r h VAL 245 Cb 0.88 0.94 -0.01 0.00 -2.13 0.00 0.00 31.29 30.97 3h0r h VAL 245 CO 0.01 0.29 -0.35 0.11 -1.23 0.00 0.00 177.57 176.39 3h0r h LYS 246 N 0.54 0.00 -7.29 5.19 1.57 -1.84 -3.40 116.57 111.35 3h0r h LYS 246 Ca 0.11 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.38 3h0r h LYS 246 Cb 0.36 0.00 0.17 0.00 0.08 0.00 0.00 32.23 32.84 3h0r h LYS 246 CO 0.01 0.35 0.26 0.15 -0.57 0.00 0.00 179.45 179.66 3h0r s LYS 247 N -3.55 1.50 -0.07 3.15 1.02 -1.08 -5.06 119.74 115.65 3h0r s LYS 247 Ca 0.01 1.40 0.00 0.00 0.02 0.00 0.00 55.97 57.40 3h0r s LYS 247 Cb 0.10 -1.79 0.02 0.00 -0.52 0.00 0.00 37.83 35.64 3h0r s LYS 247 CO 0.68 -2.25 -0.05 -2.00 -0.92 0.00 0.00 175.35 170.81 3h0r s GLU 248 N -4.75 1.05 -0.18 1.68 2.12 -1.26 -4.92 118.70 112.43 3h0r s GLU 248 Ca 0.65 -0.13 -0.06 0.00 0.36 0.00 0.00 54.97 55.78 3h0r s GLU 248 Cb -0.21 -1.11 -0.03 0.00 0.26 0.00 0.00 34.13 33.04 3h0r s GLU 248 CO 0.57 -0.16 0.03 0.08 -0.54 0.00 0.00 175.26 175.25 3h0r s VAL 249 N 1.29 4.45 0.27 3.70 1.01 -1.26 -5.09 120.40 124.77 3h0r s VAL 249 Ca -0.04 -0.15 -0.22 0.00 0.00 0.00 0.00 61.98 61.57 3h0r s VAL 249 Cb -0.14 -3.00 -0.09 0.00 0.00 0.00 0.00 36.38 33.15 3h0r s VAL 249 CO -0.02 0.45 0.80 -0.54 0.00 0.00 0.00 175.10 175.79 3h0r s LYS 250 N 0.56 4.35 -0.71 2.72 -0.14 -1.26 -4.24 119.74 121.01 3h0r s LYS 250 Ca 0.01 1.02 -0.01 0.00 -1.36 0.00 0.00 55.97 55.63 3h0r s LYS 250 Cb -0.13 -2.81 0.00 0.00 -1.68 0.00 0.00 37.83 33.21 3h0r s LYS 250 CO 0.02 0.33 0.18 0.41 -0.76 0.00 0.00 175.35 175.53 3h0r n GLY 251 N 0.57 0.10 3.78 -3.33 0.00 -1.26 -5.02 105.19 100.03 3h0r n GLY 251 Ca -0.00 -0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.26 3h0r n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h0r s LEU 252 N -3.01 3.59 -0.03 0.99 1.43 -1.26 -4.89 118.68 115.50 3h0r s LEU 252 Ca 0.09 2.00 0.06 0.00 -1.03 0.00 0.00 54.13 55.25 3h0r s LEU 252 Cb -0.04 -4.56 -0.01 0.00 0.03 0.00 0.00 46.19 41.61 3h0r s LEU 252 CO 0.11 -1.28 -0.22 -0.54 0.23 0.00 0.00 176.35 174.65 3h0r s LYS 253 N -3.72 1.87 -0.11 1.70 1.02 -1.26 -2.27 119.74 116.96 3h0r s LYS 253 Ca 0.68 -0.77 0.03 0.00 0.02 0.00 0.00 55.97 55.93 3h0r s LYS 253 Cb -0.20 -1.74 -0.00 0.00 -0.52 0.00 0.00 37.83 35.37 3h0r s LYS 253 CO 0.33 0.43 -0.21 0.42 -0.92 0.00 0.00 175.35 175.39 3h0r s ILE 254 N -0.39 2.27 -0.15 2.17 1.01 0.11 -1.25 121.20 124.97 3h0r s ILE 254 Ca 0.05 -0.94 -0.11 0.00 0.00 0.00 0.00 60.65 59.65 3h0r s ILE 254 Cb -0.09 -1.90 -0.05 0.00 0.01 0.00 0.00 42.46 40.43 3h0r s ILE 254 CO 0.00 0.55 0.22 -0.83 0.00 0.00 0.00 174.94 174.88 3h0r s GLY 255 N 0.44 2.17 -0.38 6.18 0.00 -0.09 -0.59 107.32 115.04 3h0r s GLY 255 Ca -0.15 -0.55 -0.06 0.00 0.00 0.00 0.00 44.72 43.96 3h0r s GLY 255 CO 0.06 0.14 0.17 1.08 0.00 0.00 0.00 173.10 174.56 3h0r s LEU 256 N -0.01 4.81 -0.07 0.66 1.43 0.85 -1.74 118.68 124.62 3h0r s LEU 256 Ca 0.14 -1.54 -0.31 0.00 -1.03 0.00 0.00 54.13 51.39 3h0r s LEU 256 Cb -0.12 -1.87 -0.09 0.00 0.03 0.00 0.00 46.19 44.13 3h0r s LEU 256 CO 0.03 -0.45 2.01 -2.65 0.23 0.00 0.00 176.35 175.52 3h0r n PRO 257 N 4.76 2.41 -0.06 1.29 -0.02 -1.26 -1.49 135.00 140.63 3h0r n PRO 257 Ca -0.09 0.84 0.13 0.00 -2.02 0.00 0.00 63.50 62.37 3h0r n PRO 257 Cb 0.43 -2.93 0.54 0.00 -0.02 0.00 0.00 33.50 31.52 3h0r n PRO 257 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3h0r h LYS 258 N 11.21 0.32 0.00 -0.52 1.57 -0.76 -0.74 116.57 127.65 3h0r h LYS 258 Ca -0.47 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.28 3h0r h LYS 258 Cb 1.25 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.49 3h0r h LYS 258 CO 0.95 0.21 -0.09 0.93 -0.57 0.00 0.00 179.45 180.88 3h0r h GLU 259 N 0.33 0.00 0.00 3.15 3.07 -1.88 -2.63 114.58 116.61 3h0r h GLU 259 Ca 0.27 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 3h0r h GLU 259 Cb 0.61 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.52 3h0r h GLU 259 CO -0.06 0.09 0.00 1.19 -1.40 0.00 0.00 179.01 178.82 3h0r n PHE 260 N -3.24 0.84 0.23 4.33 3.72 -0.28 -3.03 117.46 120.02 3h0r n PHE 260 Ca 0.00 0.26 0.09 0.00 -0.05 0.00 0.00 57.45 57.76 3h0r n PHE 260 Cb 0.34 -0.93 0.52 0.00 -0.94 0.00 0.00 39.48 38.47 3h0r n PHE 260 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 3h0r h PHE 261 N 0.00 0.00 0.00 1.38 0.04 -1.56 -2.19 116.94 114.61 3h0r h PHE 261 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3h0r h PHE 261 Cb 0.64 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.79 3h0r h PHE 261 CO 0.00 0.23 0.00 0.39 -0.60 0.00 0.00 178.31 178.33 3h0r n GLU 262 N -3.56 0.11 -2.79 1.51 -0.58 -1.17 -4.83 120.64 109.33 3h0r n GLU 262 Ca -0.01 0.02 -0.41 0.00 -0.42 0.00 0.00 57.16 56.34 3h0r n GLU 262 Cb 0.38 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.71 3h0r n GLU 262 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 3h0r s TYR 263 N -2.88 3.64 -0.26 -0.32 1.51 -0.83 -4.97 117.35 113.24 3h0r s TYR 263 Ca 0.17 1.59 -0.28 0.00 -1.01 0.00 0.00 57.07 57.54 3h0r s TYR 263 Cb 0.18 -3.04 -0.05 0.00 -0.11 0.00 0.00 41.96 38.94 3h0r s TYR 263 CO 0.48 0.02 2.20 -1.21 -1.11 0.00 0.00 175.55 175.93 3h0r s GLU 264 N 0.95 3.03 -0.00 -0.62 2.02 -1.26 -4.98 118.70 117.83 3h0r s GLU 264 Ca 0.48 1.89 0.02 0.00 0.02 0.00 0.00 54.97 57.39 3h0r s GLU 264 Cb -0.20 -4.38 -0.03 0.00 0.10 0.00 0.00 34.13 29.61 3h0r s GLU 264 CO 0.26 -2.22 -0.03 -0.51 0.02 0.00 0.00 175.26 172.77 3h0r s LEU 265 N 8.62 3.34 0.33 1.80 1.43 -1.26 -4.83 118.68 128.10 3h0r s LEU 265 Ca 0.98 -0.07 -0.29 0.00 -1.03 0.00 0.00 54.13 53.72 3h0r s LEU 265 Cb -0.30 -1.90 -0.10 0.00 0.03 0.00 0.00 46.19 43.91 3h0r s LEU 265 CO 0.34 0.29 1.33 -1.10 0.23 0.00 0.00 176.35 177.43 3h0r s GLN 266 N -1.46 4.33 0.26 1.70 -0.21 -0.13 -4.88 119.66 119.27 3h0r s GLN 266 Ca 0.18 2.25 -0.02 0.00 0.02 0.00 0.00 55.36 57.78 3h0r s GLN 266 Cb -0.11 -3.07 0.45 0.00 1.00 0.00 0.00 33.01 31.28 3h0r s GLN 266 CO 0.08 -0.23 1.81 -1.35 -2.12 0.00 0.00 175.29 173.49 3h0r h PRO 267 N 3.47 0.79 -0.87 2.91 0.11 -1.99 -0.37 132.00 136.05 3h0r h PRO 267 Ca -0.49 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 65.59 3h0r h PRO 267 Cb 1.23 -0.18 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 3h0r h PRO 267 CO 0.66 0.52 0.58 1.96 -0.21 0.00 0.00 178.00 181.51 3h0r h GLN 268 N 0.82 1.13 -0.15 1.05 7.50 -1.97 -0.25 115.11 123.24 3h0r h GLN 268 Ca 0.43 -0.07 -0.04 0.00 0.50 0.00 0.00 58.65 59.48 3h0r h GLN 268 Cb 0.44 -0.26 -0.00 0.00 0.05 0.00 0.00 27.48 27.71 3h0r h GLN 268 CO -0.27 0.75 -0.05 0.28 -1.50 0.00 0.00 178.83 178.04 3h0r h VAL 269 N 1.17 1.30 -0.23 -0.54 2.07 -1.47 -0.97 116.25 117.58 3h0r h VAL 269 Ca 0.32 -1.03 0.03 0.00 0.82 0.00 0.00 66.70 66.84 3h0r h VAL 269 Cb -0.11 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 3h0r h VAL 269 CO -0.08 0.30 0.05 0.50 0.02 0.00 0.00 177.57 178.36 3h0r h LYS 270 N -0.03 0.13 -0.17 1.57 3.64 -0.87 0.31 116.57 121.15 3h0r h LYS 270 Ca 0.04 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 3h0r h LYS 270 Cb 0.49 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.22 3h0r h LYS 270 CO 0.02 0.09 -0.19 1.49 -2.27 0.00 0.00 179.45 178.59 3h0r h GLU 271 N 0.14 -0.20 -0.57 1.90 4.81 -0.99 -0.56 114.58 119.10 3h0r h GLU 271 Ca 0.11 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.42 3h0r h GLU 271 Cb 0.10 0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.47 3h0r h GLU 271 CO -0.14 -0.14 0.25 0.00 -0.73 0.00 0.00 179.01 178.25 3h0r h ALA 272 N 0.85 0.74 -0.27 2.92 0.00 -0.73 -2.00 119.26 120.77 3h0r h ALA 272 Ca 0.11 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 3h0r h ALA 272 Cb 0.38 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3h0r h ALA 272 CO -0.30 -0.13 -0.16 0.35 0.00 0.00 0.00 179.25 179.01 3h0r h PHE 273 N 0.47 0.68 -0.74 0.00 3.57 -0.61 -1.84 116.94 118.46 3h0r h PHE 273 Ca 0.27 -0.18 0.06 0.00 3.53 0.00 0.00 57.97 61.66 3h0r h PHE 273 Cb 0.27 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 38.80 3h0r h PHE 273 CO -0.13 0.85 0.43 0.93 -2.23 0.00 0.00 178.31 178.16 3h0r h GLU 274 N 0.31 0.77 -0.47 1.11 5.08 -0.94 -1.30 114.58 119.14 3h0r h GLU 274 Ca 0.05 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 3h0r h GLU 274 Cb 0.69 