#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 -4.19 117.00 118.73 3h0r n LEU 2 Ca 0.00 0.00 0.12 0.00 -1.11 0.00 0.00 56.01 55.02 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 0.85 -2.67 -1.11 0.00 0.00 177.39 174.46 3h0r n TRP 3 N 0.00 0.79 1.54 1.96 4.27 -1.26 -1.42 117.44 123.33 3h0r n TRP 3 Ca 0.00 0.32 0.14 0.00 -3.89 0.00 0.00 57.50 54.08 3h0r n TRP 3 Cb 0.00 -1.02 0.63 0.00 -1.36 0.00 0.00 31.31 29.55 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 -2.23 1.10 -3.75 -2.67 4.81 -1.26 -4.91 118.16 109.25 3h0r n LYS 4 Ca 0.02 -0.46 -0.30 0.00 -0.87 0.00 0.00 58.31 56.69 3h0r n LYS 4 Cb 0.20 -1.49 -0.04 0.00 0.02 0.00 0.00 35.03 33.72 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 -2.22 3.55 0.92 1.64 1.02 -0.51 -4.84 119.74 119.29 3h0r s LYS 5 Ca 0.35 -0.24 -0.14 0.00 0.02 0.00 0.00 55.97 55.96 3h0r s LYS 5 Cb 0.21 -2.90 0.15 0.00 -0.52 0.00 0.00 37.83 34.77 3h0r s LYS 5 CO 0.41 0.49 1.23 -1.54 -0.92 0.00 0.00 175.35 175.02 3h0r s SER 6 N -2.62 3.53 0.43 2.83 1.04 -1.26 -4.81 113.70 112.85 3h0r s SER 6 Ca 0.39 0.59 0.24 0.00 0.48 0.00 0.00 55.95 57.65 3h0r s SER 6 Cb -0.12 -0.90 0.84 0.00 0.10 0.00 0.00 66.02 65.95 3h0r s SER 6 CO 0.26 -2.50 1.79 -0.07 0.98 0.00 0.00 173.24 173.70 3h0r h LEU 7 N -1.47 0.00 -0.07 2.42 3.38 -1.97 0.18 115.31 117.78 3h0r h LEU 7 Ca -0.46 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 3h0r h LEU 7 Cb 1.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.04 3h0r h LEU 7 CO 0.52 0.22 -0.05 0.28 0.09 0.00 0.00 178.44 179.50 3h0r h SER 8 N 0.00 0.16 -0.50 -0.43 0.02 -1.98 0.15 113.55 110.97 3h0r h SER 8 Ca -0.00 -0.46 -0.02 0.00 -0.84 0.00 0.00 61.79 60.47 3h0r h SER 8 Cb 0.80 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.28 3h0r h SER 8 CO 0.03 0.59 0.25 -0.33 -1.14 0.00 0.00 176.83 176.23 3h0r h GLU 9 N -0.27 0.72 -0.39 3.45 5.08 -1.87 -2.26 114.58 119.04 3h0r h GLU 9 Ca 0.01 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 3h0r h GLU 9 Cb 0.54 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 3h0r h GLU 9 CO 0.01 0.58 0.09 -0.07 -1.00 0.00 0.00 179.01 178.63 3h0r h LEU 10 N 0.67 0.59 -0.33 1.33 4.07 -0.66 -2.82 115.31 118.15 3h0r h LEU 10 Ca 0.17 -0.23 -0.02 0.00 0.08 0.00 0.00 57.88 57.88 3h0r h LEU 10 Cb 0.09 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.66 3h0r h LEU 10 CO -0.02 0.67 0.11 -0.09 -1.08 0.00 0.00 178.44 178.03 3h0r h ARG 11 N 0.48 0.51 -0.52 1.13 2.43 -0.59 -0.87 114.38 116.95 3h0r h ARG 11 Ca 0.12 -0.10 0.08 0.00 -0.81 0.00 0.00 59.98 59.27 3h0r h ARG 11 Cb 0.31 -0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 29.72 3h0r h ARG 11 CO 0.00 0.53 0.16 1.49 -1.51 0.00 0.00 179.97 180.65 3h0r h GLU 12 N 0.39 0.32 -0.28 0.20 4.81 -1.43 0.17 114.58 118.75 3h0r h GLU 12 Ca 0.11 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 3h0r h GLU 12 Cb 0.23 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 3h0r h GLU 12 CO -0.01 0.21 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.33 3h0r h LEU 13 N 0.33 0.44 0.06 1.64 4.07 -1.23 -2.76 115.31 117.85 3h0r h LEU 13 Ca 0.26 -0.10 -0.26 0.00 0.08 0.00 0.00 57.88 57.86 3h0r h LEU 13 Cb 0.31 -0.12 0.02 0.00 1.08 0.00 0.00 40.66 41.96 3h0r h LEU 13 CO -0.28 0.57 -1.05 -0.07 -1.08 0.00 0.00 178.44 176.52 3h0r h LEU 14 N 0.43 0.83 -0.99 1.67 3.38 -0.20 -1.00 115.31 119.43 3h0r h LEU 14 Ca 0.09 -0.79 -0.08 0.00 0.09 0.00 0.00 57.88 57.18 3h0r h LEU 14 Cb 0.42 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3h0r h LEU 14 CO 0.02 1.52 -0.17 0.11 0.09 0.00 0.00 178.44 180.01 3h0r h LYS 15 N 0.24 0.53 -0.64 1.13 1.57 -0.67 -2.73 116.57 116.00 3h0r h LYS 15 Ca -0.15 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 3h0r h LYS 15 Cb 1.73 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 34.00 3h0r h LYS 15 CO 0.20 0.69 0.00 0.54 -0.57 0.00 0.00 179.45 180.31 3h0r n ARG 16 N -4.16 3.43 -0.66 3.15 1.74 -1.05 -4.94 116.66 114.17 3h0r n ARG 16 Ca 0.00 -2.50 0.00 0.00 -0.77 0.00 0.00 57.85 54.58 3h0r n ARG 16 Cb 0.36 -1.83 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 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 1.02 0.44 0.39 -0.13 0.00 -1.03 -4.82 105.19 101.06 3h0r n GLY 17 Ca 0.23 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.45 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 1.17 0.13 -4.36 1.61 5.08 -1.48 -3.42 114.58 113.31 3h0r h GLU 18 Ca 0.00 -0.01 -0.18 0.00 -1.00 0.00 0.00 59.36 58.17 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 0.00 179.01 177.94 3h0r s VAL 19 N -5.14 0.38 0.23 3.13 0.11 -0.83 -5.03 120.40 113.26 3h0r s VAL 19 Ca -0.06 -1.56 0.08 0.00 -2.93 0.00 0.00 61.98 57.51 3h0r s VAL 19 Cb 0.20 -1.18 -0.04 0.00 -1.53 0.00 0.00 36.38 33.83 3h0r s VAL 19 CO 0.75 -0.77 0.08 -0.94 -3.33 0.00 0.00 175.10 170.88 3h0r s SER 20 N -2.47 5.00 0.38 3.54 1.04 -1.26 -4.38 113.70 115.55 3h0r s SER 20 Ca 0.01 -0.42 0.09 0.00 0.48 0.00 0.00 55.95 56.12 3h0r s SER 20 Cb 0.01 -1.12 0.84 0.00 0.10 0.00 0.00 66.02 65.85 3h0r s SER 20 CO -0.05 0.01 1.93 -0.65 0.98 0.00 0.00 173.24 175.46 3h0r h PRO 21 N 1.97 0.64 -0.78 4.02 0.11 -1.89 -1.76 132.00 134.30 3h0r h PRO 21 Ca -0.47 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 3h0r h PRO 21 Cb 1.23 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 3h0r h PRO 21 CO 0.60 0.42 0.32 -0.22 -0.21 0.00 0.00 178.00 178.91 3h0r h LYS 22 N 0.65 1.15 -0.30 1.05 3.64 -1.89 -2.00 116.57 118.87 3h0r h LYS 22 Ca 0.36 -0.20 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 3h0r h LYS 22 Cb 0.52 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 3h0r h LYS 22 CO -0.14 0.92 0.03 0.93 -2.27 0.00 0.00 179.45 178.93 3h0r h GLU 23 N 1.13 0.51 -0.31 1.90 5.08 -1.74 0.35 114.58 121.51 3h0r h GLU 23 Ca 0.26 -0.15 0.06 0.00 -1.00 0.00 0.00 59.36 58.53 3h0r h GLU 23 Cb 0.19 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 3h0r h GLU 23 CO -0.02 0.63 -0.05 0.28 -1.00 0.00 0.00 179.01 178.85 3h0r h VAL 24 N 0.32 0.73 -0.30 3.13 2.07 -1.27 0.13 116.25 121.04 3h0r h VAL 24 Ca 0.09 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.60 3h0r h VAL 24 Cb 0.38 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3h0r h VAL 24 CO 0.01 0.01 0.19 0.58 0.02 0.00 0.00 177.57 178.38 3h0r h VAL 25 N 0.03 1.06 -0.69 2.57 2.07 -1.18 -2.49 116.25 117.62 3h0r h VAL 25 Ca 0.15 -0.14 0.13 0.00 0.82 0.00 0.00 66.70 67.66 3h0r h VAL 25 Cb 0.22 0.63 -0.09 0.00 -1.52 0.00 0.00 31.29 30.53 3h0r h VAL 25 CO -0.29 0.07 0.24 -0.33 0.02 0.00 0.00 177.57 177.29 3h0r h GLU 26 N 0.40 0.38 0.25 1.57 5.08 -0.24 0.33 114.58 122.35 3h0r h GLU 26 Ca 0.11 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3h0r h GLU 26 Cb -0.03 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3h0r h GLU 26 CO -0.03 0.25 -0.23 1.03 -1.00 0.00 0.00 179.01 179.03 3h0r h SER 27 N 0.39 -0.61 -0.21 1.42 0.87 -0.35 -0.20 113.55 114.86 3h0r h SER 27 Ca 0.37 0.06 -0.10 0.00 -1.23 0.00 0.00 61.79 60.88 3h0r h SER 27 Cb 0.54 0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.69 3h0r h SER 27 CO -0.39 -0.34 -0.20 -0.26 -0.53 0.00 0.00 176.83 175.11 3h0r h PHE 28 N -0.50 0.73 -0.58 2.24 0.04 -1.14 -2.56 116.94 115.16 3h0r h PHE 28 Ca -0.01 -0.15 0.10 0.00 2.80 0.00 0.00 57.97 60.72 3h0r h PHE 28 Cb 0.46 -0.18 -0.08 0.00 2.20 0.00 0.00 35.95 38.35 3h0r h PHE 28 CO -0.15 0.80 0.14 -0.92 -0.60 0.00 0.00 178.31 177.58 3h0r h TYR 29 N 0.58 0.22 -0.43 -0.55 5.03 0.02 0.25 116.97 122.09 3h0r h TYR 29 Ca 0.09 0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.39 3h0r h TYR 29 Cb 0.66 -0.01 -0.02 0.00 1.55 0.00 0.00 36.73 38.92 3h0r h TYR 29 CO 0.03 -0.01 0.11 -0.44 -1.32 0.00 0.00 178.16 176.54 3h0r h ASP 30 N 0.27 0.64 0.81 -2.11 3.32 -0.66 -0.45 116.42 118.25 3h0r h ASP 30 Ca 0.30 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 3h0r h ASP 30 Cb 0.43 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 3h0r h ASP 30 CO -0.37 0.70 -0.38 -0.09 -1.72 0.00 0.00 179.24 177.38 3h0r h ARG 31 N 0.55 0.00 0.15 3.56 9.65 -1.15 0.53 114.38 127.68 3h0r h ARG 31 Ca 0.14 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.02 3h0r h ARG 31 Cb 0.30 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.86 3h0r h ARG 31 CO -0.00 0.38 -0.15 -0.92 2.80 0.00 0.00 179.97 182.08 3h0r h TYR 32 N 0.00 -0.39 -0.89 2.20 3.20 -0.09 -2.66 116.97 118.34 3h0r h TYR 32 Ca -0.00 0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.95 3h0r h TYR 32 Cb 0.88 0.15 -0.06 0.00 1.54 0.00 0.00 36.73 39.24 3h0r h TYR 32 CO 0.00 -0.23 0.58 -0.91 -1.64 0.00 0.00 178.16 175.96 3h0r h ASN 33 N -0.33 0.86 -0.94 -2.11 2.35 0.05 -0.35 115.58 115.11 3h0r h ASN 33 Ca 0.00 0.01 0.06 0.00 -0.55 0.00 0.00 56.30 55.82 3h0r h ASN 33 Cb 0.31 -0.17 -0.06 0.00 0.05 0.00 0.00 38.32 38.45 3h0r h ASN 33 CO -0.04 0.54 0.60 1.56 -1.65 0.00 0.00 177.43 178.44 3h0r h GLN 34 N 0.97 1.08 0.00 0.81 4.20 -0.74 -3.37 115.11 118.05 3h0r h GLN 34 Ca 0.40 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.95 3h0r h GLN 34 Cb 0.28 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 3h0r h GLN 34 CO -0.16 0.71 -1.44 0.25 -0.67 0.00 0.00 178.83 177.53 3h0r n THR 35 N -4.54 0.36 0.10 -0.54 -2.24 -0.70 -4.73 114.28 101.99 3h0r n THR 35 Ca 0.14 -0.26 -0.03 0.00 -2.27 0.00 0.00 64.05 61.62 3h0r n THR 35 Cb 0.16 -0.54 0.16 0.00 -2.10 0.00 0.00 70.33 68.01 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 0.16 -0.49 -0.78 4.57 -1.26 -1.10 114.58 115.69 3h0r h GLU 36 Ca -0.14 -0.11 0.01 0.00 -1.18 0.00 0.00 59.36 57.94 3h0r h GLU 36 Cb 1.16 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.74 3h0r h GLU 36 CO 0.01 0.69 0.32 1.49 -1.18 0.00 0.00 179.01 180.34 3h0r h GLU 37 N 0.13 0.64 0.03 1.92 4.81 -1.83 0.17 114.58 120.45 3h0r h GLU 37 Ca -0.00 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.07 3h0r h GLU 37 Cb 1.04 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.26 3h0r h GLU 37 CO 0.08 0.42 -0.60 0.87 -0.73 0.00 0.00 179.01 179.05 3h0r h LYS 38 N 0.66 0.06 0.11 1.92 1.57 -1.61 -3.41 116.57 115.87 3h0r h LYS 38 Ca 0.18 -0.11 -0.16 0.00 -1.87 0.00 0.00 60.65 58.69 3h0r h LYS 38 Cb -0.07 0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.29 3h0r h LYS 38 CO -0.04 1.05 -0.71 0.28 -0.57 0.00 0.00 179.45 179.46 3h0r h VAL 39 N -0.84 1.52 -5.62 0.50 2.07 -1.19 -3.42 116.25 109.27 3h0r h VAL 39 Ca -0.15 -2.48 -0.30 0.00 0.82 0.00 0.00 66.70 64.59 3h0r h VAL 39 Cb 1.25 3.18 0.17 0.00 -1.52 0.00 0.00 31.29 34.37 3h0r h VAL 39 CO -0.03 0.69 -0.84 0.29 0.02 0.00 0.00 177.57 177.69 3h0r n LYS 40 N -4.21 -3.59 0.10 1.57 5.02 0.60 -0.93 118.16 116.72 3h0r n LYS 40 Ca -0.14 0.81 -0.05 0.00 -2.02 0.00 0.00 58.31 56.91 3h0r n LYS 40 Cb 0.76 -5.65 0.02 0.00 -0.02 0.00 0.00 35.03 30.13 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 0.34 0.64 -3.20 7.82 0.00 -1.88 -3.39 119.26 119.59 3h0r h ALA 41 Ca -0.61 -0.73 -0.66 0.00 0.00 0.00 0.00 54.91 52.91 3h0r h ALA 41 Cb 1.33 -0.12 -0.12 0.00 0.00 0.00 0.00 17.79 18.88 3h0r h ALA 41 CO 0.47 0.99 -0.60 0.71 0.00 0.00 0.00 179.25 180.82 3h0r s TYR 42 N -3.17 3.21 -0.18 0.00 1.51 -1.26 0.37 117.35 117.83 3h0r s TYR 42 Ca -0.01 0.17 -0.14 0.00 -1.01 0.00 0.00 57.07 56.08 3h0r s TYR 42 Cb 0.11 -1.73 -0.21 0.00 -0.11 0.00 0.00 41.96 40.02 3h0r s TYR 42 CO 0.80 0.52 0.22 -0.89 -1.11 0.00 0.00 175.55 175.08 3h0r n ILE 43 N 1.42 1.63 -3.72 2.71 5.41 0.98 -4.67 119.36 123.12 3h0r n ILE 43 Ca -0.15 -0.32 -0.30 0.00 1.00 0.00 0.00 62.75 62.99 3h0r n ILE 43 Cb 0.53 -1.89 -0.15 0.00 -0.71 0.00 0.00 39.64 37.42 3h0r n ILE 43 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 3h0r s THR 44 N -2.46 0.83 0.28 1.39 2.01 -0.69 -4.99 115.64 112.02 3h0r s THR 44 Ca -0.27 -1.37 -0.29 0.00 0.31 0.00 0.00 61.69 60.07 3h0r s THR 44 Cb 0.07 -1.64 -0.10 0.00 0.01 0.00 0.00 72.50 70.85 3h0r s THR 44 CO 0.65 -0.68 1.23 -2.16 -0.69 0.00 0.00 174.62 172.98 3h0r s PRO 45 N 1.64 4.47 -0.04 4.92 0.04 -1.26 0.14 135.00 144.90 3h0r s PRO 45 Ca 0.10 2.03 0.06 0.00 0.04 0.00 0.00 61.00 63.23 3h0r s PRO 45 Cb -0.17 -3.14 0.10 0.00 0.04 0.00 0.00 34.50 31.32 3h0r s PRO 45 CO -0.26 -0.06 0.96 1.28 0.04 0.00 0.00 177.00 178.96 3h0r n LEU 46 N 1.39 1.34 -0.28 -3.56 4.77 0.16 -4.79 117.00 116.04 3h0r n LEU 46 Ca 0.01 -1.80 0.03 0.00 -0.03 0.00 0.00 56.01 54.22 3h0r n LEU 46 Cb 0.43 -0.14 0.17 0.00 -2.33 0.00 0.00 43.42 41.55 3h0r n LEU 46 CO 0.57 0.43 1.12 1.88 -1.33 0.00 0.00 177.39 180.06 3h0r h TYR 47 N 0.00 0.81 -0.32 -1.77 -1.99 -1.75 0.15 116.97 112.10 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 0.94 -0.24 -0.07 0.00 2.00 0.00 0.00 36.73 39.36 3h0r h TYR 47 CO 0.02 0.31 -0.14 0.78 -0.00 0.00 0.00 178.16 179.13 3h0r h GLY 48 N 0.74 0.12 1.71 3.88 0.00 -1.90 0.20 103.07 107.82 3h0r h GLY 48 Ca 0.39 0.18 -0.13 0.00 0.00 0.00 0.00 47.33 47.78 3h0r h GLY 48 CO -0.26 -0.16 -0.49 1.70 0.00 0.00 0.00 176.54 177.32 3h0r h LYS 49 N -0.09 0.31 -0.25 4.80 3.64 -1.61 -2.95 116.57 120.41 3h0r h LYS 49 Ca 0.16 -0.18 -0.15 0.00 -1.27 0.00 0.00 60.65 59.22 3h0r h LYS 49 Cb 0.34 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 3h0r h LYS 49 CO -0.38 0.74 -0.45 0.00 -2.27 0.00 0.00 179.45 177.09 3h0r h ALA 50 N 1.24 0.74 -0.44 5.00 0.00 -0.10 -1.58 119.26 124.12 3h0r h ALA 50 Ca 0.01 -0.47 0.09 0.00 0.00 0.00 0.00 54.91 54.54 3h0r h ALA 50 Cb 0.96 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 3h0r h ALA 50 CO 0.08 0.66 -0.02 -0.07 0.00 0.00 0.00 179.25 179.90 3h0r h LEU 51 N 0.52 -0.23 -0.61 0.00 4.07 -0.46 -0.40 115.31 118.19 3h0r h LEU 51 Ca 0.03 0.11 -0.08 0.00 0.08 0.00 0.00 57.88 58.03 3h0r h LEU 51 Cb 0.98 0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.90 3h0r h LEU 51 CO 0.09 -0.08 0.08 0.11 -1.08 0.00 0.00 178.44 177.56 3h0r h LYS 52 N 0.09 1.03 0.00 1.13 1.57 -1.40 -2.87 116.57 116.12 3h0r h LYS 52 Ca 0.22 -0.29 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 3h0r h LYS 52 Cb 0.33 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3h0r h LYS 52 CO -0.39 0.98 -0.24 1.96 -0.57 0.00 0.00 179.45 181.19 3h0r h GLN 53 N 0.94 0.00 -0.20 3.15 4.20 -0.87 -3.00 115.11 119.33 3h0r h GLN 53 Ca 0.18 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.80 3h0r h GLN 53 Cb 0.46 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 3h0r h GLN 53 CO 0.02 0.24 -0.27 0.00 -0.67 0.00 0.00 178.83 178.15 3h0r h ALA 54 N 1.76 1.17 -0.91 3.87 0.00 -0.85 -2.96 119.26 121.34 3h0r h ALA 54 Ca -0.00 -0.34 0.11 0.00 0.00 0.00 0.00 54.91 54.68 3h0r h ALA 54 Cb 0.61 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 3h0r h ALA 54 CO 0.03 0.53 0.59 0.93 0.00 0.00 0.00 179.25 181.33 3h0r h GLU 55 N 0.34 0.84 -0.02 0.00 5.08 -1.55 -1.91 114.58 117.37 3h0r h GLU 55 Ca 0.05 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3h0r h GLU 55 Cb 0.66 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3h0r h GLU 55 CO 0.05 0.56 -0.02 -1.13 -1.00 0.00 0.00 179.01 177.47 3h0r n SER 56 N -4.55 1.60 -4.66 1.42 3.41 -1.12 -4.86 113.62 104.85 3h0r n SER 56 Ca 0.16 -1.50 -0.41 0.00 -0.26 0.00 0.00 58.87 56.86 3h0r n SER 56 Cb 0.34 0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.26 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 -2.04 4.14 0.01 1.04 0.20 -0.72 -4.89 118.68 116.42 3h0r s LEU 57 Ca 0.36 1.08 0.00 0.00 0.69 0.00 0.00 54.13 56.26 3h0r s LEU 57 Cb 0.21 -3.16 0.00 0.00 -0.43 0.00 0.00 46.19 42.80 3h0r s LEU 57 CO 0.35 -0.41 0.00 0.29 -0.29 0.00 0.00 176.35 176.29 3h0r n LYS 58 N 5.41 0.00 -2.06 1.98 4.76 -1.26 -4.94 118.16 122.05 3h0r n LYS 58 Ca 0.04 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.08 3h0r n LYS 58 Cb 0.49 -0.34 -0.03 0.00 -1.84 0.00 0.00 35.03 33.30 3h0r n LYS 58 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3h0r s GLU 59 N -2.00 2.83 0.45 1.97 -6.30 -1.26 -4.86 118.70 109.53 3h0r s GLU 59 Ca 0.00 0.78 0.25 0.00 -2.50 0.00 0.00 54.97 53.50 3h0r s GLU 59 Cb 0.00 -4.33 0.87 0.00 0.00 0.00 0.00 34.13 30.68 3h0r s GLU 59 CO 0.00 -2.48 1.80 0.00 0.02 0.00 0.00 175.26 174.60 3h0r h ARG 60 N 14.23 0.00 -0.00 4.30 3.08 -1.94 -3.17 114.38 130.88 3h0r h ARG 60 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.77 3h0r h ARG 60 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 3h0r h ARG 60 CO 1.17 0.17 -0.01 -1.91 -1.07 0.00 0.00 179.97 178.33 3h0r n GLU 61 N -3.26 1.02 -1.84 0.04 2.13 -1.26 -4.66 120.64 112.80 3h0r n GLU 61 Ca 0.01 -0.14 -0.42 0.00 0.66 0.00 0.00 57.16 57.27 3h0r n GLU 61 Cb 0.44 -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 -2.08 4.37 0.41 4.31 1.02 -1.20 -4.89 118.68 120.61 3h0r s LEU 62 Ca 0.44 2.79 0.21 0.00 0.02 0.00 0.00 54.13 57.58 3h0r s LEU 62 Cb 0.22 -3.61 1.16 0.00 0.02 0.00 0.00 46.19 43.98 3h0r s LEU 62 CO 0.38 -0.88 1.75 -0.65 0.02 0.00 0.00 176.35 176.97 3h0r h PRO 63 N 6.09 0.33 -0.27 1.29 0.11 -1.88 0.11 132.00 137.78 3h0r h PRO 63 Ca -0.44 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.46 3h0r h PRO 63 Cb 1.21 -0.07 -0.14 0.00 0.11 0.00 0.00 31.00 32.11 3h0r h PRO 63 CO 0.88 0.22 -0.51 1.28 -0.21 0.00 0.00 178.00 179.66 3h0r n LEU 64 N -4.63 3.60 -0.15 2.35 4.77 0.93 -4.98 117.00 118.89 3h0r n LEU 64 Ca 0.27 -4.13 -0.02 0.00 -0.03 0.00 0.00 56.01 52.10 3h0r n LEU 64 Cb 0.97 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 41.55 3h0r n LEU 64 CO 0.25 1.58 0.19 0.33 -1.33 0.00 0.00 177.39 178.41 3h0r n PHE 65 N -1.01 -0.09 -1.38 -1.77 7.35 0.36 -1.13 117.46 119.80 3h0r n PHE 65 Ca 0.29 0.45 0.07 0.00 -0.76 0.00 0.00 57.45 57.49 3h0r n PHE 65 Cb 0.81 -0.57 0.11 0.00 0.35 0.00 0.00 39.48 40.18 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 -1.12 3.79 3.67 7.13 0.00 -1.26 -4.42 105.19 112.98 3h0r n GLY 66 Ca 0.02 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.17 4.81 0.43 -0.61 -1.09 -0.29 -4.77 121.20 117.53 3h0r s ILE 67 Ca 0.25 1.78 -0.24 0.00 -2.23 0.00 0.00 60.65 60.22 3h0r s ILE 67 Cb 0.23 -4.20 -0.08 0.00 -1.58 0.00 0.00 42.46 36.83 3h0r s ILE 67 CO 0.01 -0.04 1.17 -2.84 -1.23 0.00 0.00 174.94 172.01 3h0r s PRO 68 N 2.46 3.88 -0.08 2.79 0.02 -1.26 -0.43 135.00 142.39 3h0r s PRO 68 Ca 0.41 1.80 -0.03 0.00 0.02 0.00 0.00 61.00 63.19 3h0r s PRO 68 Cb -0.16 -2.52 0.04 0.00 0.02 0.00 0.00 34.50 31.88 3h0r s PRO 68 CO 0.11 -0.45 0.17 -1.50 -0.33 0.00 0.00 177.00 175.00 3h0r s ILE 69 N -1.49 -0.12 0.40 2.83 2.07 -0.42 -4.41 121.20 120.05 3h0r s ILE 69 Ca 0.61 0.22 -0.17 0.00 -1.41 0.00 0.00 60.65 59.90 3h0r s ILE 69 Cb -0.29 -0.29 -0.09 0.00 0.13 0.00 0.00 42.46 41.91 3h0r s ILE 69 CO 0.36 0.09 0.87 0.00 -1.91 0.00 0.00 174.94 174.35 3h0r s ALA 70 N 1.54 3.17 -0.04 1.50 0.00 -1.15 -1.65 121.76 125.12 3h0r s ALA 70 Ca -0.06 0.19 0.01 0.00 0.00 0.00 0.00 51.96 52.11 3h0r s ALA 70 Cb -0.12 -2.97 0.02 0.00 0.00 0.00 0.00 23.12 20.05 3h0r s ALA 70 CO -0.06 0.13 -0.06 0.08 0.00 0.00 0.00 175.76 175.85 3h0r s VAL 71 N -2.20 0.61 0.38 