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 3h0r h GLU 274 CO 0.05 0.51 0.22 -0.97 -1.00 0.00 0.00 179.01 177.81 3h0r h ASN 275 N 0.79 0.62 -0.53 1.42 -1.24 -1.29 0.05 115.58 115.40 3h0r h ASN 275 Ca 0.33 -0.14 0.10 0.00 0.71 0.00 0.00 56.30 57.30 3h0r h ASN 275 Cb 0.19 -0.16 -0.08 0.00 0.73 0.00 0.00 38.32 39.00 3h0r h ASN 275 CO -0.18 0.59 0.08 0.15 -1.29 0.00 0.00 177.43 176.78 3h0r h PHE 276 N 0.62 0.12 -0.24 0.67 3.57 -0.75 0.44 116.94 121.36 3h0r h PHE 276 Ca 0.16 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.57 3h0r h PHE 276 Cb 0.14 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.91 3h0r h PHE 276 CO -0.01 -0.04 -0.34 0.82 -2.23 0.00 0.00 178.31 176.51 3h0r h ILE 277 N 0.21 1.31 -0.64 1.41 1.08 -1.05 -1.50 117.51 118.34 3h0r h ILE 277 Ca 0.27 -1.54 0.03 0.00 -0.39 0.00 0.00 64.86 63.23 3h0r h ILE 277 Cb 0.39 1.73 -0.04 0.00 -3.07 0.00 0.00 36.82 35.83 3h0r h ILE 277 CO -0.37 0.48 0.40 0.11 -0.69 0.00 0.00 178.15 178.08 3h0r h LYS 278 N 0.37 0.76 -0.34 2.37 1.57 -0.72 0.26 116.57 120.84 3h0r h LYS 278 Ca 0.03 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 3h0r h LYS 278 Cb 0.93 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.05 3h0r h LYS 278 CO 0.08 0.50 -0.12 0.93 -0.57 0.00 0.00 179.45 180.27 3h0r h GLU 279 N 0.79 0.60 -0.45 3.15 3.07 -0.88 -1.17 114.58 119.69 3h0r h GLU 279 Ca 0.25 -0.18 -0.13 0.00 -0.50 0.00 0.00 59.36 58.80 3h0r h GLU 279 Cb 0.00 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.85 3h0r h GLU 279 CO -0.10 0.71 -0.24 -0.07 -1.40 0.00 0.00 179.01 177.91 3h0r h LEU 280 N 0.55 0.99 -0.47 1.33 3.38 -0.67 -2.84 115.31 117.58 3h0r h LEU 280 Ca 0.10 -0.41 0.04 0.00 0.09 0.00 0.00 57.88 57.70 3h0r h LEU 280 Cb 0.53 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 3h0r h LEU 280 CO 0.03 1.19 0.22 -0.08 0.09 0.00 0.00 178.44 179.89 3h0r h GLU 281 N 0.80 0.43 -0.17 1.13 4.81 -0.09 -2.17 114.58 119.32 3h0r h GLU 281 Ca 0.10 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.34 3h0r h GLU 281 Cb 0.82 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 3h0r h GLU 281 CO 0.07 0.28 0.12 0.87 -0.73 0.00 0.00 179.01 179.62 3h0r h LYS 282 N 0.44 0.04 -0.00 1.92 1.57 -1.09 0.45 116.57 119.90 3h0r h LYS 282 Ca 0.21 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3h0r h LYS 282 Cb 0.14 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.44 3h0r h LYS 282 CO -0.16 0.03 -0.04 0.39 -0.57 0.00 0.00 179.45 179.09 3h0r n GLU 283 N -4.50 0.88 0.00 3.15 -0.58 -0.84 -4.90 120.64 113.85 3h0r n GLU 283 Ca 0.01 -0.23 0.00 0.00 -0.42 0.00 0.00 57.16 56.52 3h0r n GLU 283 Cb 0.22 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.60 3h0r n GLU 283 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h0r n GLY 284 N 1.18 0.96 3.72 0.62 0.00 0.15 -5.09 105.19 106.74 3h0r n GLY 284 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3h0r n GLY 284 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h0r s PHE 285 N -2.00 3.44 -0.10 1.61 0.40 -1.05 -4.66 117.98 115.62 3h0r s PHE 285 Ca 0.00 1.36 -0.28 0.00 -0.60 0.00 0.00 56.93 57.41 3h0r s PHE 285 Cb 0.00 -3.42 -0.02 0.00 0.51 0.00 0.00 43.02 40.09 3h0r s PHE 285 CO 0.00 -1.23 0.91 -2.00 0.70 0.00 0.00 175.22 173.60 3h0r s GLU 286 N 0.47 4.41 -0.21 0.44 2.12 -0.96 -4.30 118.70 120.66 3h0r s GLU 286 Ca 0.56 1.22 -0.05 0.00 0.36 0.00 0.00 54.97 57.06 3h0r s GLU 286 Cb -0.31 -3.53 -0.02 0.00 0.26 0.00 0.00 34.13 30.53 3h0r s GLU 286 CO 0.32 -0.23 -0.00 0.42 -0.54 0.00 0.00 175.26 175.24 3h0r s ILE 287 N 1.73 3.86 -0.01 -3.70 -1.09 -1.26 -0.72 121.20 120.02 3h0r s ILE 287 Ca 0.44 -0.34 0.05 0.00 -2.23 0.00 0.00 60.65 58.58 3h0r s ILE 287 Cb -0.18 -2.76 -0.01 0.00 -1.58 0.00 0.00 42.46 37.93 3h0r s ILE 287 CO 0.18 0.42 -0.16 -0.54 -1.23 0.00 0.00 174.94 173.60 3h0r s LYS 288 N 1.18 1.29 0.05 2.79 1.02 0.24 -4.99 119.74 121.33 3h0r s LYS 288 Ca 0.03 -0.61 -0.30 0.00 0.02 0.00 0.00 55.97 55.11 3h0r s LYS 288 Cb -0.14 -1.26 -0.05 0.00 -0.52 0.00 0.00 37.83 35.86 3h0r s LYS 288 CO 0.01 0.34 1.04 -1.21 -0.92 0.00 0.00 175.35 174.62 3h0r s GLU 289 N -0.46 4.56 0.35 1.68 2.02 -1.26 -0.11 118.70 125.48 3h0r s GLU 289 Ca 0.06 1.54 0.09 0.00 0.02 0.00 0.00 54.97 56.68 3h0r s GLU 289 Cb -0.06 -3.40 -0.07 0.00 0.10 0.00 0.00 34.13 30.70 3h0r s GLU 289 CO -0.00 -0.04 -0.07 0.14 0.02 0.00 0.00 175.26 175.30 3h0r s VAL 290 N 0.70 2.13 -0.09 2.63 -7.23 -0.56 -4.81 120.40 113.18 3h0r s VAL 290 Ca 0.52 -2.16 -0.01 0.00 -1.81 0.00 0.00 61.98 58.52 3h0r s VAL 290 Cb -0.24 -2.69 -0.03 0.00 0.56 0.00 0.00 36.38 33.98 3h0r s VAL 290 CO 0.29 -0.17 -0.03 -0.44 -0.31 0.00 0.00 175.10 174.44 3h0r s SER 291 N -3.61 4.94 -0.45 4.85 0.01 -1.26 0.04 113.70 118.23 3h0r s SER 291 Ca 0.33 0.04 0.04 0.00 1.31 0.00 0.00 55.95 57.68 3h0r s SER 291 Cb 0.04 -1.38 0.18 0.00 0.21 0.00 0.00 66.02 65.06 3h0r s SER 291 CO 0.16 0.35 0.38 0.18 0.41 0.00 0.00 173.24 174.72 3h0r n LEU 292 N 2.34 0.07 0.28 2.44 4.77 -1.26 -4.72 117.00 120.91 3h0r n LEU 292 Ca -0.18 -4.52 0.18 0.00 -0.03 0.00 0.00 56.01 51.46 3h0r n LEU 292 Cb 0.53 0.37 0.92 0.00 -2.33 0.00 0.00 43.42 42.91 3h0r n LEU 292 CO 0.28 1.86 1.15 1.55 -1.33 0.00 0.00 177.39 180.91 3h0r h PRO 293 N 5.47 0.00 -0.01 3.23 0.13 -1.96 -2.21 132.00 136.66 3h0r h PRO 293 Ca 0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.37 3h0r h PRO 293 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 3h0r h PRO 293 CO 0.43 0.00 -0.64 0.72 -0.23 0.00 0.00 178.00 178.28 3h0r n HIS 294 N -3.28 0.00 -0.13 1.56 8.25 -1.26 -4.66 115.22 115.70 3h0r n HIS 294 Ca -0.00 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.57 3h0r n HIS 294 Cb 0.31 0.00 0.46 0.00 1.12 0.00 0.00 29.99 31.87 3h0r n HIS 294 CO 0.00 0.00 0.00 -0.39 0.64 0.00 0.00 176.34 176.59 3h0r h VAL 295 N 0.89 0.91 -0.04 1.59 -1.51 -1.77 0.03 116.25 116.36 3h0r h VAL 295 Ca 0.00 -0.18 0.01 0.00 -1.23 0.00 0.00 66.70 65.31 3h0r h VAL 295 Cb 0.51 0.36 -0.00 0.00 -2.13 0.00 0.00 31.29 30.02 3h0r h VAL 295 CO 0.00 0.09 0.19 0.07 -1.23 0.00 0.00 177.57 176.69 3h0r h LYS 296 N 0.51 0.00 -0.00 5.19 2.10 -1.83 0.29 116.57 122.83 3h0r h LYS 296 Ca 0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.96 3h0r h LYS 296 Cb 0.52 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.85 3h0r h LYS 296 CO -0.10 0.00 -0.06 0.66 -2.00 0.00 0.00 179.45 177.96 3h0r n TYR 297 N -3.16 0.00 -0.19 0.07 4.01 -0.00 -4.28 117.16 113.61 3h0r n TYR 297 Ca -0.01 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.70 3h0r n TYR 297 Cb 0.26 -0.18 0.08 0.00 -0.31 0.00 0.00 39.34 39.19 3h0r n TYR 297 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 3h0r h SER 298 N 0.39 0.38 0.01 7.72 0.02 -0.54 -2.23 113.55 119.31 3h0r h SER 298 Ca 0.00 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3h0r h SER 298 Cb 0.29 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.80 3h0r h SER 298 CO 0.00 0.25 -0.01 0.40 -1.14 0.00 0.00 176.83 176.33 3h0r h ILE 299 N 0.52 1.10 0.00 3.27 1.08 -1.79 0.51 117.51 122.20 3h0r h ILE 299 Ca 0.26 -0.35 -0.12 0.00 -0.39 0.00 0.00 64.86 64.27 3h0r h ILE 299 Cb 0.21 1.33 -0.02 0.00 -3.07 0.00 0.00 36.82 35.27 3h0r h ILE 299 CO -0.20 0.09 -0.56 -0.65 -0.69 0.00 0.00 178.15 176.14 3h0r h PRO 300 N -0.17 0.00 0.35 2.37 0.11 -1.83 -0.95 132.00 131.87 3h0r h PRO 300 Ca -0.00 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 3h0r h PRO 300 Cb 0.16 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 3h0r h PRO 300 CO 0.00 0.56 -0.23 1.15 -0.21 0.00 0.00 178.00 179.27 3h0r h THR 301 N 0.00 0.51 -0.97 -1.15 2.02 -1.30 -2.71 112.91 109.31 3h0r h THR 301 Ca -0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.20 3h0r h THR 301 Cb 1.02 0.51 -0.05 0.00 -1.74 0.00 0.00 68.15 67.89 3h0r h THR 301 CO 0.07 0.00 0.64 0.22 0.37 0.00 0.00 175.52 176.82 3h0r h TYR 302 N -0.56 1.20 -0.27 3.16 3.20 -0.70 -1.53 116.97 121.46 3h0r h TYR 302 Ca -0.03 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3h0r h TYR 302 Cb 0.48 -0.40 0.00 0.00 1.54 0.00 0.00 36.73 38.35 3h0r h TYR 302 CO -0.11 0.71 0.00 0.66 -1.64 0.00 0.00 178.16 177.79 3h0r n TYR 303 N -4.42 0.71 -0.06 -3.82 4.01 -0.38 -0.52 117.16 112.67 3h0r n TYR 303 Ca 0.12 -0.27 -0.13 0.00 -0.16 0.00 0.00 57.90 57.46 