0.00 1.01 -0.39 -1.42 120.40 118.40 3h0r s VAL 71 Ca 0.58 -0.18 -0.27 0.00 0.00 0.00 0.00 61.98 62.11 3h0r s VAL 71 Cb -0.10 -0.61 -0.11 0.00 0.00 0.00 0.00 36.38 35.56 3h0r s VAL 71 CO 0.19 0.23 1.32 1.17 0.00 0.00 0.00 175.10 178.02 3h0r n LYS 72 N 3.92 2.16 -0.13 2.72 4.81 -0.83 0.05 118.16 130.85 3h0r n LYS 72 Ca -0.24 0.76 -0.02 0.00 -0.87 0.00 0.00 58.31 57.94 3h0r n LYS 72 Cb 0.51 -2.42 0.03 0.00 0.02 0.00 0.00 35.03 33.17 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 0.45 2.72 -0.31 3.14 2.03 -0.88 -1.58 116.55 122.12 3h0r n ASP 73 Ca 0.05 -2.17 0.03 0.00 0.52 0.00 0.00 54.79 53.22 3h0r n ASP 73 Cb 0.38 -0.53 0.06 0.00 -0.72 0.00 0.00 41.12 40.31 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 0.25 2.09 -4.62 1.67 6.94 -1.26 -0.59 115.26 119.74 3h0r n ASN 74 Ca 0.06 -1.68 -0.35 0.00 -0.02 0.00 0.00 54.58 52.59 3h0r n ASN 74 Cb 0.57 -0.07 -0.10 0.00 -2.36 0.00 0.00 39.78 37.82 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 -0.79 4.73 -0.11 1.53 1.01 -0.61 -0.75 121.20 126.20 3h0r s ILE 75 Ca 0.10 -0.05 -0.30 0.00 0.00 0.00 0.00 60.65 60.40 3h0r s ILE 75 Cb 0.06 -3.13 -0.02 0.00 0.01 0.00 0.00 42.46 39.38 3h0r s ILE 75 CO 0.08 0.45 1.13 -0.76 0.00 0.00 0.00 174.94 175.85 3h0r s LEU 76 N 0.44 4.23 -0.19 2.97 1.02 -0.18 -4.90 118.68 122.07 3h0r s LEU 76 Ca 0.03 1.66 0.00 0.00 0.02 0.00 0.00 54.13 55.84 3h0r s LEU 76 Cb -0.13 -3.55 0.02 0.00 0.02 0.00 0.00 46.19 42.55 3h0r s LEU 76 CO 0.01 -0.57 -0.16 -0.69 0.02 0.00 0.00 176.35 174.95 3h0r s VAL 77 N 2.43 2.31 0.26 -1.59 1.01 -1.26 -1.11 120.40 122.45 3h0r s VAL 77 Ca 0.52 -0.91 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 3h0r s VAL 77 Cb -0.21 -2.02 -0.10 0.00 0.00 0.00 0.00 36.38 34.05 3h0r s VAL 77 CO 0.18 0.47 1.38 -0.70 0.00 0.00 0.00 175.10 176.43 3h0r s GLU 78 N 1.31 4.31 0.00 2.72 2.12 -1.23 -2.41 118.70 125.52 3h0r s GLU 78 Ca 0.04 2.23 0.00 0.00 0.36 0.00 0.00 54.97 57.60 3h0r s GLU 78 Cb -0.14 -3.11 0.00 0.00 0.26 0.00 0.00 34.13 31.14 3h0r s GLU 78 CO -0.11 -0.32 0.00 0.41 -0.54 0.00 0.00 175.26 174.70 3h0r n GLY 79 N 1.84 1.84 3.55 -1.50 0.00 0.01 -4.97 105.19 105.95 3h0r n GLY 79 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.53 1.97 0.35 1.61 0.41 -1.01 -4.83 118.70 116.66 3h0r s GLU 80 Ca 0.00 -1.36 -0.29 0.00 -0.41 0.00 0.00 54.97 52.92 3h0r s GLU 80 Cb 0.00 -2.08 -0.11 0.00 -1.78 0.00 0.00 34.13 30.15 3h0r s GLU 80 CO 0.00 0.41 1.53 0.15 -0.49 0.00 0.00 175.26 176.87 3h0r s LYS 81 N -2.93 4.10 -0.32 1.61 1.02 -1.26 -1.90 119.74 120.06 3h0r s LYS 81 Ca 0.25 2.59 0.01 0.00 0.02 0.00 0.00 55.97 58.84 3h0r s LYS 81 Cb -0.08 -2.98 0.10 0.00 -0.52 0.00 0.00 37.83 34.34 3h0r s LYS 81 CO 0.15 -0.58 0.08 0.99 -0.92 0.00 0.00 175.35 175.07 3h0r s THR 82 N -0.74 1.37 -0.14 2.17 2.01 -0.54 -4.86 115.64 114.91 3h0r s THR 82 Ca 0.56 -1.71 0.22 0.00 0.31 0.00 0.00 61.69 61.08 3h0r s THR 82 Cb -0.47 -2.01 -0.23 0.00 0.01 0.00 0.00 72.50 69.79 3h0r s THR 82 CO 0.58 -0.63 0.67 0.35 -0.69 0.00 0.00 174.62 174.90 3h0r n THR 83 N 4.64 0.18 -2.33 -0.82 -2.24 -1.22 -4.68 114.28 107.80 3h0r n THR 83 Ca -0.00 -0.49 -0.11 0.00 -2.27 0.00 0.00 64.05 61.18 3h0r n THR 83 Cb 0.42 -0.06 -0.01 0.00 -2.10 0.00 0.00 70.33 68.58 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 -2.00 -1.25 -2.39 0.00 0.00 -1.26 -1.20 120.51 112.41 3h0r n ALA 85 Ca -0.13 0.09 -0.29 0.00 0.00 0.00 0.00 53.44 53.11 3h0r n ALA 85 Cb 0.57 -3.95 -0.15 0.00 0.00 0.00 0.00 19.45 15.93 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 -3.27 2.90 0.40 0.00 0.15 0.71 -1.65 113.70 112.93 3h0r s SER 86 Ca 0.71 -0.55 0.07 0.00 0.70 0.00 0.00 55.95 56.89 3h0r s SER 86 Cb -0.38 -0.27 0.83 0.00 -1.71 0.00 0.00 66.02 64.50 3h0r s SER 86 CO 0.88 0.23 2.02 0.11 1.20 0.00 0.00 173.24 177.68 3h0r h LYS 87 N 4.93 0.60 0.00 5.44 1.79 -1.84 -1.11 116.57 126.37 3h0r h LYS 87 Ca -0.45 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 3h0r h LYS 87 Cb 1.15 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.66 3h0r h LYS 87 CO 0.44 0.40 0.00 0.97 -1.08 0.00 0.00 179.45 180.18 3h0r h ILE 88 N 0.62 0.00 0.00 1.86 2.10 -1.78 -3.17 117.51 117.14 3h0r h ILE 88 Ca 0.21 -0.34 0.00 0.00 1.08 0.00 0.00 64.86 65.81 3h0r h ILE 88 Cb 0.08 1.17 0.00 0.00 -1.09 0.00 0.00 36.82 36.98 3h0r h ILE 88 CO -0.05 0.00 -0.13 0.18 -1.08 0.00 0.00 178.15 177.07 3h0r n LEU 89 N -2.43 1.06 -4.75 2.19 4.32 -0.99 -1.06 117.00 115.34 3h0r n LEU 89 Ca 0.02 -1.49 -0.41 0.00 -0.02 0.00 0.00 56.01 54.11 3h0r n LEU 89 Cb 0.28 -0.10 -0.04 0.00 -1.62 0.00 0.00 43.42 41.94 3h0r n LEU 89 CO 0.23 0.36 0.87 -1.83 -1.22 0.00 0.00 177.39 175.80 3h0r s GLU 90 N -0.94 4.52 0.00 3.23 -1.05 -0.46 -2.33 118.70 121.68 3h0r s GLU 90 Ca 0.08 1.92 0.00 0.00 -0.15 0.00 0.00 54.97 56.82 3h0r s GLU 90 Cb 0.07 -3.18 0.00 0.00 -0.44 0.00 0.00 34.13 30.58 3h0r s GLU 90 CO 0.01 0.01 0.00 0.09 0.95 0.00 0.00 175.26 176.32 3h0r n ASN 91 N 1.60 0.00 -4.62 0.83 3.02 -1.26 -4.67 115.26 110.16 3h0r n ASN 91 Ca 0.01 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.13 3h0r n ASN 91 Cb 0.44 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.59 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 -3.50 2.67 -0.17 3.10 5.36 -0.98 -4.91 117.98 119.55 3h0r s PHE 92 Ca 0.00 0.84 -0.18 0.00 -0.96 0.00 0.00 56.93 56.64 3h0r s PHE 92 Cb 0.00 -4.00 -0.04 0.00 -0.34 0.00 0.00 43.02 38.65 3h0r s PHE 92 CO 0.00 -1.68 0.48 0.08 -1.46 0.00 0.00 175.22 172.64 3h0r s VAL 93 N 4.52 5.16 -0.07 3.12 1.01 -1.26 -1.46 120.40 131.41 3h0r s VAL 93 Ca 0.56 0.90 -0.30 0.00 0.00 0.00 0.00 61.98 63.15 3h0r s VAL 93 Cb -0.15 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 3h0r s VAL 93 CO 0.25 0.25 1.56 0.00 0.00 0.00 0.00 175.10 177.16 3h0r s ALA 94 N 1.20 3.63 -1.37 5.51 0.00 -0.80 -4.88 121.76 125.04 3h0r s ALA 94 Ca 0.24 0.85 0.27 0.00 0.00 0.00 0.00 51.96 53.32 3h0r s ALA 94 Cb -0.15 -3.71 1.35 0.00 0.00 0.00 0.00 23.12 20.61 3h0r s ALA 94 CO 0.09 -1.32 1.93 -2.30 0.00 0.00 0.00 175.76 174.16 3h0r n PRO 95 N 6.90 0.34 -3.81 0.00 -0.02 -1.26 -0.80 135.00 136.34 3h0r n PRO 95 Ca 0.16 0.03 -0.09 0.00 -2.02 0.00 0.00 63.50 61.59 3h0r n PRO 95 Cb 0.43 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.38 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 -2.63 -0.09 -0.09 6.00 1.13 -1.26 -4.92 117.35 115.48 3h0r s TYR 96 Ca 0.24 -0.29 -0.16 0.00 -1.41 0.00 0.00 57.07 55.45 3h0r s TYR 96 Cb 0.18 0.50 -0.05 0.00 -1.10 0.00 0.00 41.96 41.50 3h0r s TYR 96 CO 0.43 -1.06 0.41 -0.51 -2.51 0.00 0.00 175.55 172.31 3h0r s ASP 97 N -2.91 6.66 0.32 -0.18 1.01 -1.26 -3.51 116.67 116.80 3h0r s ASP 97 Ca 0.12 0.78 -0.25 0.00 0.71 0.00 0.00 52.55 53.91 3h0r s ASP 97 Cb -0.03 -2.25 -0.15 0.00 1.01 0.00 0.00 42.92 41.50 3h0r s ASP 97 CO 0.03 0.12 0.54 0.00 0.21 0.00 0.00 175.17 176.07 3h0r n ALA 98 N 3.08 -2.01 -0.36 5.23 0.00 -0.27 -4.81 120.51 121.37 3h0r n ALA 98 Ca -0.10 0.29 0.03 0.00 0.00 0.00 0.00 53.44 53.66 3h0r n ALA 98 Cb 0.52 -1.71 0.17 0.00 0.00 0.00 0.00 19.45 18.44 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 1.00 1.05 -0.76 0.00 2.02 -1.47 -1.00 112.91 113.75 3h0r h THR 99 Ca -0.35 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 66.45 3h0r h THR 99 Cb 1.41 -0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 67.64 3h0r h THR 99 CO 0.54 0.20 0.47 -0.37 0.37 0.00 0.00 175.52 176.73 3h0r h VAL 100 N 1.11 1.21 -0.12 3.16 -1.51 -1.85 -1.33 116.25 116.91 3h0r h VAL 100 Ca 0.43 -0.44 -0.20 0.00 -1.23 0.00 0.00 66.70 65.26 3h0r h VAL 100 Cb 0.21 0.13 0.00 0.00 -2.13 0.00 0.00 31.29 29.50 3h0r h VAL 100 CO -0.19 0.21 -0.73 0.40 -1.23 0.00 0.00 177.57 176.03 3h0r h ILE 101 N 1.04 1.33 -0.63 7.19 1.08 -1.55 -0.46 117.51 125.51 3h0r h ILE 101 Ca 0.27 -2.04 0.04 0.00 -0.39 0.00 0.00 64.86 62.74 3h0r h ILE 101 Cb -0.06 2.03 -0.05 0.00 -3.07 0.00 0.00 36.82 35.67 3h0r h ILE 101 CO -0.05 0.63 0.37 -0.08 -0.69 0.00 0.00 178.15 178.32 3h0r h GLU 102 N 0.40 0.68 0.00 2.37 4.81 -1.02 -0.94 114.58 120.88 3h0r h GLU 102 Ca -0.04 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.01 3h0r h GLU 102 Cb 1.33 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.54 3h0r h GLU 102 CO 0.14 0.45 -0.67 0.00 -0.73 0.00 0.00 179.01 178.20 3h0r h ARG 103 N 0.70 0.00 -0.15 1.92 3.08 -0.91 -1.49 114.38 117.53 3h0r h ARG 103 Ca 0.27 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.20 3h0r h ARG 103 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 3h0r h ARG 103 CO -0.14 0.67 -0.35 -0.07 -1.07 0.00 0.00 179.97 179.01 3h0r h LEU 104 N 0.00 0.57 -0.76 3.04 3.38 -0.90 -2.84 115.31 117.81 3h0r h LEU 104 Ca -0.01 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 57.39 3h0r h LEU 104 Cb 1.21 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 3h0r h LEU 104 CO 0.09 1.04 0.45 0.11 0.09 0.00 0.00 178.44 180.22 3h0r h LYS 105 N 0.14 1.04 0.00 1.13 1.57 -1.07 -0.58 116.57 118.80 3h0r h LYS 105 Ca 0.00 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 3h0r h LYS 105 Cb 0.95 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.05 3h0r h LYS 105 CO 0.08 0.74 -0.04 -0.22 -0.57 0.00 0.00 179.45 179.43 3h0r h LYS 106 N 1.04 0.00 -0.14 3.15 3.64 -1.31 -2.18 116.57 120.77 3h0r h LYS 106 Ca 0.27 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 3h0r h LYS 106 Cb -0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3h0r h LYS 106 CO -0.05 0.04 0.00 0.00 -2.27 0.00 0.00 179.45 