3h0r n TYR 303 Cb 0.07 -0.17 -0.04 0.00 -0.31 0.00 0.00 39.34 38.88 3h0r n TYR 303 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 3h0r n ILE 304 N 0.33 0.80 0.09 -0.72 5.41 -0.93 -4.65 119.36 119.69 3h0r n ILE 304 Ca 0.11 -0.14 -0.13 0.00 1.00 0.00 0.00 62.75 63.59 3h0r n ILE 304 Cb 0.50 -1.71 -0.08 0.00 -0.71 0.00 0.00 39.64 37.64 3h0r n ILE 304 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3h0r h ILE 305 N -0.48 0.95 0.57 1.39 2.04 -1.13 -2.45 117.51 118.40 3h0r h ILE 305 Ca -0.31 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 3h0r h ILE 305 Cb 1.22 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.46 3h0r h ILE 305 CO -0.19 0.08 -0.29 0.00 0.00 0.00 0.00 178.15 177.75 3h0r h ALA 306 N 0.53 -0.79 -0.48 1.87 0.00 -1.06 -1.55 119.26 117.78 3h0r h ALA 306 Ca -0.02 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.80 3h0r h ALA 306 Cb 0.26 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3h0r h ALA 306 CO 0.03 -0.95 0.32 -1.35 0.00 0.00 0.00 179.25 177.30 3h0r h PRO 307 N -0.79 0.30 0.25 0.00 0.11 -1.76 0.19 132.00 130.31 3h0r h PRO 307 Ca -0.07 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 3h0r h PRO 307 Cb 0.62 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.66 3h0r h PRO 307 CO 0.11 0.20 -0.12 0.77 -0.21 0.00 0.00 178.00 178.75 3h0r h SER 308 N 0.31 -0.29 -0.15 -2.05 0.02 -1.03 -0.67 113.55 109.70 3h0r h SER 308 Ca 0.22 -0.16 -0.07 0.00 -0.84 0.00 0.00 61.79 60.93 3h0r h SER 308 Cb 0.45 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 3h0r h SER 308 CO -0.05 0.01 -0.13 -0.33 -1.14 0.00 0.00 176.83 175.19 3h0r h GLU 309 N -0.59 0.51 -0.28 3.45 5.08 -1.08 -2.62 114.58 119.04 3h0r h GLU 309 Ca -0.03 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.20 3h0r h GLU 309 Cb 0.43 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 3h0r h GLU 309 CO 0.06 0.63 0.11 0.00 -1.00 0.00 0.00 179.01 178.81 3h0r h ALA 310 N 1.40 0.32 -0.93 3.43 0.00 -0.36 0.49 119.26 123.60 3h0r h ALA 310 Ca 0.09 0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.13 3h0r h ALA 310 Cb 0.50 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 3h0r h ALA 310 CO 0.03 -0.29 0.60 0.66 0.00 0.00 0.00 179.25 180.24 3h0r h SER 311 N 0.24 0.83 -0.04 0.00 4.64 -0.74 -0.25 113.55 118.23 3h0r h SER 311 Ca 0.12 0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.34 3h0r h SER 311 Cb 0.08 -0.14 0.01 0.00 -0.31 0.00 0.00 62.40 62.03 3h0r h SER 311 CO -0.11 0.47 -0.48 -1.28 -0.87 0.00 0.00 176.83 174.56 3h0r h SER 312 N 0.91 0.49 0.94 4.97 0.87 -1.32 -2.94 113.55 117.47 3h0r h SER 312 Ca 0.44 -0.71 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 3h0r h SER 312 Cb 0.46 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 3h0r h SER 312 CO -0.21 1.13 0.00 0.78 -0.53 0.00 0.00 176.83 178.00 3h0r h ASN 313 N -0.11 0.00 -0.03 6.23 2.35 -0.40 -2.75 115.58 120.87 3h0r h ASN 313 Ca -0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3h0r h ASN 313 Cb 1.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.54 3h0r h ASN 313 CO 0.10 0.00 -0.08 0.18 -1.65 0.00 0.00 177.43 175.97 3h0r n LEU 314 N -2.67 2.83 0.31 1.61 4.32 -0.15 -4.31 117.00 118.94 3h0r n LEU 314 Ca 0.02 -0.96 0.19 0.00 -0.02 0.00 0.00 56.01 55.24 3h0r n LEU 314 Cb 0.28 0.00 1.01 0.00 -1.62 0.00 0.00 43.42 43.09 3h0r n LEU 314 CO 0.24 0.48 1.11 0.00 -1.22 0.00 0.00 177.39 178.00 3h0r h ALA 315 N 4.56 1.16 0.00 -1.18 0.00 -1.30 -3.03 119.26 119.47 3h0r h ALA 315 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h0r h ALA 315 Cb 0.96 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3h0r h ALA 315 CO 0.00 0.03 0.00 0.07 0.00 0.00 0.00 179.25 179.35 3h0r h ARG 316 N 0.00 0.00 -5.84 0.00 0.11 -1.79 -3.41 114.38 103.44 3h0r h ARG 316 Ca -0.00 0.00 -0.60 0.00 0.10 0.00 0.00 59.98 59.48 3h0r h ARG 316 Cb 0.13 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 31.09 3h0r h ARG 316 CO 0.00 0.00 0.69 0.71 0.10 0.00 0.00 179.97 181.47 3h0r s TYR 317 N -3.25 2.62 0.00 4.08 2.02 -1.15 -4.74 117.35 116.93 3h0r s TYR 317 Ca 0.07 -0.22 0.00 0.00 -0.37 0.00 0.00 57.07 56.55 3h0r s TYR 317 Cb 0.08 -4.32 0.00 0.00 -0.40 0.00 0.00 41.96 37.33 3h0r s TYR 317 CO 0.60 -1.65 0.08 -0.40 -1.57 0.00 0.00 175.55 172.61 3h0r n ASP 318 N 8.05 0.00 -0.03 2.29 5.75 -1.26 -4.81 116.55 126.55 3h0r n ASP 318 Ca 0.00 -1.00 -0.00 0.00 -0.01 0.00 0.00 54.79 53.78 3h0r n ASP 318 Cb 0.47 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.56 3h0r n ASP 318 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h0r n GLY 319 N 0.00 0.41 0.10 6.12 0.00 -1.25 -4.60 105.19 105.98 3h0r n GLY 319 Ca 0.00 -0.06 -0.18 0.00 0.00 0.00 0.00 46.02 45.78 3h0r n GLY 319 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3h0r n VAL 320 N -2.77 1.50 0.45 1.61 0.31 -1.26 -4.76 118.33 113.41 3h0r n VAL 320 Ca -0.00 -0.03 0.08 0.00 -0.01 0.00 0.00 64.34 64.38 3h0r n VAL 320 Cb 0.12 -2.13 -0.11 0.00 -0.91 0.00 0.00 33.84 30.81 3h0r n VAL 320 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3h0r n ARG 321 N -4.44 1.07 -3.64 5.55 1.74 -1.26 -5.04 116.66 110.64 3h0r n ARG 321 Ca -0.29 -0.07 -0.01 0.00 -0.77 0.00 0.00 57.85 56.71 3h0r n ARG 321 Cb 0.61 -1.34 -0.01 0.00 -1.02 0.00 0.00 32.46 30.70 3h0r n ARG 321 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 3h0r s TYR 322 N -2.84 -0.09 0.00 -1.55 1.13 -1.26 -5.17 117.35 107.57 3h0r s TYR 322 Ca 0.01 -0.05 0.00 0.00 -1.41 0.00 0.00 57.07 55.62 3h0r s TYR 322 Cb 0.12 0.56 0.00 0.00 -1.10 0.00 0.00 41.96 41.54 3h0r s TYR 322 CO 0.70 -0.40 0.00 0.41 -2.51 0.00 0.00 175.55 173.75 3h0r n GLY 323 N -0.41 -0.15 3.76 5.49 0.00 -1.26 -4.28 105.19 108.34 3h0r n GLY 323 Ca -0.07 -1.04 -0.38 0.00 0.00 0.00 0.00 46.02 44.53 3h0r n GLY 323 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3h0r s TYR 324 N 0.00 2.56 -0.03 1.61 5.04 -0.16 -4.89 117.35 121.48 3h0r s TYR 324 Ca 0.00 1.41 -0.01 0.00 -2.44 0.00 0.00 57.07 56.03 3h0r s TYR 324 Cb 0.00 -3.69 0.03 0.00 0.35 0.00 0.00 41.96 38.65 3h0r s TYR 324 CO 0.00 -2.40 0.05 0.50 -1.34 0.00 0.00 175.55 172.36 3h0r s ARG 325 N -2.65 -0.05 0.42 4.97 3.52 -1.26 -3.81 118.95 120.09 3h0r s ARG 325 Ca 0.65 0.28 -0.23 0.00 -0.13 0.00 0.00 55.73 56.29 3h0r s ARG 325 Cb -0.38 -0.35 -0.11 0.00 -1.56 0.00 0.00 34.95 32.55 3h0r s ARG 325 CO 0.46 -0.23 0.78 0.00 -0.81 0.00 0.00 175.30 175.50 3h0r n ALA 326 N 4.64 -0.66 -0.01 6.12 0.00 -1.26 -4.94 120.51 124.39 3h0r n ALA 326 Ca -0.18 0.19 -0.17 0.00 0.00 0.00 0.00 53.44 53.28 3h0r n ALA 326 Cb 0.50 -1.93 -0.09 0.00 0.00 0.00 0.00 19.45 17.93 3h0r n ALA 326 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3h0r h LYS 327 N 1.13 0.53 -5.29 0.00 1.57 -1.98 -3.45 116.57 109.08 3h0r h LYS 327 Ca -0.42 -0.48 -0.64 0.00 -1.87 0.00 0.00 60.65 57.23 3h0r h LYS 327 Cb 1.37 0.12 -0.23 0.00 0.08 0.00 0.00 32.23 33.56 3h0r h LYS 327 CO 0.54 1.12 -0.70 -1.21 -0.57 0.00 0.00 179.45 178.63 3h0r s GLU 328 N -3.51 3.58 -0.25 3.15 2.02 -1.26 -5.10 118.70 117.34 3h0r s GLU 328 Ca -0.12 -0.57 -0.26 0.00 0.02 0.00 0.00 54.97 54.04 3h0r s GLU 328 Cb 0.05 -2.84 0.10 0.00 0.10 0.00 0.00 34.13 31.54 3h0r s GLU 328 CO 0.84 0.21 0.87 1.52 0.02 0.00 0.00 175.26 178.73 3h0r s TYR 329 N 0.41 -0.61 -0.28 1.61 1.13 -1.26 -4.84 117.35 113.51 3h0r s TYR 329 Ca -0.06 1.43 0.22 0.00 -1.41 0.00 0.00 57.07 57.26 3h0r s TYR 329 Cb -0.15 0.34 -0.16 0.00 -1.10 0.00 0.00 41.96 40.89 3h0r s TYR 329 CO 0.04 -0.33 0.77 0.36 -2.51 0.00 0.00 175.55 173.87 3h0r n LYS 330 N 2.18 0.52 -1.23 -3.49 2.85 -1.26 -4.94 118.16 112.79 3h0r n LYS 330 Ca -0.13 -0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.06 3h0r n LYS 330 Cb 0.56 -1.61 0.00 0.00 -0.65 0.00 0.00 35.03 33.33 3h0r n LYS 330 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 3h0r n ASP 331 N -2.24 0.00 0.07 -5.58 5.68 -1.26 -5.04 116.55 108.18 3h0r n ASP 331 Ca -0.01 -0.91 -0.07 0.00 -0.50 0.00 0.00 54.79 53.30 3h0r n ASP 331 Cb 0.52 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.42 3h0r n ASP 331 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3h0r h ILE 332 N 0.91 1.66 0.21 2.12 6.09 -1.98 -1.85 117.51 124.66 3h0r h ILE 332 Ca 0.00 -3.21 -0.01 0.00 -1.37 0.00 0.00 64.86 60.27 3h0r h ILE 332 Cb 0.00 