177.17 3h0r n ALA 107 N -2.15 2.51 -0.42 5.00 0.00 -0.32 -4.92 120.51 120.21 3h0r n ALA 107 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.82 3h0r n ALA 107 Cb 0.22 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 1.25 0.75 3.69 0.00 0.00 -0.82 -0.05 105.19 110.01 3h0r n GLY 108 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.86 1.55 -0.21 4.61 0.00 -0.65 -4.09 121.76 120.12 3h0r s ALA 109 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.34 3h0r s ALA 109 Cb 0.00 -3.36 0.05 0.00 0.00 0.00 0.00 23.12 19.81 3h0r s ALA 109 CO 0.00 -2.52 -0.07 -0.51 0.00 0.00 0.00 175.76 172.66 3h0r s LEU 110 N -6.42 2.24 -0.21 0.00 1.43 0.43 -4.61 118.68 111.55 3h0r s LEU 110 Ca 0.65 -0.97 -0.29 0.00 -1.03 0.00 0.00 54.13 52.49 3h0r s LEU 110 Cb -0.21 -1.13 -0.04 0.00 0.03 0.00 0.00 46.19 44.85 3h0r s LEU 110 CO 0.58 -0.20 1.79 -0.63 0.23 0.00 0.00 176.35 178.12 3h0r s ILE 111 N 1.46 3.46 -2.04 -0.59 1.09 -1.26 -1.30 121.20 122.01 3h0r s ILE 111 Ca -0.03 0.51 0.23 0.00 -1.10 0.00 0.00 60.65 60.26 3h0r s ILE 111 Cb -0.17 -3.50 -0.01 0.00 -1.06 0.00 0.00 42.46 37.72 3h0r s ILE 111 CO -0.07 -0.23 1.10 1.33 -0.10 0.00 0.00 174.94 176.96 3h0r n VAL 112 N 6.69 0.00 0.00 2.92 0.24 -0.66 -4.57 118.33 122.96 3h0r n VAL 112 Ca 0.21 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 3h0r n VAL 112 Cb 0.45 1.24 0.00 0.00 -1.47 0.00 0.00 33.84 34.06 3h0r n VAL 112 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h0r n GLY 113 N 1.42 1.79 3.51 7.63 0.00 -1.26 0.39 105.19 118.68 3h0r n GLY 113 Ca 0.09 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 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 0.08 1.61 -0.14 0.12 -1.26 119.74 121.91 3h0r s LYS 114 Ca 0.00 -0.44 -0.11 0.00 -1.36 0.00 0.00 55.97 54.06 3h0r s LYS 114 Cb 0.00 -3.26 -0.06 0.00 -1.68 0.00 0.00 37.83 32.83 3h0r s LYS 114 CO 0.00 -0.01 0.43 0.99 -0.76 0.00 0.00 175.35 176.01 3h0r s THR 115 N 1.12 5.04 0.65 2.17 2.01 0.11 -0.02 115.64 126.72 3h0r s THR 115 Ca 0.04 0.57 -0.18 0.00 0.31 0.00 0.00 61.69 62.44 3h0r s THR 115 Cb -0.14 -3.67 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 3h0r s THR 115 CO 0.03 0.32 1.25 0.21 -0.69 0.00 0.00 174.62 175.73 3h0r s ASN 116 N -1.67 4.69 0.19 3.53 2.47 0.16 -2.07 114.94 122.24 3h0r s ASN 116 Ca 0.33 2.49 -0.14 0.00 0.42 0.00 0.00 52.86 55.96 3h0r s ASN 116 Cb -0.14 -2.61 0.01 0.00 -1.45 0.00 0.00 41.25 37.06 3h0r s ASN 116 CO 0.18 -1.94 0.44 -1.48 -3.72 0.00 0.00 177.10 170.58 3h0r s LEU 117 N -4.45 0.38 0.53 3.21 2.34 -1.26 -2.21 118.68 117.23 3h0r s LEU 117 Ca 0.79 -0.65 -0.22 0.00 0.06 0.00 0.00 54.13 54.12 3h0r s LEU 117 Cb -0.33 1.81 -0.05 0.00 -0.56 0.00 0.00 46.19 47.05 3h0r s LEU 117 CO 0.39 -1.01 1.28 -1.81 -1.06 0.00 0.00 176.35 174.14 3h0r s ASP 118 N -2.92 5.47 0.05 1.48 1.01 -1.14 -3.37 116.67 117.26 3h0r s ASP 118 Ca 0.13 2.59 -0.32 0.00 0.71 0.00 0.00 52.55 55.66 3h0r s ASP 118 Cb 0.00 -2.62 -0.11 0.00 1.01 0.00 0.00 42.92 41.20 3h0r s ASP 118 CO -0.01 -1.42 1.87 1.21 0.21 0.00 0.00 175.17 177.03 3h0r n GLU 119 N -0.99 2.61 -2.59 8.23 2.13 -0.68 -0.79 120.64 128.57 3h0r n GLU 119 Ca 0.10 0.95 -0.19 0.00 0.66 0.00 0.00 57.16 58.69 3h0r n GLU 119 Cb 0.46 -2.84 -0.00 0.00 0.27 0.00 0.00 31.44 29.33 3h0r n GLU 119 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 3h0r n PHE 120 N 6.22 -1.35 -2.11 4.31 3.72 -0.34 -2.50 117.46 125.42 3h0r n PHE 120 Ca 0.20 0.12 -0.20 0.00 -0.05 0.00 0.00 57.45 57.52 3h0r n PHE 120 Cb 0.36 -3.62 -0.04 0.00 -0.94 0.00 0.00 39.48 35.24 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 -2.45 -0.50 -3.54 4.37 0.00 0.03 -4.82 120.51 113.60 3h0r n ALA 121 Ca -0.18 0.22 -0.41 0.00 0.00 0.00 0.00 53.44 53.07 3h0r n ALA 121 Cb 0.64 -2.10 -0.08 0.00 0.00 0.00 0.00 19.45 17.91 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 -4.56 2.51 0.00 0.00 -1.94 -1.04 -4.66 119.30 109.62 3h0r s MET 122 Ca 0.00 -1.78 0.00 0.00 -1.71 0.00 0.00 55.69 52.20 3h0r s MET 122 Cb 0.00 -3.95 0.00 0.00 2.01 0.00 0.00 34.83 32.89 3h0r s MET 122 CO 0.00 -1.20 0.00 0.41 -0.01 0.00 0.00 175.02 174.22 3h0r n GLY 123 N 4.91 1.16 1.11 -0.03 0.00 -1.26 -4.49 105.19 106.59 3h0r n GLY 123 Ca -0.08 -1.61 0.04 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.49 113.62 120.28 3h0r n SER 124 Ca 0.00 -2.57 0.00 0.00 1.01 0.00 0.00 58.87 57.31 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 -0.07 0.00 0.00 6.43 3.41 -1.24 -2.52 113.62 119.63 3h0r n SER 125 Ca 0.09 -0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 3h0r n SER 125 Cb 0.96 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.91 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 0.15 6.66 -1.04 -1.15 -4.16 114.28 114.74 3h0r n THR 126 Ca 0.00 0.00 0.19 0.00 -2.04 0.00 0.00 64.05 62.20 3h0r n THR 126 Cb 0.06 -0.03 0.79 0.00 -1.82 0.00 0.00 70.33 69.33 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 1.38 0.00 -0.31 -2.82 5.08 -1.89 -0.53 114.58 115.49 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 -3.71 0.38 -1.67 4.33 4.01 -1.26 -4.78 117.16 114.47 3h0r n TYR 128 Ca 0.04 -0.18 -0.46 0.00 -0.16 0.00 0.00 57.90 57.14 3h0r n TYR 128 Cb 0.48 -0.02 -0.04 0.00 -0.31 0.00 0.00 39.34 39.45 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 0.27 3.10 0.05 7.72 2.88 -0.21 -1.68 113.62 125.75 3h0r n SER 129 Ca 0.09 1.08 0.08 0.00 -1.33 0.00 0.00 58.87 58.79 3h0r n SER 129 Cb 0.25 -1.43 0.34 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 3.37 1.52 -0.10 -1.46 0.00 -0.66 -4.01 120.51 119.17 3h0r n ALA 130 Ca 0.17 0.02 -0.22 0.00 0.00 0.00 0.00 53.44 53.41 3h0r n ALA 130 Cb 0.29 -1.25 -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 -1.77 0.00 -3.62 0.00 3.72 -1.26 -4.92 117.46 109.60 3h0r n PHE 131 Ca 0.02 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.38 3h0r n PHE 131 Cb 0.15 -0.72 -0.04 0.00 -0.94 0.00 0.00 39.48 37.93 3h0r n PHE 131 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 3h0r s PHE 132 N -2.37 -0.12 0.36 1.38 -0.71 -1.26 -5.15 117.98 110.12 3h0r s PHE 132 Ca -0.28 0.18 -0.27 0.00 -1.04 0.00 0.00 56.93 55.52 3h0r s PHE 132 Cb 0.11 0.49 -0.09 0.00 -1.21 0.00 0.00 43.02 42.32 3h0r s PHE 132 CO 0.35 -0.12 1.19 -1.25 -1.34 0.00 0.00 175.22 174.05 3h0r s PRO 133 N -1.29 4.24 0.24 1.99 0.04 -1.26 -4.67 135.00 134.28 3h0r s PRO 133 Ca 0.07 1.92 -0.13 0.00 0.04 0.00 0.00 61.00 62.90 3h0r s PRO 133 Cb -0.01 -2.86 -0.08 0.00 0.04 0.00 0.00 34.50 31.59 3h0r s PRO 133 CO -0.05 -0.19 0.62 0.99 0.04 0.00 0.00 177.00 178.41 3h0r s THR 134 N -1.30 4.81 0.00 1.26 2.01 -1.26 -4.81 115.64 116.35 3h0r s THR 134 Ca 0.53 0.76 0.05 0.00 0.31 0.00 0.00 61.69 63.34 3h0r s THR 134 Cb -0.33 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 3h0r s THR 134 CO 0.42 -0.00 -0.14 -0.54 -0.69 0.00 0.00 174.62 173.67 3h0r s LYS 135 N -2.59 2.32 -0.07 4.92 1.02 -0.11 -4.36 119.74 120.88 3h0r s LYS 135 Ca 0.47 -0.83 -0.30 0.00 0.02 0.00 0.00 55.97 55.33 3h0r s LYS 135 Cb -0.12 -2.32 -0.06 0.00 -0.52 0.00 0.00 37.83 34.81 3h0r s LYS 135 CO 0.20 0.58 1.70 1.21 -0.92 0.00 0.00 175.35 178.12 3h0r s ASN 136 N -1.21 6.57 0.00 2.83 3.84 0.28 -4.72 114.94 122.53 3h0r s ASN 136 Ca 0.14 2.20 0.11 0.00 0.21 0.00 0.00 52.86 55.52 3h0r s ASN 136 Cb -0.11 -2.53 0.51 0.00 -0.55 0.00 0.00 41.25 38.57 3h0r s ASN 136 CO 0.04 -1.01 1.27 -0.81 -2.79 0.00 0.00 177.10 173.81 3h0r n PRO 137 N 7.28 0.10 0.00 0.43 -0.04 -1.26 -1.27 135.00 140.25 3h0r n PRO 137 Ca 0.18 0.23 0.11 0.00 -0.04 0.00 0.00 63.50 63.98 3h0r n PRO 137 Cb 0.43 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.36 0.02 -3.15 0.54 7.02 -1.26 -4.11 117.44 115.14 3h0r n TRP 138 Ca 0.04 0.01 0.05 0.00 -1.02 0.00 0.00 57.50 56.58 3h0r n TRP 138 Cb 0.10 -0.11 -0.01 0.00 -2.42 0.00 0.00 31.31 28.87 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 -3.16 -0.60 0.00 -0.99 -1.08 -0.40 -4.90 116.67 105.54 3h0r s ASP 139 Ca 0.07 0.20 0.15 0.00 -0.52 0.00 0.00 52.55 52.45 3h0r s ASP 139 Cb 0.16 1.43 0.82 0.00 -1.46 0.00 0.00 42.92 43.88 3h0r s ASP 139 CO 0.83 -0.11 1.34 0.18 0.52 0.00 0.00 175.17 177.93 3h0r n LEU 140 N 5.30 0.00 -0.07 -1.34 4.77 -0.86 0.15 117.00 124.95 3h0r n LEU 140 Ca 0.02 0.11 0.15 0.00 -0.03 0.00 0.00 56.01 56.26 3h0r n LEU 140 Cb 0.55 -0.11 0.69 0.00 -2.33 0.00 0.00 43.42 42.22 3h0r n LEU 140 CO -0.12 -0.06 0.94 -0.62 -1.33 0.00 0.00 177.39 176.20 3h0r n GLU 141 N -1.11 0.65 -4.40 3.23 1.02 -1.26 -4.73 120.64 114.04 3h0r n GLU 141 Ca 0.09 -0.15 -0.26 0.00 -0.02 0.00 0.00 57.16 56.83 3h0r n GLU 141 Cb 0.08 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 29.88 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 -2.45 1.46 0.37 3.49 0.52 0.12 -3.35 118.95 119.11 3h0r s ARG 142 Ca 0.31 -1.49 -0.26 0.00 -0.52 0.00 0.00 55.73 53.77 3h0r s ARG 142 Cb 0.20 -1.73 -0.09 0.00 0.52 0.00 0.00 34.95 33.86 3h0r s ARG 142 CO 0.46 0.37 1.11 0.08 0.02 0.00 0.00 175.30 177.34 3h0r s VAL 143 N -1.73 3.44 -2.37 3.52 1.01 -0.59 -0.56 120.40 123.12 3h0r s VAL 143 Ca 0.19 1.22 0.24 0.00 0.00 0.00 0.00 61.98 63.63 3h0r s VAL 143 Cb -0.08 -3.69 0.49 0.00 0.00 0.00 0.00 36.38 33.11 3h0r s VAL 143 CO 0.09 0.12 1.62 -0.81 0.00 0.00 0.00 175.10 176.12 3h0r n PRO 144 N 0.26 1.72 0.00 2.72 -0.04 -1.26 -4.44 135.00 133.96 3h0r n PRO 144 Ca 0.03 -1.07 0.00 0.00 -0.04 0.00 0.00 63.50 62.43 3h0r n PRO 144 Cb 0.47 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 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 1.15 0.45 3.60 0.55 0.00 -1.26 -4.35 105.19 105.33 3h0r n GLY 145 Ca 0.17 -2.02 -0.07 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.33 -0.39 0.22 -0.02 0.00 -1.05 -2.96 107.32 102.79 3h0r s GLY 146 Ca 0.00 0.55 0.20 0.00 0.00 0.00 0.00 44.72 45.46 3h0r s GLY 146 CO 0.00 0.17 1.15 1.48 0.00 0.00 0.00 173.10 175.90 3h0r h SER 147 N 2.00 0.00 0.00 1.64 4.64 -1.58 -3.37 113.55 116.87 3h0r h SER 147 Ca -0.24 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.99 3h0r h SER 147 Cb 1.25 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.31 3h0r h SER 147 CO 0.30 0.26 -0.02 -1.20 -0.87 0.00 0.00 176.83 175.30 3h0r n SER 148 N -2.91 3.07 0.14 4.97 7.64 -0.89 -2.86 113.62 122.78 3h0r n SER 148 Ca -0.02 -2.02 -0.13 0.00 1.01 0.00 0.00 58.87 57.71 3h0r n SER 148 Cb 0.67 -0.79 -0.06 0.00 -1.01 0.00 0.00 64.21 63.01 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 4.98 -0.43 1.51 0.23 0.00 -1.68 -2.66 103.07 105.02 3h0r h GLY 149 Ca 0.09 0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.64 3h0r h GLY 149 CO 0.27 -0.20 0.24 -1.33 0.00 0.00 0.00 176.54 175.53 3h0r h GLY 150 N -0.44 0.68 1.33 4.60 0.00 -1.64 -1.22 103.07 106.39 3h0r h GLY 150 Ca 0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 47.33 46.92 3h0r h GLY 150 CO -0.06 0.28 -0.26 1.76 0.00 0.00 0.00 176.54 178.27 3h0r h SER 151 N 0.65 0.78 -0.07 0.19 0.02 -1.69 -1.34 113.55 112.09 3h0r h SER 151 Ca 0.17 -0.29 -0.09 0.00 -0.84 0.00 0.00 61.79 60.73 3h0r h SER 151 Cb 0.04 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.37 3h0r h SER 151 CO -0.03 1.00 -0.32 0.00 -1.14 0.00 0.00 176.83 176.34 3h0r h ALA 152 N 1.05 0.13 0.00 3.77 0.00 -1.35 -3.18 119.26 119.69 3h0r h ALA 152 Ca 0.09 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.57 3h0r h ALA 152 Cb 0.77 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 3h0r h ALA 152 CO 0.06 0.19 -0.09 0.00 0.00 0.00 0.00 179.25 179.42 3h0r h ALA 153 N 0.43 -0.10 0.00 0.00 0.00 -1.13 -1.11 119.26 117.36 3h0r h ALA 153 Ca -0.02 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3h0r h ALA 153 Cb 0.97 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 3h0r h ALA 153 CO 0.07 -0.58 -0.09 0.66 0.00 0.00 0.00 179.25 179.31 3h0r h SER 154 N -0.15 0.00 1.55 0.00 4.64 -1.38 -0.63 113.55 117.58 3h0r h SER 154 Ca 0.03 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.28 3h0r h SER 154 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 3h0r h SER 154 CO -0.09 0.09 -0.33 0.58 -0.87 0.00 0.00 176.83 176.21 3h0r h VAL 155 N 0.00 0.59 0.02 0.95 2.07 -1.41 -0.49 116.25 117.99 3h0r h VAL 155 Ca -0.00 -1.75 -0.05 0.00 0.82 0.00 0.00 66.70 65.72 3h0r h VAL 155 Cb 0.17 2.22 0.01 0.00 -1.52 0.00 0.00 31.29 32.17 3h0r h VAL 155 CO 0.01 0.32 -0.22 0.00 0.02 0.00 0.00 177.57 177.71 3h0r h ALA 156 N 1.67 -0.00 0.00 1.67 0.00 0.12 -3.24 119.26 119.47 3h0r h ALA 156 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3h0r h ALA 156 Cb 1.20 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3h0r h ALA 156 CO 0.04 0.07 0.00 -0.39 0.00 0.00 0.00 179.25 178.98 3h0r h VAL 157 N -0.69 0.00 -3.18 0.00 -1.51 -1.39 -3.39 116.25 106.09 3h0r h VAL 157 Ca -0.03 -0.45 -0.23 0.00 -1.23 0.00 0.00 66.70 64.75 3h0r h VAL 157 Cb 1.07 1.40 0.05 0.00 -2.13 0.00 0.00 31.29 31.68 3h0r h VAL 157 CO 0.04 0.00 -0.37 0.18 -1.23 0.00 0.00 177.57 176.20 3h0r n LEU 158 N -2.32 -2.44 0.06 4.19 4.77 -0.32 -4.88 117.00 116.05 3h0r n LEU 158 Ca 0.05 -0.22 0.09 0.00 -0.03 0.00 0.00 56.01 55.90 3h0r n LEU 158 Cb 0.39 -1.94 0.40 0.00 -2.33 0.00 0.00 43.42 39.94 3h0r n LEU 158 CO 0.28 0.23 0.80 -1.54 -1.33 0.00 0.00 177.39 175.83 3h0r n SER 159 N -0.86 0.29 -3.74 -1.43 3.41 -0.47 -4.70 113.62 106.12 3h0r n SER 159 Ca -0.04 0.57 -0.13 0.00 -0.26 0.00 0.00 58.87 59.01 3h0r n SER 159 Cb 0.56 -0.63 -0.10 0.00 -0.26 0.00 0.00 64.21 63.77 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 -0.96 0.09 7.33 0.00 -1.03 -4.68 121.76 119.38 3h0r s ALA 160 Ca 0.06 1.00 0.11 0.00 0.00 0.00 0.00 51.96 53.13 3h0r s ALA 160 Cb 0.10 -0.53 0.06 0.00 0.00 0.00 0.00 23.12 22.74 3h0r s ALA 160 CO 0.34 -0.20 1.43 -1.00 0.00 0.00 0.00 175.76 176.33 3h0r h PRO 161 N 5.26 0.00 -3.54 0.00 0.13 -1.84 -3.34 132.00 128.67 3h0r h PRO 161 Ca -0.27 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.74 3h0r h PRO 161 Cb 1.18 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.13 3h0r h PRO 161 CO 0.28 0.75 -0.41 0.54 -0.23 0.00 0.00 178.00 178.93 3h0r s VAL 162 N -3.04 0.10 0.03 1.56 0.11 -1.26 -4.24 120.40 113.67 3h0r s VAL 162 Ca 0.01 -0.86 -0.13 0.00 -2.93 0.00 0.00 61.98 58.07 3h0r s VAL 162 Cb 0.10 -0.84 0.02 0.00 -1.53 0.00 0.00 36.38 34.12 3h0r s VAL 162 CO 0.78 -0.48 0.28 -0.55 -3.33 0.00 0.00 175.10 171.80 3h0r s SER 163 N -1.98 -0.10 -0.13 3.54 0.15 -0.16 -2.95 113.70 112.08 3h0r s SER 163 Ca -0.07 -0.18 -0.02 0.00 0.70 0.00 0.00 55.95 56.38 3h0r s SER 163 Cb -0.02 0.33 -0.03 0.00 -1.71 0.00 0.00 66.02 64.60 3h0r s SER 163 CO -0.03 -0.57 -0.06 -0.76 1.20 0.00 0.00 173.24 173.02 3h0r s LEU 164 N -1.93 3.15 0.00 3.45 1.02 -0.50 -1.13 118.68 122.73 3h0r s LEU 164 Ca -0.07 -0.13 0.00 0.00 0.02 0.00 0.00 54.13 53.96 3h0r s LEU 164 Cb -0.02 -1.73 -0.00 0.00 0.02 0.00 0.00 46.19 44.46 3h0r s LEU 164 CO -0.02 0.22 0.02 0.61 0.02 0.00 0.00 176.35 177.19 3h0r n GLY 165 N 3.20 4.01 3.16 -3.19 0.00 -0.81 -1.97 105.19 109.59 3h0r n GLY 165 Ca -0.18 -1.96 -0.14 0.00 0.00 0.00 0.00 46.02 43.75 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 -1.31 1.34 -0.18 1.61 1.04 -1.26 -1.36 113.70 113.58 3h0r s SER 166 Ca 0.02 -0.82 -0.04 0.00 0.48 0.00 0.00 55.95 55.60 3h0r s SER 166 Cb 0.00 0.02 0.06 0.00 0.10 0.00 0.00 66.02 66.20 3h0r s SER 166 CO 0.02 -0.29 0.06 -0.62 0.98 0.00 0.00 173.24 173.38 3h0r s ASP 167 N -2.45 2.60 -0.22 7.02 -1.08 -0.27 -3.05 116.67 119.22 3h0r s ASP 167 Ca 0.05 -0.69 0.09 0.00 -0.52 0.00 0.00 52.55 51.48 3h0r s ASP 167 Cb -0.02 -0.44 -0.20 0.00 -1.46 0.00 0.00 42.92 40.80 3h0r s ASP 167 CO -0.01 -0.32 -0.07 0.41 0.52 0.00 0.00 175.17 175.70 3h0r n THR 168 N 5.15 1.35 -2.10 1.71 -1.04 -1.26 -2.22 114.28 115.87 3h0r n THR 168 Ca -0.08 -0.67 -0.03 0.00 -2.04 0.00 0.00 64.05 61.23 3h0r n THR 168 Cb 0.48 -0.92 -0.03 0.00 -1.82 0.00 0.00 70.33 68.03 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 2.08 0.69 0.00 3.41 0.00 -1.26 -4.68 105.19 105.42 3h0r n GLY 169 Ca -0.37 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 0.10 1.01 0.05 -0.02 0.00 -1.26 -3.33 105.19 101.74 3h0r n GLY 170 Ca -0.14 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.98 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 0.27 -0.10 1.61 7.64 -1.26 -1.04 113.62 120.73 3h0r n SER 171 Ca 0.00 0.56 -0.20 0.00 1.01 0.00 0.00 58.87 60.24 3h0r n SER 171 Cb 0.00 -0.62 -0.09 0.00 -1.01 0.00 0.00 64.21 62.49 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 -1.79 1.51 -0.10 0.44 5.41 -1.17 -2.11 119.36 121.56 3h0r n ILE 172 Ca 0.04 -0.05 -0.08 0.00 1.00 0.00 0.00 62.75 63.66 3h0r n ILE 172 Cb 0.23 -2.09 -0.01 0.00 -0.71 0.00 0.00 39.64 37.06 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 0.42 -0.26 0.38 3.08 -1.72 -0.47 114.38 114.81 3h0r h ARG 173 Ca -0.34 -0.03 -0.19 0.00 0.07 0.00 0.00 59.98 59.50 3h0r h ARG 173 Cb 1.20 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.16 3h0r h ARG 173 CO -0.20 0.28 -0.56 -0.56 -1.07 0.00 0.00 179.97 177.85 3h0r h GLN 174 N 0.43 0.84 -0.39 0.04 -0.00 -1.39 0.14 115.11 114.79 3h0r h GLN 174 Ca 0.13 -0.56 -0.03 0.00 -0.00 0.00 0.00 58.65 58.19 3h0r h GLN 174 Cb -0.03 0.08 -0.02 0.00 -0.00 0.00 0.00 27.48 27.50 3h0r h GLN 174 CO -0.04 1.19 0.11 -1.35 -0.00 0.00 0.00 178.83 178.74 3h0r h PRO 175 N 0.61 0.56 -0.63 0.06 0.11 -1.75 -0.91 132.00 130.05 3h0r h PRO 175 Ca 0.00 -0.08 -0.03 0.00 0.11 0.00 0.00 66.00 66.00 3h0r h PRO 175 Cb 1.18 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 3h0r h PRO 175 CO 0.12 0.50 0.26 0.00 -0.21 0.00 0.00 178.00 178.67 3h0r h ALA 176 N 1.58 1.28 0.16 -0.75 0.00 -0.29 -0.77 119.26 120.48 3h0r h ALA 176 Ca 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3h0r h ALA 176 Cb 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3h0r h ALA 176 CO -0.01 0.54 -0.08 1.03 0.00 0.00 0.00 179.25 180.73 3h0r h SER 177 N 0.90 -0.18 0.05 0.00 0.87 -0.52 -0.81 113.55 113.85 3h0r h SER 177 Ca 0.21 -0.24 -0.01 0.00 -1.23 0.00 0.00 61.79 60.53 3h0r h SER 177 Cb 0.15 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.16 3h0r h SER 177 CO -0.02 0.15 -0.04 -0.26 -0.53 0.00 0.00 176.83 176.13 3h0r h PHE 178 N -0.52 0.00 -0.16 2.24 -1.00 -0.99 -2.83 116.94 113.67 3h0r h PHE 178 Ca -0.02 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.76 3h0r h PHE 178 Cb 0.40 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.96 3h0r h PHE 178 CO 0.03 0.04 0.00 0.00 -1.61 0.00 0.00 178.31 176.77 3h0r n GLY 180 N 1.13 0.04 3.17 0.00 0.00 -0.70 -4.74 105.19 104.08 3h0r n GLY 180 Ca 0.13 -0.15 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 3h0r n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h0r s VAL 181 N -3.19 0.64 0.04 1.61 0.11 -0.39 -4.88 120.40 114.33 3h0r s VAL 181 Ca 0.15 -1.93 -0.29 0.00 -2.93 0.00 0.00 61.98 56.98 3h0r s VAL 181 Cb -0.07 -1.72 -0.04 0.00 -1.53 0.00 0.00 36.38 33.02 3h0r s VAL 181 CO 0.41 -0.84 0.95 -0.63 -3.33 0.00 0.00 175.10 171.66 3h0r s ILE 182 N -3.66 4.73 -0.03 