2.75 0.00 0.00 0.47 0.00 0.00 36.82 40.05 3h0r h ILE 332 CO 0.00 0.92 -0.10 0.15 -3.07 0.00 0.00 178.15 176.05 3h0r h PHE 333 N 0.01 -0.26 -0.78 2.19 3.57 -1.99 -0.75 116.94 118.94 3h0r h PHE 333 Ca -0.02 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 3h0r h PHE 333 Cb 1.69 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 40.48 3h0r h PHE 333 CO 0.01 -0.14 0.38 0.93 -2.23 0.00 0.00 178.31 177.26 3h0r h GLU 334 N -0.31 1.11 -0.11 1.11 5.08 -1.96 0.67 114.58 120.16 3h0r h GLU 334 Ca -0.03 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.21 3h0r h GLU 334 Cb 0.24 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3h0r h GLU 334 CO 0.05 0.85 -0.09 1.98 -1.00 0.00 0.00 179.01 180.80 3h0r h MET 335 N 1.10 -0.10 0.85 2.33 4.05 -1.13 0.71 114.93 122.73 3h0r h MET 335 Ca 0.27 0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.66 3h0r h MET 335 Cb 0.11 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 30.93 3h0r h MET 335 CO -0.03 -0.07 -0.49 1.88 0.23 0.00 0.00 176.91 178.42 3h0r h TYR 336 N -0.11 -1.31 0.00 1.39 0.05 -0.71 -1.77 116.97 114.52 3h0r h TYR 336 Ca 0.07 -0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.75 3h0r h TYR 336 Cb 0.21 0.46 -0.01 0.00 1.01 0.00 0.00 36.73 38.40 3h0r h TYR 336 CO -0.21 -0.75 -0.39 0.00 -1.05 0.00 0.00 178.16 175.76 3h0r h ALA 337 N -1.19 1.19 0.21 3.88 0.00 -0.72 -2.29 119.26 120.34 3h0r h ALA 337 Ca -0.11 -0.36 -0.29 0.00 0.00 0.00 0.00 54.91 54.14 3h0r h ALA 337 Cb 0.99 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.74 3h0r h ALA 337 CO 0.13 0.49 -1.33 0.00 0.00 0.00 0.00 179.25 178.54 3h0r h ARG 338 N 0.00 0.44 -0.69 0.00 3.08 -0.94 -2.45 114.38 113.82 3h0r h ARG 338 Ca -0.00 -0.76 0.13 0.00 0.07 0.00 0.00 59.98 59.42 3h0r h ARG 338 Cb 0.77 0.28 -0.09 0.00 0.08 0.00 0.00 29.97 31.01 3h0r h ARG 338 CO 0.05 1.36 0.22 1.15 -1.07 0.00 0.00 179.97 181.68 3h0r h THR 339 N -0.03 0.64 -0.02 2.04 2.02 -1.12 -1.07 112.91 115.37 3h0r h THR 339 Ca -0.24 -0.12 -0.06 0.00 0.77 0.00 0.00 66.41 66.76 3h0r h THR 339 Cb 2.00 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 3h0r h THR 339 CO 0.22 0.06 -0.21 0.03 0.37 0.00 0.00 175.52 175.99 3h0r h ARG 340 N 0.35 0.18 -0.94 6.66 3.08 -1.52 0.14 114.38 122.35 3h0r h ARG 340 Ca 0.37 -0.17 0.03 0.00 0.07 0.00 0.00 59.98 60.29 3h0r h ARG 340 Cb 0.57 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.61 3h0r h ARG 340 CO -0.41 0.86 0.61 0.22 -1.07 0.00 0.00 179.97 180.17 3h0r h ASP 341 N -0.43 1.03 0.89 7.04 3.58 -1.36 0.39 116.42 127.55 3h0r h ASP 341 Ca -0.02 -0.01 -0.21 0.00 0.42 0.00 0.00 57.03 57.21 3h0r h ASP 341 Cb 0.91 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.70 3h0r h ASP 341 CO 0.04 0.71 -0.99 -0.33 -2.88 0.00 0.00 179.24 175.80 3h0r h GLU 342 N 1.20 0.05 0.00 0.28 5.08 -1.23 -3.36 114.58 116.60 3h0r h GLU 342 Ca 0.37 -0.07 -0.23 0.00 -1.00 0.00 0.00 59.36 58.43 3h0r h GLU 342 Cb -0.03 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 3h0r h GLU 342 CO -0.11 0.99 -1.45 0.78 -1.00 0.00 0.00 179.01 178.22 3h0r h GLY 343 N 2.63 0.00 -5.00 -3.84 0.00 -0.34 -3.47 103.07 93.05 3h0r h GLY 343 Ca -0.03 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.70 3h0r h GLY 343 CO 0.13 0.00 -0.18 -1.36 0.00 0.00 0.00 176.54 175.14 3h0r s PHE 344 N -2.75 3.72 1.02 5.60 0.08 0.10 -2.10 117.98 123.65 3h0r s PHE 344 Ca -0.03 1.02 -0.16 0.00 0.12 0.00 0.00 56.93 57.88 3h0r s PHE 344 Cb 0.08 -2.33 0.20 0.00 -0.57 0.00 0.00 43.02 40.41 3h0r s PHE 344 CO 0.81 0.60 1.18 0.20 -0.10 0.00 0.00 175.22 177.92 3h0r s GLY 345 N -0.96 1.64 0.11 4.36 0.00 -1.26 -4.81 107.32 106.40 3h0r s GLY 345 Ca 0.24 -0.86 -0.19 0.00 0.00 0.00 0.00 44.72 43.92 3h0r s GLY 345 CO 0.14 -0.13 1.69 -2.55 0.00 0.00 0.00 173.10 172.25 3h0r h PRO 346 N -1.90 0.36 -0.40 2.90 0.11 -1.96 -1.08 132.00 130.02 3h0r h PRO 346 Ca -0.47 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.44 3h0r h PRO 346 Cb 1.29 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3h0r h PRO 346 CO 0.46 0.34 -0.35 1.49 -0.21 0.00 0.00 178.00 179.73 3h0r h GLU 347 N 0.28 0.94 0.01 1.05 4.57 -1.94 -1.29 114.58 118.20 3h0r h GLU 347 Ca 0.09 -0.48 -0.00 0.00 -1.18 0.00 0.00 59.36 57.79 3h0r h GLU 347 Cb 0.10 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.69 3h0r h GLU 347 CO -0.01 1.14 -0.01 0.28 -1.18 0.00 0.00 179.01 179.23 3h0r h VAL 348 N 0.78 0.99 -0.87 0.32 2.07 -1.85 -1.78 116.25 115.90 3h0r h VAL 348 Ca 0.07 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.67 3h0r h VAL 348 Cb 0.94 0.99 -0.07 0.00 -1.52 0.00 0.00 31.29 31.63 3h0r h VAL 348 CO 0.09 0.00 0.53 0.11 0.02 0.00 0.00 177.57 178.32 3h0r h LYS 349 N -0.02 0.92 -0.77 1.57 1.57 -1.04 -0.19 116.57 118.61 3h0r h LYS 349 Ca -0.00 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3h0r h LYS 349 Cb 0.01 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 32.08 3h0r h LYS 349 CO 0.00 0.61 0.50 0.00 -0.57 0.00 0.00 179.45 179.99 3h0r h ARG 350 N 0.94 0.99 -0.03 3.15 3.08 -0.88 -1.72 114.38 119.91 3h0r h ARG 350 Ca 0.39 -0.06 -0.21 0.00 0.07 0.00 0.00 59.98 60.18 3h0r h ARG 350 Cb 0.24 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 3h0r h ARG 350 CO -0.20 0.65 -0.86 0.00 -1.07 0.00 0.00 179.97 178.50 3h0r h ARG 351 N 1.01 0.38 -0.31 0.04 3.08 -0.70 -1.63 114.38 116.25 3h0r h ARG 351 Ca 0.29 -0.37 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 3h0r h ARG 351 Cb -0.08 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3h0r h ARG 351 CO -0.08 1.04 0.12 0.82 -1.07 0.00 0.00 179.97 180.80 3h0r h ILE 352 N 0.23 1.18 0.37 2.04 2.04 -0.94 0.97 117.51 123.42 3h0r h ILE 352 Ca -0.06 -0.57 -0.00 0.00 1.00 0.00 0.00 64.86 65.23 3h0r h ILE 352 Cb 1.47 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 38.51 3h0r h ILE 352 CO 0.15 0.20 -0.48 0.24 0.00 0.00 0.00 178.15 178.26 3h0r h MET 353 N 0.35 -0.85 -0.49 2.37 2.86 -1.26 -0.73 114.93 117.17 3h0r h MET 353 Ca 0.10 0.06 0.07 0.00 -2.06 0.00 0.00 59.70 57.87 3h0r h MET 353 Cb 0.19 0.19 -0.06 0.00 0.06 0.00 0.00 31.60 31.99 3h0r h MET 353 CO -0.01 -0.57 0.14 1.25 1.06 0.00 0.00 176.91 178.79 3h0r h LEU 354 N -0.89 0.11 -0.62 1.22 5.85 -1.28 -2.30 115.31 117.40 3h0r h LEU 354 Ca -0.04 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.79 3h0r h LEU 354 Cb 0.81 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 3h0r h LEU 354 CO -0.12 0.09 0.37 1.23 -0.34 0.00 0.00 178.44 179.67 3h0r h GLY 355 N 0.30 0.90 1.78 3.75 0.00 -0.61 -0.29 103.07 108.91 3h0r h GLY 355 Ca 0.24 -0.28 -0.07 0.00 0.00 0.00 0.00 47.33 47.22 3h0r h GLY 355 CO -0.27 0.22 -0.22 0.00 0.00 0.00 0.00 176.54 176.27 3h0r h THR 356 N 0.73 1.23 0.21 4.70 1.03 -0.76 -2.08 112.91 117.96 3h0r h THR 356 Ca 0.26 -1.05 -0.01 0.00 -0.01 0.00 0.00 66.41 65.60 3h0r h THR 356 Cb 0.06 1.36 0.00 0.00 -1.07 0.00 0.00 68.15 68.50 3h0r h THR 356 CO -0.12 0.32 -0.10 0.15 -0.01 0.00 0.00 175.52 175.76 3h0r h PHE 357 N 0.24 -0.26 -0.23 0.00 3.04 -1.10 -2.33 116.94 116.30 3h0r h PHE 357 Ca 0.04 -0.01 0.07 0.00 3.98 0.00 0.00 57.97 62.05 3h0r h PHE 357 Cb 0.53 0.09 -0.01 0.00 2.56 0.00 0.00 35.95 39.12 3h0r h PHE 357 CO 0.01 0.11 0.28 0.00 -2.02 0.00 0.00 178.31 176.69 3h0r h ALA 358 N -0.05 1.85 -0.00 2.41 0.00 -0.90 -0.67 119.26 121.90 3h0r h ALA 358 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3h0r h ALA 358 Cb 0.49 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3h0r h ALA 358 CO 0.05 -0.40 -0.80 1.28 0.00 0.00 0.00 179.25 179.38 3h0r n LEU 359 N -3.70 1.20 -4.77 0.00 4.77 -0.80 -3.65 117.00 110.04 3h0r n LEU 359 Ca 0.03 -0.50 -0.40 0.00 -0.03 0.00 0.00 56.01 55.10 3h0r n LEU 359 Cb 0.41 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.45 3h0r n LEU 359 CO 0.26 0.27 0.96 -0.94 -1.33 0.00 0.00 177.39 176.61 3h0r s SER 360 N -2.86 6.65 0.33 -1.43 1.04 -0.26 -4.63 113.70 112.54 3h0r s SER 360 Ca 0.11 2.65 -0.29 0.00 0.48 0.00 0.00 55.95 58.91 3h0r s SER 360 Cb 0.17 -2.64 -0.12 0.00 0.10 0.00 0.00 66.02 63.52 3h0r s SER 360 CO 0.77 -0.61 1.42 0.00 0.98 0.00 0.00 173.24 175.79 3h0r n ALA 361 N 0.59 1.80 0.00 5.32 0.00 -1.26 -0.92 120.51 126.05 3h0r n ALA 361 Ca 0.01 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.82 3h0r n ALA 361 Cb 0.43 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.53 3h0r n ALA 361 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0r n GLY 362 N 1.13 3.12 0.00 0.00 0.00 -1.26 -4.72 105.19 103.46 3h0r n GLY 362 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3h0r n GLY 362 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3h0r n TYR 363 N -2.00 0.00 -0.02 1.61 4.01 -0.44 -4.83 117.16 115.49 3h0r n TYR 363 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 3h0r n TYR 363 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 3h0r n TYR 363 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 3h0r h TYR 364 N 0.00 0.12 -0.79 -0.72 5.03 -1.14 -2.19 116.97 117.29 3h0r h TYR 364 Ca 0.00 0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.34 3h0r h TYR 364 Cb 0.00 -0.03 -0.04 0.00 1.55 0.00 0.00 36.73 38.21 3h0r h TYR 364 CO 0.00 0.07 0.51 -0.44 -1.32 0.00 0.00 178.16 176.98 3h0r h ASP 365 N 0.15 0.86 1.76 -2.11 5.19 -1.87 -1.82 116.42 118.57 3h0r h ASP 365 Ca 0.06 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 3h0r h ASP 365 Cb 0.02 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.33 3h0r h ASP 365 CO -0.05 0.60 0.00 0.00 -3.12 0.00 0.00 179.24 176.68 3h0r h ALA 366 N 1.32 1.00 -3.00 3.45 0.00 -1.87 -2.69 119.26 117.47 3h0r h ALA 366 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3h0r h ALA 366 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3h0r h ALA 366 CO -0.09 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.82 3h0r n TYR 367 N -2.86 0.00 0.03 0.00 4.02 -0.83 -4.54 117.16 112.97 3h0r n TYR 367 Ca 0.04 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.83 3h0r n TYR 367 Cb 0.48 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.76 3h0r n TYR 367 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 3h0r h TYR 368 N 0.00 -0.41 -0.10 -0.72 3.20 -1.50 0.21 116.97 117.64 3h0r h TYR 368 Ca 0.00 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.91 3h0r h TYR 368 Cb 0.00 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 3h0r h TYR 368 CO 0.00 -0.23 -0.05 1.25 -1.64 0.00 0.00 178.16 177.48 3h0r h LEU 369 N -0.23 -0.18 -0.46 2.82 5.85 -1.54 -0.85 115.31 120.72 3h0r h LEU 369 Ca 0.07 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.88 3h0r h LEU 369 Cb 0.33 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 3h0r h LEU 369 CO -0.20 -0.07 0.21 0.50 -0.34 0.00 0.00 178.44 178.53 3h0r h LYS 370 N -0.05 0.40 -0.79 1.25 1.63 -1.11 -1.65 116.57 116.25 3h0r h LYS 370 Ca 0.06 -0.02 0.01 0.00 -0.85 0.00 0.00 60.65 59.84 3h0r h LYS 370 Cb 0.14 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.64 3h0r h LYS 370 CO -0.13 0.26 0.52 0.00 -3.45 0.00 0.00 179.45 176.65 3h0r h ALA 371 N 1.27 1.44 0.00 5.00 0.00 -0.24 -1.03 119.26 125.70 3h0r h ALA 371 Ca 0.21 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 3h0r h ALA 371 Cb 0.16 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3h0r h ALA 371 CO -0.17 0.52 -0.30 1.96 0.00 0.00 0.00 179.25 181.25 3h0r h GLN 372 N 1.06 0.00 0.05 0.00 1.08 -0.27 -0.68 115.11 116.35 3h0r h GLN 372 Ca 0.29 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.33 3h0r h GLN 372 Cb -0.12 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.32 3h0r h GLN 372 CO -0.06 0.30 -0.65 0.87 -0.95 0.00 0.00 178.83 178.34 3h0r h LYS 373 N 0.00 0.36 -0.08 1.46 1.57 -0.54 -3.10 116.57 116.24 3h0r h LYS 373 Ca -0.00 -0.45 0.01 0.00 -1.87 0.00 0.00 60.65 58.34 3h0r h LYS 373 Cb 0.80 0.14 -0.00 0.00 0.08 0.00 0.00 32.23 33.25 3h0r h LYS 373 CO 0.04 1.14 0.06 0.28 -0.57 0.00 0.00 179.45 180.40 3h0r h VAL 374 N -0.22 0.98 -0.16 0.50 2.07 -1.04 -0.85 116.25 117.53 3h0r h VAL 374 Ca -0.09 -0.02 -0.12 0.00 0.82 0.00 0.00 66.70 67.29 3h0r h VAL 374 Cb 1.41 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 3h0r h VAL 374 CO 0.13 0.01 -0.41 -0.09 0.02 0.00 0.00 177.57 177.22 3h0r h ARG 375 N 0.05 0.38 -0.44 1.57 2.43 -1.16 -1.60 114.38 115.60 3h0r h ARG 375 Ca 0.04 -0.19 -0.13 0.00 -0.81 0.00 0.00 59.98 58.88 3h0r h ARG 375 Cb 0.08 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 3h0r h ARG 375 CO -0.00 0.73 -0.25 -0.09 -1.51 0.00 0.00 179.97 178.84 3h0r h ARG 376 N 0.31 0.95 -0.51 0.20 2.43 -1.10 -0.74 114.38 115.92 3h0r h ARG 376 Ca 0.03 -0.43 0.03 0.00 -0.81 0.00 0.00 59.98 58.80 3h0r h ARG 376 Cb 0.86 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.36 3h0r h ARG 376 CO 0.07 1.09 0.29 -0.07 -1.51 0.00 0.00 179.97 179.84 3h0r h LEU 377 N 0.78 0.44 -0.55 3.80 3.38 -1.16 -0.52 115.31 121.49 3h0r h LEU 377 Ca 0.09 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 3h0r h LEU 377 Cb 0.83 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 3h0r h LEU 377 CO 0.07 0.31 0.12 0.40 0.09 0.00 0.00 178.44 179.43 3h0r h ILE 378 N 0.56 1.25 -0.65 1.22 2.04 -1.15 -1.15 117.51 119.63 3h0r h ILE 378 Ca 0.22 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 65.17 3h0r h ILE 378 Cb 0.07 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3h0r h ILE 378 CO -0.12 0.33 0.40 0.74 0.00 0.00 0.00 178.15 179.50 3h0r h THR 379 N 0.79 1.19 -0.49 -0.27 2.02 -0.93 -2.77 112.91 112.45 3h0r h THR 379 Ca 0.17 -0.41 -0.06 0.00 0.77 0.00 0.00 66.41 66.89 3h0r h THR 379 Cb 0.36 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 3h0r h THR 379 CO 0.00 0.19 0.08 0.78 0.37 0.00 0.00 175.52 176.94 3h0r h ASN 380 N 0.89 0.72 -0.36 4.18 2.35 -0.60 -1.92 115.58 120.84 3h0r h ASN 380 Ca 0.24 -0.14 0.08 0.00 -0.55 0.00 0.00 56.30 55.92 3h0r h ASN 380 Cb -0.04 -0.19 -0.09 0.00 0.05 0.00 0.00 38.32 38.06 3h0r h ASN 380 CO -0.05 0.74 -0.31 0.44 -1.65 0.00 0.00 177.43 176.61 3h0r h ASP 381 N 0.73 -1.01 0.11 5.81 3.32 -0.94 -2.07 116.42 122.37 3h0r h ASP 381 Ca 0.16 0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.39 3h0r h ASP 381 Cb 0.34 0.47 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 3h0r h ASP 381 CO 0.01 -0.31 -0.14 -0.26 -1.72 0.00 0.00 179.24 176.81 3h0r h PHE 382 N -0.26 -0.37 -0.90 4.55 0.04 -1.26 -0.49 116.94 118.25 3h0r h PHE 382 Ca 0.16 0.00 0.12 0.00 2.80 0.00 0.00 57.97 61.05 3h0r h PHE 382 Cb 0.52 0.15 -0.07 0.00 2.20 0.00 0.00 35.95 38.76 3h0r h PHE 382 CO -0.50 -0.22 0.58 -0.07 -0.60 0.00 0.00 178.31 177.50 3h0r h LEU 383 N -0.30 0.76 -0.09 1.54 3.38 -1.17 0.17 115.31 119.60 3h0r h LEU 383 Ca 0.01 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 3h0r h LEU 383 Cb 0.30 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3h0r h LEU 383 CO -0.06 0.42 -0.35 0.50 0.09 0.00 0.00 178.44 179.03 3h0r h LYS 384 N 0.82 0.40 -0.62 1.13 3.64 -1.08 -2.97 116.57 117.89 3h0r h LYS 384 Ca 0.43 -0.31 0.09 0.00 -1.27 0.00 0.00 60.65 59.60 3h0r h LYS 384 Cb 0.53 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.37 3h0r h LYS 384 CO -0.20 0.94 0.41 0.00 -2.27 0.00 0.00 179.45 178.33 3h0r h ALA 385 N 0.46 1.96 0.00 5.00 0.00 -0.12 -0.59 119.26 125.96 3h0r h ALA 385 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3h0r h ALA 385 Cb 0.99 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3h0r h ALA 385 CO 0.07 -0.08 0.00 1.19 0.00 0.00 0.00 179.25 180.43 3h0r n PHE 386 N -4.47 0.00 0.08 0.00 3.72 0.50 -2.13 117.46 115.15 3h0r n PHE 386 Ca 0.10 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.43 3h0r n PHE 386 Cb 0.34 -0.29 0.07 0.00 -0.94 0.00 0.00 39.48 38.66 3h0r n PHE 386 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3h0r h GLU 387 N 0.00 0.27 0.00 -1.08 5.08 -1.04 -3.33 114.58 114.48 3h0r h GLU 387 Ca 0.00 -0.21 -0.25 0.00 -1.00 0.00 0.00 59.36 57.89 3h0r h GLU 387 Cb 0.23 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 3h0r h GLU 387 CO 0.00 0.85 -2.05 0.39 -1.00 0.00 0.00 179.01 177.20 3h0r n GLU 388 N -3.82 0.66 -4.36 2.33 1.02 -0.96 -5.03 120.64 110.49 3h0r n GLU 388 Ca -0.03 0.03 -0.18 0.00 -0.02 0.00 0.00 57.16 56.96 3h0r n GLU 388 Cb 0.68 -1.61 -0.10 0.00 -0.02 0.00 0.00 31.44 30.39 3h0r n GLU 388 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3h0r s VAL 389 N -2.78 1.07 -0.23 2.62 -7.23 -0.91 -4.97 120.40 107.97 3h0r s VAL 389 Ca -0.08 -2.03 0.07 0.00 -1.81 0.00 0.00 61.98 58.14 3h0r s VAL 389 Cb 0.08 -2.45 -0.19 0.00 0.56 0.00 0.00 36.38 34.38 3h0r s VAL 389 CO 0.84 -0.24 -0.12 0.47 -0.31 0.00 0.00 175.10 