7.04 1.01 0.61 -4.36 121.20 126.54 3h0r s ILE 182 Ca 0.13 2.01 -0.01 0.00 0.00 0.00 0.00 60.65 62.78 3h0r s ILE 182 Cb 0.06 -4.30 0.03 0.00 0.01 0.00 0.00 42.46 38.26 3h0r s ILE 182 CO -0.04 0.24 0.05 -0.83 0.00 0.00 0.00 174.94 174.35 3h0r s GLY 183 N 0.56 0.17 -0.11 6.18 0.00 -0.96 -0.13 107.32 113.03 3h0r s GLY 183 Ca 0.49 0.24 0.01 0.00 0.00 0.00 0.00 44.72 45.45 3h0r s GLY 183 CO 0.28 1.08 -0.12 -1.50 0.00 0.00 0.00 173.10 172.84 3h0r s ILE 184 N 1.69 3.19 -0.31 0.90 2.07 -0.11 -1.16 121.20 127.47 3h0r s ILE 184 Ca -0.01 -0.63 -0.07 0.00 -1.41 0.00 0.00 60.65 58.52 3h0r s ILE 184 Cb -0.12 -2.32 0.02 0.00 0.13 0.00 0.00 42.46 40.16 3h0r s ILE 184 CO -0.03 0.54 0.10 -0.75 -1.91 0.00 0.00 174.94 172.89 3h0r s LYS 185 N -0.02 3.00 1.14 3.50 2.20 -0.35 -1.94 119.74 127.27 3h0r s LYS 185 Ca -0.03 -0.93 -0.19 0.00 -0.36 0.00 0.00 55.97 54.47 3h0r s LYS 185 Cb -0.14 -3.43 0.27 0.00 -1.51 0.00 0.00 37.83 33.02 3h0r s LYS 185 CO 0.04 -0.50 1.18 -1.25 -0.36 0.00 0.00 175.35 174.45 3h0r s PRO 186 N 1.49 -0.79 0.39 4.03 0.04 -1.26 -0.94 135.00 137.97 3h0r s PRO 186 Ca 0.02 -0.23 -0.26 0.00 0.04 0.00 0.00 61.00 60.57 3h0r s PRO 186 Cb -0.18 -1.66 -0.11 0.00 0.04 0.00 0.00 34.50 32.59 3h0r s PRO 186 CO 0.03 -3.39 1.30 2.41 0.04 0.00 0.00 177.00 177.39 3h0r n THR 187 N -4.50 2.34 -1.83 1.26 -1.04 -1.26 -4.33 114.28 104.92 3h0r n THR 187 Ca 0.15 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 61.23 3h0r n THR 187 Cb 0.60 -1.61 -0.03 0.00 -1.82 0.00 0.00 70.33 67.46 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 1.85 0.00 -1.42 5.04 -0.71 -1.09 117.35 119.86 3h0r s TYR 188 Ca 0.58 -0.04 0.00 0.00 -2.44 0.00 0.00 57.07 55.17 3h0r s TYR 188 Cb -0.52 -4.08 0.00 0.00 0.35 0.00 0.00 41.96 37.71 3h0r s TYR 188 CO 0.60 -4.62 0.00 0.41 -1.34 0.00 0.00 175.55 170.60 3h0r n GLY 189 N 4.26 2.50 0.15 8.97 0.00 -1.26 -4.93 105.19 114.88 3h0r n GLY 189 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.19 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 1.56 0.02 -5.69 1.61 2.43 -1.45 -1.71 114.38 111.16 3h0r h ARG 190 Ca 0.00 -0.01 -0.62 0.00 -0.81 0.00 0.00 59.98 58.54 3h0r h ARG 190 Cb 0.00 0.00 -0.31 0.00 -0.42 0.00 0.00 29.97 29.24 3h0r h ARG 190 CO 0.00 0.60 -0.86 0.08 -1.51 0.00 0.00 179.97 178.28 3h0r s VAL 191 N -3.71 1.70 0.47 0.20 1.01 -1.26 -0.18 120.40 118.64 3h0r s VAL 191 Ca -0.02 -0.88 -0.24 0.00 0.00 0.00 0.00 61.98 60.84 3h0r s VAL 191 Cb 0.13 -1.45 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 3h0r s VAL 191 CO 0.76 0.48 1.33 -0.24 0.00 0.00 0.00 175.10 177.44 3h0r n SER 192 N 2.99 2.75 -1.18 3.32 2.88 -1.26 -4.76 113.62 118.35 3h0r n SER 192 Ca -0.17 1.06 0.10 0.00 -1.33 0.00 0.00 58.87 58.53 3h0r n SER 192 Cb 0.53 -1.55 0.28 0.00 -0.75 0.00 0.00 64.21 62.72 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 -0.37 2.78 -2.16 -1.46 1.74 -1.26 -4.74 116.66 111.18 3h0r n ARG 193 Ca 0.07 -2.52 -0.43 0.00 -0.77 0.00 0.00 57.85 54.20 3h0r n ARG 193 Cb 0.42 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.33 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 -1.01 2.09 0.00 -1.55 5.04 -1.26 -1.98 117.35 118.68 3h0r s TYR 194 Ca 0.43 0.64 0.00 0.00 -2.44 0.00 0.00 57.07 55.70 3h0r s TYR 194 Cb 0.22 -4.21 0.00 0.00 0.35 0.00 0.00 41.96 38.32 3h0r s TYR 194 CO 0.29 -2.51 0.00 0.41 -1.34 0.00 0.00 175.55 172.40 3h0r n GLY 195 N 5.24 0.83 3.55 8.97 0.00 -1.26 -1.11 105.19 121.41 3h0r n GLY 195 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 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 4.37 -0.09 0.99 2.96 -0.84 -1.01 118.68 125.06 3h0r s LEU 196 Ca 0.00 -0.10 -0.30 0.00 -0.22 0.00 0.00 54.13 53.51 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 -0.39 2.08 0.52 -1.32 0.00 0.00 176.35 177.24 3h0r n VAL 197 N 5.31 0.56 -2.33 1.68 0.31 0.07 -4.86 118.33 119.07 3h0r n VAL 197 Ca -0.07 -0.27 -0.41 0.00 -0.01 0.00 0.00 64.34 63.58 3h0r n VAL 197 Cb 0.49 -2.35 -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 6.09 3.46 0.00 3.52 0.00 -1.26 -4.94 121.76 128.63 3h0r s ALA 198 Ca 0.95 0.99 0.00 0.00 0.00 0.00 0.00 51.96 53.90 3h0r s ALA 198 Cb -0.44 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.25 3h0r s ALA 198 CO 0.41 -0.42 0.00 0.34 0.00 0.00 0.00 175.76 176.08 3h0r n PHE 199 N 2.66 0.00 -3.96 0.00 7.35 -1.26 -4.77 117.46 117.47 3h0r n PHE 199 Ca 0.05 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.44 3h0r n PHE 199 Cb 0.44 0.00 -0.15 0.00 0.35 0.00 0.00 39.48 40.12 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 -3.39 2.14 0.37 3.13 0.00 -1.26 -2.68 121.76 120.07 3h0r s ALA 200 Ca 0.00 -1.54 0.05 0.00 0.00 0.00 0.00 51.96 50.48 3h0r s ALA 200 Cb 0.00 -1.51 0.73 0.00 0.00 0.00 0.00 23.12 22.34 3h0r s ALA 200 CO 0.00 -1.25 1.99 0.77 0.00 0.00 0.00 175.76 177.27 3h0r h SER 201 N 7.90 0.53 0.66 0.00 0.02 -1.93 0.11 113.55 120.84 3h0r h SER 201 Ca -0.17 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 3h0r h SER 201 Cb 1.06 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.46 3h0r h SER 201 CO 0.43 0.46 -0.12 -1.54 -1.14 0.00 0.00 176.83 174.92 3h0r n SER 202 N -4.40 0.22 -0.01 3.07 3.41 -1.26 -4.14 113.62 110.51 3h0r n SER 202 Ca 0.03 -0.04 -0.01 0.00 -0.26 0.00 0.00 58.87 58.59 3h0r n SER 202 Cb 0.12 -0.21 -0.02 0.00 -0.26 0.00 0.00 64.21 63.84 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 -1.31 0.00 -4.67 1.04 4.77 -0.61 -4.96 117.00 111.25 3h0r n LEU 203 Ca 0.10 0.00 -0.44 0.00 -0.03 0.00 0.00 56.01 55.64 3h0r n LEU 203 Cb 0.30 0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.43 3h0r n LEU 203 CO 0.27 0.06 0.96 0.47 -1.33 0.00 0.00 177.39 177.81 3h0r n ASP 204 N -2.06 2.63 -3.70 -1.43 8.00 0.30 -4.41 116.55 115.88 3h0r n ASP 204 Ca -0.04 1.16 -0.11 0.00 0.71 0.00 0.00 54.79 56.51 3h0r n ASP 204 Cb 0.55 -1.43 -0.12 0.00 -0.02 0.00 0.00 41.12 40.11 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 -0.79 0.30 0.43 -1.24 -1.52 -0.94 -4.87 119.66 111.03 3h0r s GLN 205 Ca 0.65 0.74 -0.25 0.00 -1.95 0.00 0.00 55.36 54.55 3h0r s GLN 205 Cb -0.64 -0.01 -0.09 0.00 -0.22 0.00 0.00 33.01 32.05 3h0r s GLN 205 CO 0.53 -0.19 1.31 -0.89 -0.25 0.00 0.00 175.29 175.80 3h0r n ILE 206 N 4.54 2.65 -3.58 1.08 5.41 -1.26 -1.11 119.36 127.09 3h0r n ILE 206 Ca -0.20 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.05 3h0r n ILE 206 Cb 0.53 -1.63 0.00 0.00 -0.71 0.00 0.00 39.64 37.83 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 0.76 3.50 2.99 7.39 0.00 -0.46 -4.46 105.19 114.91 3h0r n GLY 207 Ca 0.06 -1.43 -0.20 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.25 0.76 -0.05 1.61 1.01 -0.82 -1.92 120.40 118.75 3h0r s VAL 208 Ca 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.62 3h0r s VAL 208 Cb 0.00 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 3h0r s VAL 208 CO 0.00 0.24 0.05 -0.36 0.00 0.00 0.00 175.10 175.03 3h0r s PHE 209 N 0.22 3.25 0.30 5.22 0.08 -0.29 -0.93 117.98 125.83 3h0r s PHE 209 Ca -0.03 0.23 -0.19 0.00 0.12 0.00 0.00 56.93 57.06 3h0r s PHE 209 Cb -0.09 -1.77 0.06 0.00 -0.57 0.00 0.00 43.02 40.65 3h0r s PHE 209 CO 0.00 0.53 0.88 0.20 -0.10 0.00 0.00 175.22 176.73 3h0r s GLY 210 N -1.28 0.22 -0.05 4.36 0.00 0.81 -0.98 107.32 110.39 3h0r s GLY 210 Ca 0.18 -0.53 0.08 0.00 0.00 0.00 0.00 44.72 44.44 3h0r s GLY 210 CO 0.07 0.62 0.10 0.54 0.00 0.00 0.00 173.10 174.43 3h0r n ARG 211 N -0.58 1.68 -4.89 2.90 1.74 -1.26 -0.28 116.66 115.97 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 -1.21 -0.14 0.00 -1.02 0.00 0.00 32.46 30.69 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 -2.36 2.16 0.45 5.56 0.52 -1.26 -4.43 118.95 119.59 3h0r s ARG 212 Ca -0.04 -0.91 0.13 0.00 -0.52 0.00 0.00 55.73 54.40 3h0r s ARG 212 Cb 0.04 -2.18 1.01 0.00 0.52 0.00 0.00 34.95 34.34 3h0r s ARG 212 CO 0.34 0.56 2.02 1.15 0.02 0.00 0.00 175.30 179.40 3h0r h THR 213 N 4.21 1.10 -0.19 0.02 2.02 -1.93 -2.04 112.91 116.10 3h0r h THR 213 Ca -0.46 -0.46 -0.13 0.00 0.77 0.00 0.00 66.41 66.13 3h0r h THR 213 Cb 1.15 1.15 -0.01 0.00 -1.74 0.00 0.00 68.15 68.69 3h0r h THR 213 CO 0.48 0.14 -0.45 -0.33 0.37 0.00 0.00 175.52 175.73 3h0r h GLU 214 N 0.10 0.47 -0.41 6.66 5.08 -1.95 -1.15 114.58 123.37 3h0r h GLU 214 Ca 0.02 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.13 3h0r h GLU 214 Cb 0.21 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 3h0r h GLU 214 CO 0.01 0.83 0.25 -0.44 -1.00 0.00 0.00 179.01 178.65 3h0r h ASP 215 N 0.38 0.50 -0.34 1.42 3.32 -1.80 -1.86 116.42 118.04 3h0r h ASP 215 Ca 0.03 -0.06 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 3h0r h ASP 215 Cb 0.94 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 3h0r h ASP 215 CO 0.08 0.42 -0.00 0.58 -1.72 0.00 0.00 179.24 178.59 3h0r h VAL 216 N 0.54 1.26 -0.61 -1.35 2.07 -1.28 -2.38 116.25 114.51 3h0r h VAL 216 Ca 0.15 -0.97 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 3h0r h VAL 216 Cb 0.01 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 3h0r h VAL 216 CO -0.03 0.32 0.28 0.00 0.02 0.00 0.00 177.57 178.17 3h0r h ALA 217 N 0.85 1.36 0.15 1.67 0.00 -1.14 -1.65 119.26 120.50 3h0r h ALA 217 Ca 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3h0r h ALA 217 Cb 0.46 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3h0r h ALA 217 CO 0.02 0.50 -0.07 1.25 0.00 0.00 0.00 179.25 180.95 3h0r h LEU 218 N 0.86 -0.17 -0.83 0.00 5.85 -1.20 -1.59 115.31 118.22 3h0r h LEU 218 