175.74 3h0r n ASP 390 N -0.48 1.38 -4.15 4.85 8.00 -0.38 -4.44 116.55 121.32 3h0r n ASP 390 Ca -0.04 -0.09 -0.10 0.00 0.71 0.00 0.00 54.79 55.27 3h0r n ASP 390 Cb 0.64 0.10 -0.10 0.00 -0.02 0.00 0.00 41.12 41.75 3h0r n ASP 390 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3h0r s VAL 391 N -2.49 0.32 -0.11 2.53 -7.23 -0.86 -4.35 120.40 108.20 3h0r s VAL 391 Ca -0.25 -1.90 0.03 0.00 -1.81 0.00 0.00 61.98 58.05 3h0r s VAL 391 Cb 0.08 -1.88 0.00 0.00 0.56 0.00 0.00 36.38 35.14 3h0r s VAL 391 CO 0.66 -0.66 -0.22 -0.63 -0.31 0.00 0.00 175.10 173.93 3h0r s ILE 392 N -3.89 2.16 0.14 -0.62 1.01 -0.08 -0.91 121.20 119.02 3h0r s ILE 392 Ca 0.18 -0.98 0.10 0.00 0.00 0.00 0.00 60.65 59.95 3h0r s ILE 392 Cb 0.07 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 3h0r s ILE 392 CO -0.02 0.55 -0.21 0.00 0.00 0.00 0.00 174.94 175.27 3h0r s ALA 393 N 0.43 2.60 0.14 9.38 0.00 -0.71 0.15 121.76 133.75 3h0r s ALA 393 Ca -0.16 -1.45 -0.25 0.00 0.00 0.00 0.00 51.96 50.10 3h0r s ALA 393 Cb -0.17 -0.52 0.07 0.00 0.00 0.00 0.00 23.12 22.49 3h0r s ALA 393 CO 0.07 0.53 0.85 -1.54 0.00 0.00 0.00 175.76 175.67 3h0r s SER 394 N -2.30 -0.29 0.61 0.00 1.04 -0.56 -4.54 113.70 107.66 3h0r s SER 394 Ca 0.18 -0.28 -0.19 0.00 0.48 0.00 0.00 55.95 56.14 3h0r s SER 394 Cb -0.10 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.50 3h0r s SER 394 CO 0.09 -0.92 1.06 -2.65 0.98 0.00 0.00 173.24 171.80 3h0r n PRO 395 N -0.40 0.98 0.01 4.02 -0.02 -1.26 0.12 135.00 138.45 3h0r n PRO 395 Ca -0.08 0.38 -0.05 0.00 -2.02 0.00 0.00 63.50 61.73 3h0r n PRO 395 Cb 0.61 -2.27 0.15 0.00 -0.02 0.00 0.00 33.50 31.98 3h0r n PRO 395 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3h0r h THR 396 N 0.54 1.29 -3.42 3.45 2.02 -1.57 -3.41 112.91 111.81 3h0r h THR 396 Ca -0.49 -1.46 -0.18 0.00 0.77 0.00 0.00 66.41 65.06 3h0r h THR 396 Cb 1.36 1.49 -0.25 0.00 -1.74 0.00 0.00 68.15 69.01 3h0r h THR 396 CO 0.52 0.46 -0.53 -0.89 0.37 0.00 0.00 175.52 175.44 3h0r s THR 397 N -4.33 0.03 -0.66 3.16 2.01 -1.26 -4.37 115.64 110.22 3h0r s THR 397 Ca -0.07 -0.23 0.24 0.00 0.31 0.00 0.00 61.69 61.94 3h0r s THR 397 Cb 0.13 -0.28 0.24 0.00 0.01 0.00 0.00 72.50 72.60 3h0r s THR 397 CO 0.81 -0.13 1.72 -0.81 -0.69 0.00 0.00 174.62 175.52 3h0r n PRO 398 N 2.50 0.17 -4.30 4.92 -0.04 -1.26 -4.87 135.00 132.12 3h0r n PRO 398 Ca -0.16 0.31 -0.16 0.00 -0.04 0.00 0.00 63.50 63.45 3h0r n PRO 398 Cb 0.58 -1.77 -0.10 0.00 -0.04 0.00 0.00 33.50 32.16 3h0r n PRO 398 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3h0r s THR 399 N -3.19 0.63 0.69 0.52 -4.23 -1.26 -0.96 115.64 107.84 3h0r s THR 399 Ca 0.07 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.46 3h0r s THR 399 Cb 0.11 -2.50 0.01 0.00 1.34 0.00 0.00 72.50 71.46 3h0r s THR 399 CO 0.45 -0.13 1.07 -0.76 -0.54 0.00 0.00 174.62 174.71 3h0r s LEU 400 N -3.28 3.23 -0.13 4.79 1.43 -1.26 -4.95 118.68 118.50 3h0r s LEU 400 Ca 0.34 1.77 -0.42 0.00 -1.03 0.00 0.00 54.13 54.79 3h0r s LEU 400 Cb 0.07 -4.52 -0.20 0.00 0.03 0.00 0.00 46.19 41.58 3h0r s LEU 400 CO 0.11 -1.55 1.24 -2.65 0.23 0.00 0.00 176.35 173.73 3h0r n PRO 401 N -2.87 0.11 -2.59 1.29 -0.02 -1.26 -4.96 135.00 124.69 3h0r n PRO 401 Ca 0.09 0.04 -0.22 0.00 -2.02 0.00 0.00 63.50 61.38 3h0r n PRO 401 Cb 0.53 -1.55 0.06 0.00 -0.02 0.00 0.00 33.50 32.52 3h0r n PRO 401 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3h0r s PHE 402 N 0.89 2.51 0.39 6.00 -0.12 -1.26 -4.86 117.98 121.53 3h0r s PHE 402 Ca 0.94 -0.05 -0.05 0.00 -0.05 0.00 0.00 56.93 57.71 3h0r s PHE 402 Cb -1.30 -2.85 -0.05 0.00 -0.63 0.00 0.00 43.02 38.20 3h0r s PHE 402 CO 0.63 -1.14 0.68 0.15 -0.05 0.00 0.00 175.22 175.49 3h0r s LYS 403 N -4.90 3.62 0.48 1.99 1.02 -1.26 -1.48 119.74 119.21 3h0r s LYS 403 Ca 0.60 0.13 -0.24 0.00 0.02 0.00 0.00 55.97 56.48 3h0r s LYS 403 Cb -0.09 -2.50 -0.07 0.00 -0.52 0.00 0.00 37.83 34.65 3h0r s LYS 403 CO 0.40 0.01 1.39 -0.06 -0.92 0.00 0.00 175.35 176.17 3h0r s PHE 404 N -2.40 2.43 0.00 3.18 0.08 -1.22 -2.03 117.98 118.02 3h0r s PHE 404 Ca 0.46 1.32 0.00 0.00 0.12 0.00 0.00 56.93 58.83 3h0r s PHE 404 Cb -0.10 -3.85 0.00 0.00 -0.57 0.00 0.00 43.02 38.50 3h0r s PHE 404 CO 0.36 -2.83 0.00 0.41 -0.10 0.00 0.00 175.22 173.06 3h0r n GLY 405 N 0.63 2.53 0.19 4.36 0.00 -1.26 -4.86 105.19 106.78 3h0r n GLY 405 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 3h0r n GLY 405 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3h0r h GLU 406 N 2.06 0.27 -0.32 1.61 4.81 -1.81 -3.26 114.58 117.95 3h0r h GLU 406 Ca 0.00 -0.14 -0.25 0.00 -0.13 0.00 0.00 59.36 58.84 3h0r h GLU 406 Cb 0.00 0.01 -0.24 0.00 0.63 0.00 0.00 28.75 29.14 3h0r h GLU 406 CO 0.00 0.68 -0.74 0.54 -0.73 0.00 0.00 179.01 178.76 3h0r n ARG 407 N -3.99 2.18 -0.00 1.92 1.74 -1.26 -4.65 116.66 112.60 3h0r n ARG 407 Ca -0.02 -3.50 0.05 0.00 -0.77 0.00 0.00 57.85 53.61 3h0r n ARG 407 Cb 0.52 -1.68 -0.07 0.00 -1.02 0.00 0.00 32.46 30.20 3h0r n ARG 407 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3h0r n LEU 408 N -0.73 0.15 0.28 0.55 4.77 -1.23 -3.92 117.00 116.87 3h0r n LEU 408 Ca 0.26 -0.16 -0.11 0.00 -0.03 0.00 0.00 56.01 55.96 3h0r n LEU 408 Cb 0.86 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.89 3h0r n LEU 408 CO 0.13 0.04 0.39 -0.33 -1.33 0.00 0.00 177.39 176.29 3h0r h GLU 409 N 0.00 -0.71 -4.83 3.23 5.08 -1.83 -3.40 114.58 112.12 3h0r h GLU 409 Ca 0.00 0.05 -0.66 0.00 -1.00 0.00 0.00 59.36 57.74 3h0r h GLU 409 Cb 0.39 0.16 -0.22 0.00 0.50 0.00 0.00 28.75 29.59 3h0r h GLU 409 CO 0.00 -0.47 -0.56 1.21 -1.00 0.00 0.00 179.01 178.18 3h0r s ASN 410 N -3.82 5.54 0.38 1.42 2.47 -1.26 -4.99 114.94 114.67 3h0r s ASN 410 Ca -0.11 -0.37 0.18 0.00 0.42 0.00 0.00 52.86 52.98 3h0r s ASN 410 Cb 0.01 -2.01 1.13 0.00 -1.45 0.00 0.00 41.25 38.94 3h0r s ASN 410 CO 0.32 -0.14 1.70 -0.65 -3.72 0.00 0.00 177.10 174.62 3h0r h PRO 411 N 8.33 0.33 -0.44 0.43 0.11 -1.84 0.44 132.00 139.36 3h0r h PRO 411 Ca -0.34 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.78 3h0r h PRO 411 Cb 1.16 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3h0r h PRO 411 CO 0.60 0.22 0.29 0.82 -0.21 0.00 0.00 178.00 179.72 3h0r h ILE 412 N 0.34 1.04 -0.05 4.15 2.04 -1.94 -0.53 117.51 122.57 3h0r h ILE 412 Ca 0.69 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 66.35 3h0r h ILE 412 Cb 1.73 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 3h0r h ILE 412 CO -0.44 0.09 -0.15 -0.33 0.00 0.00 0.00 178.15 177.32 3h0r h GLU 413 N 0.48 0.08 -0.34 2.37 5.08 -1.20 -0.72 114.58 120.33 3h0r h GLU 413 Ca 0.18 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.38 3h0r h GLU 413 Cb 0.11 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3h0r h GLU 413 CO -0.04 0.23 -0.37 1.98 -1.00 0.00 0.00 179.01 179.81 3h0r h MET 414 N 0.08 0.79 -0.60 2.33 4.05 -1.18 -3.20 114.93 117.18 3h0r h MET 414 Ca 0.02 -0.40 -0.04 0.00 -0.28 0.00 0.00 59.70 59.00 3h0r h MET 414 Cb 0.31 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.09 3h0r h MET 414 CO 0.02 1.03 0.22 1.88 0.23 0.00 0.00 176.91 180.29 3h0r h TYR 415 N 0.65 0.90 0.00 1.39 0.05 -0.98 -2.41 116.97 116.57 3h0r h TYR 415 Ca 0.06 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3h0r h TYR 415 Cb 0.92 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 38.39 3h0r h TYR 415 CO 0.05 0.71 0.00 1.28 -1.05 0.00 0.00 178.16 179.15 3h0r n LEU 416 N -4.31 0.00 0.27 3.88 4.77 -0.90 -1.48 117.00 119.22 3h0r n LEU 416 Ca 0.05 0.45 0.13 0.00 -0.03 0.00 0.00 56.01 56.61 3h0r n LEU 416 Cb 0.18 -0.45 0.74 0.00 -2.33 0.00 0.00 43.42 41.57 3h0r n LEU 416 CO 0.39 -0.32 0.99 0.28 -1.33 0.00 0.00 177.39 177.40 3h0r h SER 417 N 0.00 0.00 -0.21 -1.43 0.02 -1.56 -3.23 113.55 107.13 3h0r h SER 417 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3h0r h SER 417 Cb 0.