Ca 0.21 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 3h0r h LEU 218 Cb 0.10 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 3h0r h LEU 218 CO -0.03 0.29 0.45 0.58 -0.34 0.00 0.00 178.44 179.40 3h0r h VAL 219 N -0.69 1.25 -0.74 1.05 2.07 -1.32 -1.25 116.25 116.62 3h0r h VAL 219 Ca -0.02 -0.62 0.01 0.00 0.82 0.00 0.00 66.70 66.89 3h0r h VAL 219 Cb 0.50 0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 3h0r h VAL 219 CO 0.03 0.28 0.49 0.25 0.02 0.00 0.00 177.57 178.64 3h0r h LEU 220 N 1.16 0.86 -0.53 2.57 5.85 -1.36 -2.83 115.31 121.03 3h0r h LEU 220 Ca 0.29 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 59.01 3h0r h LEU 220 Cb 0.04 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 3h0r h LEU 220 CO -0.05 0.63 0.31 -0.08 -0.34 0.00 0.00 178.44 178.91 3h0r h GLU 221 N 1.01 0.60 -0.75 1.25 4.81 -0.22 -2.69 114.58 118.59 3h0r h GLU 221 Ca 0.27 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.55 3h0r h GLU 221 Cb -0.11 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.09 3h0r h GLU 221 CO -0.06 0.40 0.49 0.28 -0.73 0.00 0.00 179.01 179.39 3h0r h VAL 222 N 0.62 0.96 -0.00 0.32 2.07 -1.02 -3.25 116.25 115.95 3h0r h VAL 222 Ca 0.22 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.50 3h0r h VAL 222 Cb 0.04 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.01 3h0r h VAL 222 CO -0.10 0.13 -0.35 2.30 0.02 0.00 0.00 177.57 179.56 3h0r n ILE 223 N -4.49 0.00 -2.96 4.57 -5.35 -1.08 -4.84 119.36 105.21 3h0r n ILE 223 Ca 0.12 -0.33 -0.20 0.00 -0.27 0.00 0.00 62.75 62.07 3h0r n ILE 223 Cb 0.30 1.01 0.07 0.00 -1.74 0.00 0.00 39.64 39.28 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 -1.68 4.96 0.00 7.28 1.04 -1.03 -4.47 113.70 119.79 3h0r s SER 224 Ca 0.03 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.69 3h0r s SER 224 Cb 0.06 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.44 3h0r s SER 224 CO 0.31 -1.44 0.00 0.61 0.98 0.00 0.00 173.24 173.70 3h0r n GLY 225 N -2.35 -0.99 3.78 7.32 0.00 0.75 -4.93 105.19 108.77 3h0r n GLY 225 Ca 0.16 -1.64 -0.36 0.00 0.00 0.00 0.00 46.02 44.17 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 -1.08 3.29 -0.09 1.61 -0.00 -1.26 -4.50 118.94 116.91 3h0r s TRP 226 Ca 0.00 1.65 -0.01 0.00 -0.00 0.00 0.00 56.10 57.74 3h0r s TRP 226 Cb 0.00 -3.10 0.03 0.00 -0.00 0.00 0.00 33.47 30.40 3h0r s TRP 226 CO 0.00 -0.55 -0.04 0.34 -0.00 0.00 0.00 176.95 176.70 3h0r s ASP 227 N -1.62 1.79 0.58 5.86 2.15 -1.26 -5.01 116.67 119.17 3h0r s ASP 227 Ca 0.58 -0.18 0.36 0.00 0.43 0.00 0.00 52.55 53.74 3h0r s ASP 227 Cb -0.21 -0.61 1.77 0.00 -0.30 0.00 0.00 42.92 43.57 3h0r s ASP 227 CO 0.26 -0.15 2.15 1.05 -0.17 0.00 0.00 175.17 178.31 3h0r h GLU 228 N 8.17 0.00 -0.01 4.34 4.11 -1.96 -1.85 114.58 127.38 3h0r h GLU 228 Ca -0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.18 3h0r h GLU 228 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3h0r h GLU 228 CO 0.34 0.04 -0.04 1.63 0.07 0.00 0.00 179.01 181.05 3h0r n LYS 229 N -3.24 1.07 -3.82 1.06 5.02 -1.26 -4.71 118.16 112.27 3h0r n LYS 229 Ca -0.01 -0.34 -0.29 0.00 -2.02 0.00 0.00 58.31 55.64 3h0r n LYS 229 Cb 0.20 -1.49 -0.16 0.00 -0.02 0.00 0.00 35.03 33.56 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 -2.17 3.44 0.52 4.39 -1.08 -0.70 -4.81 116.67 116.26 3h0r s ASP 230 Ca 0.38 -1.07 0.18 0.00 -0.52 0.00 0.00 52.55 51.52 3h0r s ASP 230 Cb 0.21 -0.88 1.30 0.00 -1.46 0.00 0.00 42.92 42.09 3h0r s ASP 230 CO 0.40 -0.29 2.14 0.28 0.52 0.00 0.00 175.17 178.21 3h0r h SER 231 N 8.10 0.00 0.29 -0.34 0.02 -1.84 -2.42 113.55 117.36 3h0r h SER 231 Ca -0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 3h0r h SER 231 Cb 1.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.63 3h0r h SER 231 CO 0.38 0.03 -0.46 0.35 -1.14 0.00 0.00 176.83 175.99 3h0r n THR 232 N -4.39 0.00 -2.39 -2.27 -2.24 -1.26 -4.87 114.28 96.85 3h0r n THR 232 Ca -0.03 -0.08 -0.40 0.00 -2.27 0.00 0.00 64.05 61.27 3h0r n THR 232 Cb 0.12 0.50 -0.04 0.00 -2.10 0.00 0.00 70.33 68.81 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 -2.76 7.15 0.11 3.42 1.04 -0.91 -4.43 113.70 117.33 3h0r s SER 233 Ca 0.17 2.36 -0.17 0.00 0.48 0.00 0.00 55.95 58.78 3h0r s SER 233 Cb 0.18 -2.63 -0.07 0.00 0.10 0.00 0.00 66.02 63.60 3h0r s SER 233 CO 0.64 -0.24 0.57 0.00 0.98 0.00 0.00 173.24 175.19 3h0r s ALA 234 N -1.07 3.57 -1.38 5.32 0.00 -0.64 -4.77 121.76 122.79 3h0r s ALA 234 Ca 0.46 -0.03 -0.11 0.00 0.00 0.00 0.00 51.96 52.28 3h0r s ALA 234 Cb -0.34 -2.60 0.09 0.00 0.00 0.00 0.00 23.12 20.28 3h0r s ALA 234 CO 0.43 0.42 2.17 1.63 0.00 0.00 0.00 175.76 180.41 3h0r n LYS 235 N 1.25 3.46 -4.35 0.00 5.02 -1.26 -4.01 118.16 118.27 3h0r n LYS 235 Ca -0.08 -3.05 -0.24 0.00 -2.02 0.00 0.00 58.31 52.92 3h0r n LYS 235 Cb 0.51 -3.01 -0.17 0.00 -0.02 0.00 0.00 35.03 32.35 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 1.40 0.93 0.38 -0.18 1.01 -1.26 -5.09 120.40 117.58 3h0r s VAL 236 Ca 0.47 -0.34 -0.27 0.00 0.00 0.00 0.00 61.98 61.84 3h0r s VAL 236 Cb 0.13 -0.89 -0.11 0.00 0.00 0.00 0.00 36.38 35.51 3h0r s VAL 236 CO -0.05 0.32 1.27 -0.81 0.00 0.00 0.00 175.10 175.83 3h0r n PRO 237 N 4.07 2.02 -2.83 2.72 -0.04 -1.26 -4.60 135.00 135.08 3h0r n PRO 237 Ca -0.22 0.71 -0.42 0.00 -0.04 0.00 0.00 63.50 63.53 3h0r n PRO 237 Cb 0.51 -2.34 -0.04 0.00 -0.04 0.00 0.00 33.50 31.60 3h0r n PRO 237 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3h0r s VAL 238 N -1.14 4.80 0.53 0.52 1.01 -1.26 -5.02 120.40 119.85 3h0r s VAL 238 Ca 0.58 1.70 -0.22 0.00 0.00 0.00 0.00 61.98 64.04 3h0r s VAL 238 Cb -0.54 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 31.61 3h0r s VAL 238 CO 0.60 -0.08 1.35 -2.65 0.00 0.00 0.00 175.10 174.32 3h0r n PRO 239 N 5.94 1.73 -1.95 2.72 -0.02 -1.26 -4.88 135.00 137.28 3h0r n PRO 239 Ca 0.07 0.63 -0.38 0.00 -2.02 0.00 0.00 63.50 61.81 3h0r n PRO 239 Cb 0.47 -2.56 -0.04 0.00 -0.02 0.00 0.00 33.50 31.36 3h0r n PRO 239 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3h0r n GLU 240 N -0.89 2.18 -0.09 -0.52 1.02 -1.26 -4.78 120.64 116.30 3h0r n GLU 240 Ca 0.10 -2.56 -0.04 0.00 -0.02 0.00 0.00 57.16 54.64 3h0r n GLU 240 Cb 0.44 -3.42 0.17 0.00 -0.02 0.00 0.00 31.44 28.61 3h0r n GLU 240 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 3h0r h TRP 241 N 8.20 0.80 0.00 -0.32 6.55 -1.90 -2.30 115.95 126.98 3h0r h TRP 241 Ca 0.38 -0.12 -0.01 0.00 0.95 0.00 0.00 58.89 60.09 3h0r h TRP 241 Cb 0.82 -0.22 -0.00 0.00 -0.86 0.00 0.00 29.16 28.90 3h0r h TRP 241 CO 1.31 0.76 -0.03 0.66 -1.05 0.00 0.00 178.44 180.09 3h0r h SER 242 N 0.69 0.00 0.38 -3.49 4.64 -1.86 -0.95 113.55 112.96 3h0r h SER 242 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3h0r h SER 242 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3h0r h SER 242 CO 0.02 0.03 -0.43 -0.62 -0.87 0.00 0.00 176.83 174.96 3h0r n GLU 243 N -4.34 0.32 -0.05 4.77 -0.58 -0.91 -4.44 120.64 115.42 3h0r n GLU 243 Ca -0.03 -0.19 -0.03 0.00 -0.42 0.00 0.00 57.16 56.49 3h0r n GLU 243 Cb 0.12 -1.50 -0.10 0.00 -0.57 0.00 0.00 31.44 29.40 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 -1.17 1.69 -0.13 3.49 4.07 -0.48 -4.54 120.64 123.56 3h0r n GLU 244 Ca 0.08 -0.03 0.01 0.00 -0.06 0.00 0.00 57.16 57.15 3h0r n GLU 244 Cb 0.34 -1.31 0.28 0.00 -0.06 0.00 0.00 31.44 30.69 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 1.18 0.00 6.31 -1.51 -1.45 -2.71 116.25 118.07 3h0r h VAL 245 Ca -0.25 -0.43 -0.06 0.00 -1.23 0.00 0.00 66.70 64.72 3h0r h VAL 245 Cb 1.49 0.35 -0.01 0.00 -2.13 0.00 0.00 31.29 30.99 3h0r h VAL 245 CO 0.01 0.19 -0.29 0.11 -1.23 0.00 0.00 177.57 176.37 3h0r h LYS 246 N 0.83 0.00 -7.29 5.19 1.57 -1.84 -3.40 116.57 111.64 3h0r h LYS 246 Ca 0.22 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.48 3h0r h LYS 246 Cb 0.00 0.00 0.17 0.00 0.08 0.00 0.00 32.23 32.48 3h0r h LYS 246 CO -0.04 0.29 0.26 0.15 -0.57 0.00 0.00 179.45 179.54 3h0r s LYS 247 N -3.40 1.51 -0.06 3.15 1.02 -1.02 -5.06 119.74 115.88 3h0r s LYS 247 Ca 0.02 1.33 0.01 0.00 0.02 0.00 0.00 55.97 57.35 3h0r s LYS 247 Cb 0.09 -1.80 0.02 0.00 -0.52 0.00 0.00 37.83 35.62 3h0r s LYS 247 CO 0.67 -2.22 -0.05 -2.00 -0.92 0.00 0.00 175.35 170.83 3h0r s GLU 248 N -4.77 1.02 -0.19 1.68 2.12 -1.26 -4.93 118.70 112.38 3h0r s GLU 248 Ca 0.64 -0.14 -0.07 0.00 0.36 0.00 0.00 54.97 55.77 3h0r s GLU 248 Cb -0.20 -1.05 -0.04 0.00 0.26 0.00 0.00 34.13 33.10 3h0r s GLU 248 CO 0.57 -0.13 0.04 0.08 -0.54 0.00 0.00 175.26 175.29 3h0r s VAL 249 N 1.16 4.50 0.32 3.70 1.01 -1.26 -5.09 120.40 124.74 3h0r s VAL 249 Ca -0.07 -0.13 -0.25 0.00 0.00 0.00 0.00 61.98 61.53 3h0r s VAL 249 Cb -0.14 -3.03 -0.10 0.00 0.00 0.00 0.00 36.38 33.11 3h0r s VAL 249 CO -0.01 0.44 0.92 -0.54 0.00 0.00 0.00 175.10 175.91 3h0r s LYS 250 N 0.62 4.52 -0.86 2.72 -0.14 -1.26 -4.25 119.74 121.10 3h0r s LYS 250 Ca 0.02 1.26 -0.02 0.00 -1.36 0.00 0.00 55.97 55.88 3h0r s LYS 250 Cb -0.13 -2.77 0.00 0.00 -1.68 0.00 0.00 37.83 33.25 3h0r s LYS 250 CO 0.02 0.27 0.25 0.41 -0.76 0.00 0.00 175.35 175.54 3h0r n GLY 251 N 0.50 0.01 3.79 -3.33 0.00 -1.26 -5.02 105.19 99.87 3h0r n GLY 251 Ca 0.02 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.66 3.45 -0.03 0.99 1.43 -1.26 -4.89 118.68 114.71 3h0r s LEU 252 Ca 0.12 1.92 0.06 0.00 -1.03 0.00 0.00 54.13 55.20 3h0r s LEU 252 Cb -0.05 -4.54 -0.01 0.00 0.03 0.00 0.00 46.19 41.61 3h0r s LEU 252 CO 0.15 -1.41 -0.19 -0.54 0.23 0.00 0.00 176.35 