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.67 3h0r h SER 417 CO 0.00 0.11 0.00 0.47 -1.14 0.00 0.00 176.83 176.27 3h0r n ASP 418 N -3.64 2.83 0.18 3.07 8.00 -0.55 -4.57 116.55 121.88 3h0r n ASP 418 Ca -0.02 -1.90 0.13 0.00 0.71 0.00 0.00 54.79 53.72 3h0r n ASP 418 Cb 0.23 -0.13 0.71 0.00 -0.02 0.00 0.00 41.12 41.91 3h0r n ASP 418 CO 0.00 0.00 0.00 0.16 -0.39 0.00 0.00 177.20 176.97 3h0r h ILE 419 N 3.95 0.80 0.00 0.53 3.07 -1.74 -0.65 117.51 123.47 3h0r h ILE 419 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 3h0r h ILE 419 Cb 0.86 0.90 0.00 0.00 -0.27 0.00 0.00 36.82 38.31 3h0r h ILE 419 CO 0.00 0.00 -0.91 0.18 -1.05 0.00 0.00 178.15 176.37 3h0r n LEU 420 N -4.32 0.83 -0.11 0.16 4.77 -1.26 -4.57 117.00 112.50 3h0r n LEU 420 Ca 0.01 -0.34 -0.13 0.00 -0.03 0.00 0.00 56.01 55.51 3h0r n LEU 420 Cb 0.27 -0.06 -0.13 0.00 -2.33 0.00 0.00 43.42 41.16 3h0r n LEU 420 CO 0.33 0.20 -1.22 0.35 -1.33 0.00 0.00 177.39 175.73 3h0r n THR 421 N -1.55 1.36 -0.24 -5.08 -2.24 -0.31 -4.58 114.28 101.64 3h0r n THR 421 Ca 0.04 -0.66 -0.00 0.00 -2.27 0.00 0.00 64.05 61.16 3h0r n THR 421 Cb 0.34 -0.97 0.22 0.00 -2.10 0.00 0.00 70.33 67.83 3h0r n THR 421 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 3h0r h VAL 422 N 0.00 1.21 -0.82 2.28 -1.51 -1.32 -3.06 116.25 113.03 3h0r h VAL 422 Ca -0.53 -0.39 0.11 0.00 -1.23 0.00 0.00 66.70 64.65 3h0r h VAL 422 Cb 2.00 0.05 -0.06 0.00 -2.13 0.00 0.00 31.29 31.15 3h0r h VAL 422 CO -0.03 0.20 0.53 -0.65 -1.23 0.00 0.00 177.57 176.39 3h0r h PRO 423 N 1.07 0.71 -0.19 5.19 0.11 -1.84 -1.02 132.00 136.02 3h0r h PRO 423 Ca 0.29 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.28 3h0r h PRO 423 Cb -0.11 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 30.83 3h0r h PRO 423 CO -0.06 0.47 -0.22 0.00 -0.21 0.00 0.00 178.00 177.98 3h0r h ALA 424 N 1.60 1.27 -0.31 -0.75 0.00 -1.84 -1.99 119.26 117.23 3h0r h ALA 424 Ca 0.39 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 3h0r h ALA 424 Cb 0.51 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3h0r h ALA 424 CO -0.15 0.48 -0.47 -0.91 0.00 0.00 0.00 179.25 178.20 3h0r h ASN 425 N 0.31 0.91 -0.82 0.00 4.21 -1.36 0.13 115.58 118.95 3h0r h ASN 425 Ca 0.05 -0.45 -0.02 0.00 1.21 0.00 0.00 56.30 57.09 3h0r h ASN 425 Cb 0.56 -0.26 -0.04 0.00 -1.12 0.00 0.00 38.32 37.47 3h0r h ASN 425 CO 0.04 1.22 0.42 -0.07 -1.29 0.00 0.00 177.43 177.76 3h0r h LEU 426 N 0.66 1.06 -0.21 1.61 3.38 -1.10 -2.40 115.31 118.31 3h0r h LEU 426 Ca 0.04 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3h0r h LEU 426 Cb 1.05 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.53 3h0r h LEU 426 CO 0.10 0.87 -0.21 0.00 0.09 0.00 0.00 178.44 179.30 3h0r n ALA 427 N -2.40 2.94 -1.06 1.53 0.00 -0.77 -4.85 120.51 115.90 3h0r n ALA 427 Ca 0.08 -0.29 -0.02 0.00 0.00 0.00 0.00 53.44 53.21 3h0r n ALA 427 Cb 0.12 -1.26 -0.01 0.00 0.00 0.00 0.00 19.45 18.29 3h0r n ALA 427 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0r n GLY 428 N 1.37 0.55 3.85 0.00 0.00 -0.66 -4.97 105.19 105.32 3h0r n GLY 428 Ca 0.11 -0.47 -0.33 0.00 0.00 0.00 0.00 46.02 45.33 3h0r n GLY 428 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h0r s LEU 429 N -0.46 4.07 0.59 0.99 1.43 0.38 -1.71 118.68 123.97 3h0r s LEU 429 Ca 0.00 1.29 -0.18 0.00 -1.03 0.00 0.00 54.13 54.21 3h0r s LEU 429 Cb 0.00 -4.07 -0.04 0.00 0.03 0.00 0.00 46.19 42.12 3h0r s LEU 429 CO 0.00 -0.20 1.16 -2.16 0.23 0.00 0.00 176.35 175.38 3h0r s PRO 430 N -2.95 3.06 -0.12 1.29 0.04 -1.26 -4.59 135.00 130.48 3h0r s PRO 430 Ca 0.54 1.66 -0.18 0.00 0.04 0.00 0.00 61.00 63.06 3h0r s PRO 430 Cb -0.10 -1.96 0.04 0.00 0.04 0.00 0.00 34.50 32.52 3h0r s PRO 430 CO 0.17 -1.09 0.45 0.00 0.04 0.00 0.00 177.00 176.57 3h0r s ALA 431 N -1.81 -1.13 0.01 8.56 0.00 -0.09 -1.89 121.76 125.41 3h0r s ALA 431 Ca 0.74 1.05 0.05 0.00 0.00 0.00 0.00 51.96 53.79 3h0r s ALA 431 Cb -0.26 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.40 3h0r s ALA 431 CO 0.32 -0.25 -0.14 -1.50 0.00 0.00 0.00 175.76 174.19 3h0r s ILE 432 N -0.35 1.13 -0.13 0.00 2.07 -0.57 -1.12 121.20 122.23 3h0r s ILE 432 Ca -0.05 -0.77 -0.02 0.00 -1.41 0.00 0.00 60.65 58.40 3h0r s ILE 432 Cb -0.03 -0.98 -0.02 0.00 0.13 0.00 0.00 42.46 41.56 3h0r s ILE 432 CO 0.03 0.20 -0.08 -0.55 -1.91 0.00 0.00 174.94 172.63 3h0r s SER 433 N -0.66 4.48 -0.03 4.50 0.15 -0.23 -1.41 113.70 120.50 3h0r s SER 433 Ca 0.04 -0.19 0.02 0.00 0.70 0.00 0.00 55.95 56.52 3h0r s SER 433 Cb -0.06 -1.62 0.01 0.00 -1.71 0.00 0.00 66.02 62.63 3h0r s SER 433 CO 0.00 0.20 -0.07 -0.51 1.20 0.00 0.00 173.24 174.06 3h0r s ILE 434 N 0.18 0.62 0.07 6.45 -1.16 0.13 -1.75 121.20 125.73 3h0r s ILE 434 Ca -0.04 -0.26 -0.31 0.00 -0.51 0.00 0.00 60.65 59.53 3h0r s ILE 434 Cb -0.14 -0.57 -0.07 0.00 0.61 0.00 0.00 42.46 42.28 3h0r s ILE 434 CO 0.04 0.21 1.44 -2.84 -2.81 0.00 0.00 174.94 170.98 3h0r s PRO 435 N 0.32 4.28 -0.00 3.50 0.02 -1.26 0.85 135.00 142.71 3h0r s PRO 435 Ca -0.04 2.08 0.03 0.00 0.02 0.00 0.00 61.00 63.10 3h0r s PRO 435 Cb -0.09 -3.42 -0.05 0.00 0.02 0.00 0.00 34.50 30.96 3h0r s PRO 435 CO 0.00 -0.54 0.08 0.44 -0.33 0.00 0.00 177.00 176.65 3h0r n ILE 436 N 4.33 0.00 -3.77 2.83 -5.35 0.36 -4.85 119.36 112.91 3h0r n ILE 436 Ca 0.13 -0.10 -0.04 0.00 -0.27 0.00 0.00 62.75 62.47 3h0r n ILE 436 Cb 0.42 0.46 -0.01 0.00 -1.74 0.00 0.00 39.64 38.77 3h0r n ILE 436 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h0r s ALA 437 N -2.18 -1.61 -0.10 -1.28 0.00 -1.22 -4.87 121.76 110.51 3h0r s ALA 437 Ca -0.01 0.06 0.01 0.00 0.00 0.00 0.00 51.96 52.02 3h0r s ALA 437 Cb 0.02 0.66 0.02 0.00 0.00 0.00 0.00 23.12 23.82 3h0r s ALA 437 CO 0.14 -1.05 -0.12 -1.58 0.00 0.00 0.00 175.76 173.16 3h0r s TRP 438 N -3.28 1.68 -0.15 0.00 0.52 -1.26 -1.54 118.94 114.91 3h0r s TRP 438 Ca 0.13 -0.78 0.00 0.00 0.02 0.00 0.00 56.10 55.47 3h0r s TRP 438 Cb -0.02 -1.27 0.02 0.00 -1.15 0.00 0.00 33.47 31.05 3h0r s TRP 438 CO 0.03 -0.45 -0.15 0.15 0.02 0.00 0.00 176.95 176.56 3h0r s LYS 439 N 1.16 2.35 -1.53 4.98 -0.14 0.10 -4.63 119.74 122.04 3h0r s LYS 439 Ca -0.04 -0.58 -0.04 0.00 -1.36 0.00 0.00 55.97 53.95 3h0r s LYS 439 Cb -0.14 -2.13 0.01 0.00 -1.68 0.00 0.00 37.83 33.89 3h0r s LYS 439 CO -0.03 -0.23 0.36 -0.25 -0.76 0.00 0.00 175.35 174.44 3h0r n ASP 440 N 4.73 -5.50 0.00 2.83 8.00 -1.26 -1.99 116.55 123.37 3h0r n ASP 440 Ca -0.17 -0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.15 3h0r n ASP 440 Cb 0.50 -4.51 0.00 0.00 -0.02 0.00 0.00 41.12 37.09 3h0r n ASP 440 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h0r n GLY 441 N -1.26 1.11 3.46 0.44 0.00 -1.26 -5.05 105.19 102.64 3h0r n GLY 441 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 3h0r n GLY 441 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h0r s LEU 442 N 0.00 2.68 0.61 0.99 1.43 -0.84 -4.91 118.68 118.64 3h0r s LEU 442 Ca 0.00 -0.24 -0.18 0.00 -1.03 0.00 0.00 54.13 52.67 3h0r s LEU 442 Cb 0.00 -1.54 -0.03 0.00 0.03 0.00 0.00 46.19 44.65 3h0r s LEU 442 CO 0.00 0.33 1.21 -2.84 0.23 0.00 0.00 176.35 175.28 3h0r s PRO 443 N -0.83 2.86 -0.05 1.29 0.02 -1.26 -0.72 135.00 136.30 3h0r s PRO 443 Ca 0.12 1.82 0.03 0.00 0.02 0.00 0.00 61.00 62.99 3h0r s PRO 443 Cb -0.11 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.50 3h0r s PRO 443 CO 0.01 -1.29 -0.14 0.08 -0.33 0.00 0.00 177.00 175.33 3h0r s VAL 444 N -1.65 1.18 -0.14 3.83 1.01 -0.59 -4.66 120.40 119.37 3h0r s VAL 444 Ca 0.77 -0.55 -0.07 0.00 0.00 0.00 0.00 61.98 62.13 3h0r s VAL 444 Cb -0.30 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 3h0r s VAL 444 CO 0.35 0.35 0.11 -0.83 0.00 0.00 0.00 175.10 175.08 3h0r s GLY 445 N 0.28 2.06 -0.15 4.51 0.00 -1.26 -0.49 107.32 112.28 3h0r s GLY 445 Ca -0.07 -0.69 -0.07 0.00 0.00 0.00 0.00 44.72 43.89 3h0r s GLY 445 CO 0.02 -0.27 0.11 -0.32 0.00 0.00 0.00 173.10 172.64 3h0r s GLY 446 N -0.61 2.07 -0.14 0.20 0.00 0.25 -1.53 107.32 107.56 3h0r s GLY 446 Ca 0.12 -0.68 -0.04 0.00 0.00 0.00 0.00 44.72 44.12 3h0r s GLY 446 CO 0.02 -0.21 -0.00 1.62 0.00 0.00 0.00 173.10 174.54 3h0r s GLN 447 N -0.47 3.52 -0.14 2.90 0.74 0.12 -0.70 119.66 125.63 3h0r s GLN 447 Ca 0.11 -0.44 0.02 0.00 0.05 0.00 0.00 55.36 55.10 3h0r s GLN 447 Cb -0.12 -2.95 0.01 0.00 1.10 0.00 0.00 33.01 31.06 3h0r s GLN 447 CO 0.02 0.40 -0.19 -0.51 -0.55 0.00 0.00 175.29 174.46 3h0r s LEU 448 N -0.05 1.97 -0.22 3.68 1.43 -0.50 -1.50 118.68 123.49 3h0r s LEU 448 Ca 0.03 -0.56 -0.09 0.00 -1.03 0.00 0.00 54.13 52.49 3h0r s LEU 448 Cb -0.13 -1.34 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 3h0r s LEU 448 CO 0.02 0.03 0.10 -0.63 0.23 0.00 0.00 176.35 176.10 3h0r s ILE 449 N 1.05 4.91 0.50 -0.59 1.01 0.12 -1.51 121.20 126.69 3h0r s ILE 449 Ca -0.03 0.02 0.07 0.00 0.00 0.00 0.00 60.65 60.71 3h0r s ILE 449 Cb -0.14 -3.26 0.02 0.00 0.01 0.00 0.00 42.46 39.09 3h0r s ILE 449 CO -0.05 0.39 0.46 -0.83 0.00 0.00 0.00 174.94 174.90 3h0r s GLY 450 N 0.89 2.18 0.71 6.18 0.00 -0.79 -0.90 107.32 115.57 3h0r s GLY 450 Ca 0.05 -1.66 -0.11 0.00 0.00 0.00 0.00 44.72 43.00 3h0r s GLY 450 CO 0.03 -1.80 1.07 0.54 0.00 0.00 0.00 173.10 172.93 3h0r s LYS 451 N -4.28 2.76 -0.12 2.90 1.02 -1.26 -4.10 119.74 116.66 3h0r s LYS 451 Ca 0.44 1.06 -0.39 0.00 0.02 0.00 0.00 55.97 57.11 3h0r s LYS 451 Cb -0.03 -1.96 -0.16 0.00 -0.52 0.00 0.00 37.83 35.16 3h0r s LYS 451 CO 0.27 -1.25 1.58 0.72 -0.92 0.00 0.00 175.35 175.75 3h0r n HIS 452 N -3.12 1.84 -0.99 3.18 8.25 -1.26 -1.42 115.22 121.69 3h0r n HIS 452 Ca 0.08 0.56 0.00 0.00 -0.26 0.00 0.00 57.72 58.11 3h0r n HIS 452 Cb 0.53 -2.41 0.00 0.00 1.12 0.00 0.00 29.99 29.23 3h0r n HIS 452 CO 0.00 0.00 0.00 0.91 0.64 0.00 0.00 176.34 177.89 3h0r n TRP 453 N 4.20 0.00 -2.10 4.41 7.02 -1.26 -4.93 117.44 124.77 3h0r n TRP 453 Ca 0.23 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.35 3h0r n TRP 453 Cb 0.16 -0.08 0.03 0.00 -2.42 0.00 0.00 31.31 29.00 3h0r n TRP 453 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 3h0r n ASP 454 N -0.03 6.69 0.11 -0.99 2.03 -0.51 -4.62 116.55 119.24 3h0r n ASP 454 Ca 0.00 -3.80 0.03 0.00 0.52 0.00 0.00 54.79 51.54 3h0r n ASP 454 Cb 0.01 -0.89 0.40 0.00 -0.72 0.00 0.00 41.12 39.93 3h0r n ASP 454 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 3h0r h GLU 455 N 2.90 0.26 -0.08 -0.67 3.07 -1.92 -3.14 114.58 115.00 3h0r h GLU 455 Ca 0.49 -0.05 0.04 0.00 -0.50 0.00 0.00 59.36 59.33 3h0r h GLU 455 Cb 0.29 -0.04 -0.06 0.00 -0.84 0.00 0.00 28.75 28.10 3h0r h GLU 455 CO 1.26 0.36 -0.43 1.15 -1.40 0.00 0.00 179.01 179.95 3h0r h THR 456 N 0.25 0.13 -0.21 1.13 2.02 -1.98 0.28 112.91 114.53 3h0r h THR 456 Ca 0.05 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.28 3h0r h THR 456 Cb 0.32 0.13 -0.05 0.00 -1.74 0.00 0.00 68.15 66.81 3h0r h THR 456 CO 0.02 0.00 -0.13 0.74 0.37 0.00 0.00 175.52 176.51 3h0r h THR 457 N -0.53 0.61 -0.97 3.16 2.02 -1.94 0.50 112.91 115.76 3h0r h THR 457 Ca 0.06 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.42 3h0r h THR 457 Cb 0.64 0.61 -0.09 0.00 -1.74 0.00 0.00 68.15 67.58 3h0r h THR 457 CO -0.37 0.00 0.61 -0.07 0.37 0.00 0.00 175.52 176.06 3h0r h LEU 458 N -0.12 0.70 -0.01 2.58 4.07 -1.53 -1.33 115.31 119.67 3h0r h LEU 458 Ca 0.12 0.07 -0.27 0.00 0.08 0.00 0.00 57.88 57.88 3h0r h LEU 458 Cb 0.30 -0.06 0.02 0.00 1.08 0.00 0.00 40.66 42.00 3h0r h LEU 458 CO -0.28 0.29 -1.05 -0.07 -1.08 0.00 0.00 178.44 176.24 3h0r h LEU 459 N 0.70 0.88 -0.21 1.67 3.38 0.14 -2.71 115.31 119.17 3h0r h LEU 459 Ca 0.52 -0.71 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3h0r h LEU 459 Cb 0.88 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 3h0r h LEU 459 CO -0.29 1.51 0.10 1.56 0.09 0.00 0.00 178.44 181.41 3h0r h GLN 460 N 0.37 0.29 -0.29 1.13 4.20 0.58 -0.38 115.11 121.02 3h0r h GLN 460 Ca -0.13 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.49 3h0r h GLN 460 Cb 1.71 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 29.42 3h0r h GLN 460 CO 0.20 0.31 -0.00 0.82 -0.67 0.00 0.00 178.83 179.49 3h0r h ILE 461 N 0.21 1.18 -0.44 2.54 2.04 -1.35 0.09 117.51 121.78 3h0r h ILE 461 Ca 0.07 -0.71 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 3h0r h ILE 461 Cb 0.11 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 3h0r h ILE 461 CO -0.01 0.24 -0.11 -1.28 0.00 0.00 0.00 178.15 176.99 3h0r h SER 462 N 0.43 0.77 -0.37 1.72 0.87 -1.11 -0.74 113.55 115.13 3h0r h SER 462 Ca 0.10 -0.23 -0.06 0.00 -1.23 0.00 0.00 61.79 60.37 3h0r h SER 462 Cb 0.29 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 3h0r h SER 462 CO 0.01 0.91 0.01 0.22 -0.53 0.00 0.00 176.83 177.44 3h0r h TYR 463 N 0.71 0.71 -0.52 2.24 3.20 -0.05 -2.30 116.97 120.96 3h0r h TYR 463 Ca 0.12 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 3h0r h TYR 463 Cb 0.59 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 3h0r h TYR 463 CO 0.03 0.74 0.30 1.25 -1.64 0.00 0.00 178.16 178.84 3h0r h LEU 464 N 0.47 0.64 -1.28 2.82 6.46 -0.90 -3.05 115.31 120.46 3h0r h LEU 464 Ca 0.11 -0.07 -0.07 0.00 -0.12 0.00 0.00 57.88 57.72 3h0r h LEU 464 Cb 0.45 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.21 3h0r h LEU 464 CO 0.02 0.52 -0.30 -0.25 -0.62 0.00 0.00 178.44 177.81 3h0r h TRP 465 N 0.70 0.10 0.00 1.25 2.91 -1.01 -2.78 115.95 117.12 3h0r h TRP 465 Ca 0.19 -0.02 -0.10 0.00 1.13 0.00 0.00 58.89 60.09 3h0r h TRP 465 Cb 0.01 -0.03 -0.01 0.00 -0.51 0.00 0.00 29.16 28.62 3h0r h TRP 465 CO -0.02 0.39 -0.46 1.05 -1.03 0.00 0.00 178.44 178.37 3h0r h GLU 466 N 0.08 0.00 -0.16 2.65 4.11 -1.33 0.23 114.58 120.16 3h0r h GLU 466 Ca 0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.44 3h0r h GLU 466 Cb 0.58 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3h0r h GLU 466 CO 0.04 0.46 0.09 1.96 0.07 0.00 0.00 179.01 181.63 3h0r h GLN 467 N 0.00 0.21 -0.40 1.06 1.08 -1.39 -2.93 115.11 112.74 3h0r h GLN 467 Ca -0.00 -0.02 -0.15 0.00 -1.45 0.00 0.00 58.65 57.03 3h0r h GLN 467 Cb 1.10 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.48 3h0r h GLN 467 CO 0.06 0.20 -0.33 0.87 -0.95 0.00 0.00 178.83 178.68 3h0r h LYS 468 N 0.17 0.92 -3.23 1.46 1.57 -1.38 -3.42 116.57 112.65 3h0r h LYS 468 Ca 0.06 -0.45 -0.51 0.00 -1.87 0.00 0.00 60.65 57.88 3h0r h LYS 468 Cb 0.05 -0.00 -0.40 0.00 0.08 0.00 0.00 32.23 31.95 3h0r h LYS 468 CO -0.01 1.10 -0.76 0.12 -0.57 0.00 0.00 179.45 179.33 3h0r s PHE 469 N -4.47 0.68 -1.27 -1.35 5.36 0.78 -5.06 117.98 112.66 3h0r s PHE 469 Ca -0.11 -0.78 -0.11 0.00 -0.96 0.00 0.00 56.93 54.98 3h0r s PHE 469 Cb 0.12 -0.97 0.16 0.00 -0.34 0.00 0.00 43.02 41.99 3h0r s PHE 469 CO 0.87 -0.65 1.75 1.63 -1.46 0.00 0.00 175.22 177.36 3h0r n LYS 470 N 5.14 3.51 0.25 10.12 5.02 -1.12 -4.11 118.16 136.97 3h0r n LYS 470 Ca -0.07 -3.59 0.16 0.00 -2.02 0.00 0.00 58.31 52.80 3h0r n LYS 470 Cb 0.46 -2.99 0.67 0.00 -0.02 0.00 0.00 35.03 33.16 3h0r n LYS 470 CO 0.00 0.00 0.00 1.12 -0.52 0.00 0.00 177.40 178.00 3h0r h HIS 471 N 6.22 0.00 0.00 2.13 2.07 -1.91 -2.73 115.15 120.93 3h0r h HIS 471 Ca 0.38 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.90 3h0r h HIS 471 Cb 0.71 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.69 3h0r h HIS 471 CO 1.22 0.00 0.00 2.48 -3.07 0.00 0.00 177.93 178.56 3h0r n TYR 472 N -2.88 0.00 0.08 6.12 0.18 -1.26 -2.16 117.16 117.24 3h0r n TYR 472 Ca 0.01 0.00 0.07 0.00 1.88 0.00 0.00 57.90 59.86 3h0r n TYR 472 Cb 0.27 -0.44 -0.03 0.00 -0.38 0.00 0.00 39.34 38.76 3h0r n TYR 472 CO 0.00 0.00 0.00 0.93 -2.08 0.00 0.00 176.86 175.71 3h0r h GLU 473 N 0.00 0.00 -6.18 -3.48 5.08 -1.87 -3.44 114.58 104.70 3h0r h GLU 473 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 3h0r h GLU 473 Cb 0.26 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.46 3h0r h GLU 473 CO 0.00 0.12 1.21 0.15 -1.00 0.00 0.00 179.01 179.49 3h0r s LYS 474 N -3.18 2.92 -0.22 2.33 -0.14 -0.92 -4.97 119.74 115.56 3h0r s LYS 474 Ca -0.01 0.25 -0.00 0.00 -1.36 0.00 0.00 55.97 54.85 3h0r s LYS 474 Cb 0.09 -4.28 0.03 0.00 -1.68 0.00 0.00 37.83 31.99 3h0r s LYS 474 CO 0.80 -2.41 -0.12 0.42 -0.76 0.00 0.00 175.35 173.27 3h0r s ILE 475 N 7.42 2.48 0.54 2.17 1.01 -1.26 -5.07 121.20 128.49 3h0r s ILE 475 Ca 0.53 -1.03 -0.09 0.00 0.00 0.00 0.00 60.65 60.05 3h0r s ILE 475 Cb -0.11 -2.19 0.13 0.00 0.01 0.00 0.00 42.46 40.30 3h0r s ILE 475 CO 0.19 0.33 0.65 -0.81 0.00 0.00 0.00 174.94 175.30 3h0r n PRO 476 N 4.62 -1.08 -2.80 2.79 -0.04 -1.26 -4.33 135.00 132.90 3h0r n PRO 476 Ca -0.18 -1.02 -0.16 0.00 -0.04 0.00 0.00 63.50 62.10 3h0r n PRO 476 Cb 0.48 -0.75 0.01 0.00 -0.04 0.00 0.00 33.50 33.20 3h0r n PRO 476 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3h0r n LEU 477 N 0.00 -1.04 0.00 1.53 4.77 -1.25 -4.90 117.00 116.10 3h0r n LEU 477 Ca 0.08 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 3h0r n LEU 477 Cb 0.30 -0.81 0.00 0.00 -2.33 0.00 0.00 43.42 40.59 3h0r n LEU 477 CO 0.22 0.13 0.00 0.35 -1.33 0.00 0.00 177.39 176.75