174.59 3h0r s LYS 253 N -4.07 1.72 -0.12 1.70 1.02 -1.26 -2.32 119.74 116.40 3h0r s LYS 253 Ca 0.65 -0.69 0.03 0.00 0.02 0.00 0.00 55.97 55.98 3h0r s LYS 253 Cb -0.19 -1.59 0.00 0.00 -0.52 0.00 0.00 37.83 35.54 3h0r s LYS 253 CO 0.39 0.37 -0.21 0.42 -0.92 0.00 0.00 175.35 175.40 3h0r s ILE 254 N -0.30 2.25 -0.13 2.17 1.01 0.12 -1.30 121.20 125.02 3h0r s ILE 254 Ca 0.04 -0.94 -0.11 0.00 0.00 0.00 0.00 60.65 59.64 3h0r s ILE 254 Cb -0.09 -1.89 -0.05 0.00 0.01 0.00 0.00 42.46 40.44 3h0r s ILE 254 CO 0.00 0.55 0.23 -0.83 0.00 0.00 0.00 174.94 174.89 3h0r s GLY 255 N 0.49 2.20 -0.34 6.18 0.00 -0.21 -0.53 107.32 115.11 3h0r s GLY 255 Ca -0.14 -0.52 -0.03 0.00 0.00 0.00 0.00 44.72 44.02 3h0r s GLY 255 CO 0.05 0.07 0.09 1.08 0.00 0.00 0.00 173.10 174.39 3h0r s LEU 256 N -0.29 4.39 -0.06 0.66 1.43 0.57 -1.68 118.68 123.69 3h0r s LEU 256 Ca 0.15 -1.44 -0.31 0.00 -1.03 0.00 0.00 54.13 51.50 3h0r s LEU 256 Cb -0.13 -1.79 -0.09 0.00 0.03 0.00 0.00 46.19 44.21 3h0r s LEU 256 CO 0.04 -0.36 2.01 -2.65 0.23 0.00 0.00 176.35 175.62 3h0r n PRO 257 N 4.67 2.43 -0.17 1.29 -0.02 -1.26 -1.34 135.00 140.61 3h0r n PRO 257 Ca -0.10 0.85 0.15 0.00 -2.02 0.00 0.00 63.50 62.38 3h0r n PRO 257 Cb 0.43 -2.93 0.50 0.00 -0.02 0.00 0.00 33.50 31.49 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 11.13 0.41 0.00 -0.52 1.57 -1.02 -0.67 116.57 127.47 3h0r h LYS 258 Ca -0.47 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.24 3h0r h LYS 258 Cb 1.25 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 3h0r h LYS 258 CO 0.95 0.27 -0.20 0.93 -0.57 0.00 0.00 179.45 180.83 3h0r h GLU 259 N 0.42 0.00 0.00 3.15 3.07 -1.89 -2.64 114.58 116.69 3h0r h GLU 259 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 3h0r h GLU 259 Cb 0.84 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.75 3h0r h GLU 259 CO -0.12 0.20 0.00 0.74 -1.40 0.00 0.00 179.01 178.43 3h0r h PHE 260 N 0.00 0.00 0.00 4.33 0.04 -1.50 -3.03 116.94 116.78 3h0r h PHE 260 Ca -0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 3h0r h PHE 260 Cb 0.63 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.78 3h0r h PHE 260 CO 0.00 0.00 -0.05 0.74 -0.60 0.00 0.00 178.31 178.40 3h0r h PHE 261 N 0.00 0.00 0.00 -0.55 0.04 -1.55 -2.30 116.94 112.58 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 0.57 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.72 3h0r h PHE 261 CO 0.00 0.05 0.00 0.39 -0.60 0.00 0.00 178.31 178.15 3h0r n GLU 262 N -3.15 0.01 -2.79 1.51 -0.58 -1.14 -4.84 120.64 109.66 3h0r n GLU 262 Ca 0.01 0.05 -0.41 0.00 -0.42 0.00 0.00 57.16 56.39 3h0r n GLU 262 Cb 0.38 -1.51 -0.03 0.00 -0.57 0.00 0.00 31.44 29.70 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 -3.01 3.65 -0.28 -0.32 1.51 -0.87 -4.97 117.35 113.06 3h0r s TYR 263 Ca 0.13 1.60 -0.28 0.00 -1.01 0.00 0.00 57.07 57.50 3h0r s TYR 263 Cb 0.17 -3.04 -0.03 0.00 -0.11 0.00 0.00 41.96 38.94 3h0r s TYR 263 CO 0.49 0.02 1.96 -1.21 -1.11 0.00 0.00 175.55 175.69 3h0r s GLU 264 N 0.93 3.28 0.05 -0.62 2.02 -1.26 -4.99 118.70 118.10 3h0r s GLU 264 Ca 0.49 1.68 0.03 0.00 0.02 0.00 0.00 54.97 57.18 3h0r s GLU 264 Cb -0.20 -4.26 -0.04 0.00 0.10 0.00 0.00 34.13 29.73 3h0r s GLU 264 CO 0.26 -1.93 -0.01 -0.51 0.02 0.00 0.00 175.26 173.09 3h0r s LEU 265 N 7.37 3.44 0.35 1.80 1.43 -1.26 -4.84 118.68 126.97 3h0r s LEU 265 Ca 0.88 -0.11 -0.28 0.00 -1.03 0.00 0.00 54.13 53.59 3h0r s LEU 265 Cb -0.27 -2.08 -0.09 0.00 0.03 0.00 0.00 46.19 43.78 3h0r s LEU 265 CO 0.34 0.23 1.25 -1.10 0.23 0.00 0.00 176.35 177.30 3h0r s GLN 266 N -1.92 4.25 0.27 1.70 -0.21 -0.08 -4.89 119.66 118.78 3h0r s GLN 266 Ca 0.22 2.07 -0.01 0.00 0.02 0.00 0.00 55.36 57.66 3h0r s GLN 266 Cb -0.12 -2.94 0.47 0.00 1.00 0.00 0.00 33.01 31.43 3h0r s GLN 266 CO 0.14 -0.22 1.84 -1.35 -2.12 0.00 0.00 175.29 173.57 3h0r h PRO 267 N 3.15 0.94 -0.91 2.91 0.11 -1.99 -0.64 132.00 135.56 3h0r h PRO 267 Ca -0.49 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.55 3h0r h PRO 267 Cb 1.23 -0.21 -0.04 0.00 0.11 0.00 0.00 31.00 32.08 3h0r h PRO 267 CO 0.64 0.62 0.52 1.96 -0.21 0.00 0.00 178.00 181.53 3h0r h GLN 268 N 0.97 1.26 -0.16 1.05 7.50 -1.97 -0.40 115.11 123.35 3h0r h GLN 268 Ca 0.45 -0.13 -0.03 0.00 0.50 0.00 0.00 58.65 59.44 3h0r h GLN 268 Cb 0.39 -0.25 -0.01 0.00 0.05 0.00 0.00 27.48 27.66 3h0r h GLN 268 CO -0.24 0.90 -0.00 0.28 -1.50 0.00 0.00 178.83 178.27 3h0r h VAL 269 N 1.27 1.25 -0.15 -0.54 2.07 -1.51 -1.08 116.25 117.57 3h0r h VAL 269 Ca 0.32 -0.85 0.02 0.00 0.82 0.00 0.00 66.70 67.01 3h0r h VAL 269 Cb -0.00 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 3h0r h VAL 269 CO -0.06 0.25 0.03 0.50 0.02 0.00 0.00 177.57 178.32 3h0r h LYS 270 N 0.03 0.09 -0.10 1.57 3.64 -0.93 0.00 116.57 120.88 3h0r h LYS 270 Ca 0.05 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.46 3h0r h LYS 270 Cb 0.38 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.12 3h0r h LYS 270 CO 0.01 0.06 -0.30 0.93 -2.27 0.00 0.00 179.45 177.88 3h0r h GLU 271 N 0.10 -0.37 -0.63 1.90 5.08 -1.01 -0.59 114.58 119.06 3h0r h GLU 271 Ca 0.06 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.56 3h0r h GLU 271 Cb 0.05 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.31 3h0r h GLU 271 CO -0.08 -0.25 0.20 0.00 -1.00 0.00 0.00 179.01 177.88 3h0r h ALA 272 N 0.45 0.80 -0.27 3.43 0.00 -0.90 -1.92 119.26 120.84 3h0r h ALA 272 Ca 0.09 0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.97 3h0r h ALA 272 Cb 0.52 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 3h0r h ALA 272 CO -0.32 -0.24 -0.37 0.35 0.00 0.00 0.00 179.25 178.67 3h0r h PHE 273 N 0.35 0.90 -0.64 0.00 3.57 -0.58 -1.84 116.94 118.70 3h0r h PHE 273 Ca 0.33 -0.29 0.03 0.00 3.53 0.00 0.00 57.97 61.56 3h0r h PHE 273 Cb 0.46 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 3h0r h PHE 273 CO -0.20 1.06 0.39 0.93 -2.23 0.00 0.00 178.31 178.27 3h0r h GLU 274 N 0.47 0.75 -0.59 1.11 5.08 -0.90 -1.37 114.58 119.14 3h0r h GLU 274 Ca 0.03 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3h0r h GLU 274 Cb 0.95 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.01 3h0r h GLU 274 CO 0.09 0.50 0.32 -0.97 -1.00 0.00 0.00 179.01 177.95 3h0r h ASN 275 N 0.77 0.73 -0.62 1.42 -0.73 -1.28 -0.20 115.58 115.68 3h0r h ASN 275 Ca 0.26 -0.09 0.08 0.00 1.87 0.00 0.00 56.30 58.42 3h0r h ASN 275 Cb 0.02 -0.19 -0.07 0.00 0.27 0.00 0.00 38.32 38.36 3h0r h ASN 275 CO -0.10 0.61 0.27 0.15 -0.37 0.00 0.00 177.43 177.99 3h0r h PHE 276 N 0.79 0.48 -0.19 0.67 3.57 -0.64 0.20 116.94 121.83 3h0r h PHE 276 Ca 0.21 0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.57 3h0r h PHE 276 Cb 0.04 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.66 3h0r h PHE 276 CO -0.01 0.17 -0.52 0.82 -2.23 0.00 0.00 178.31 176.54 3h0r h ILE 277 N 0.49 1.31 -0.73 1.41 1.08 -1.02 -1.78 117.51 118.27 3h0r h ILE 277 Ca 0.30 -1.75 0.00 0.00 -0.39 0.00 0.00 64.86 63.02 3h0r h ILE 277 Cb 0.32 1.90 -0.04 0.00 -3.07 0.00 0.00 36.82 35.94 3h0r h ILE 277 CO -0.26 0.55 0.46 0.11 -0.69 0.00 0.00 178.15 178.32 3h0r h LYS 278 N 0.39 0.98 -0.46 2.37 1.57 -0.71 0.12 116.57 120.83 3h0r h LYS 278 Ca -0.01 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 58.61 3h0r h LYS 278 Cb 1.14 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 33.22 3h0r h LYS 278 CO 0.11 0.68 -0.07 1.49 -0.57 0.00 0.00 179.45 181.09 3h0r h GLU 279 N 1.00 0.80 -0.48 3.15 4.57 -0.94 -0.93 114.58 121.75 3h0r h GLU 279 Ca 0.27 -0.25 -0.13 0.00 -1.18 0.00 0.00 59.36 58.07 3h0r h GLU 279 Cb -0.07 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 3h0r h GLU 279 CO -0.05 0.85 -0.23 -0.07 -1.18 0.00 0.00 179.01 178.33 3h0r h LEU 280 N 0.73 1.03 -0.31 1.64 3.38 -0.92 -2.89 115.31 117.96 3h0r h LEU 280 Ca 0.13 -0.40 0.04 0.00 0.09 0.00 0.00 57.88 57.74 3h0r h LEU 280 Cb 0.54 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 3h0r h LEU 280 CO 0.03 1.20 0.09 -0.08 0.09 0.00 0.00 178.44 179.78 3h0r h GLU 281 N 0.85 0.22 -0.72 1.13 4.81 -0.38 -1.97 114.58 118.52 3h0r h GLU 281 Ca 0.11 -0.01 0.18 0.00 -0.13 0.00 0.00 59.36 59.50 3h0r h GLU 281 Cb 0.81 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.10 3h0r h GLU 281 CO 0.07 0.14 0.50 0.87 -0.73 0.00 0.00 179.01 179.86 3h0r h LYS 282 N 0.22 0.19 -0.01 1.92 1.57 -1.07 0.62 116.57 120.03 3h0r h LYS 282 Ca 0.14 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3h0r h LYS 282 Cb 0.12 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3h0r h LYS 282 CO -0.16 0.13 -0.05 0.39 -0.57 0.00 0.00 179.45 179.19 3h0r n GLU 283 N -4.41 1.07 0.00 3.15 -0.58 -0.77 -4.91 120.64 114.19 3h0r n GLU 283 Ca 0.14 -0.39 0.00 0.00 -0.42 0.00 0.00 57.16 56.49 3h0r n GLU 283 Cb 0.65 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 30.03 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 1.17 0.90 3.72 0.62 0.00 0.21 -5.08 105.19 106.73 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 3.34 -0.10 1.61 0.40 -1.03 -4.67 117.98 115.52 3h0r s PHE 285 Ca 0.00 1.14 -0.28 0.00 -0.60 0.00 0.00 56.93 57.19 3h0r s PHE 285 Cb 0.00 -3.55 -0.02 0.00 0.51 0.00 0.00 43.02 39.96 3h0r s PHE 285 CO 0.00 -1.82 0.91 -2.00 0.70 0.00 0.00 175.22 173.01 3h0r s GLU 286 N 1.00 4.41 -0.25 0.44 2.12 -0.98 -4.28 118.70 121.16 3h0r s GLU 286 Ca 0.61 1.23 -0.07 0.00 0.36 0.00 0.00 54.97 57.09 3h0r s GLU 286 Cb -0.33 -3.53 -0.03 0.00 0.26 0.00 0.00 34.13 30.50 3h0r s GLU 286 CO 0.30 -0.23 0.07 0.42 -0.54 0.00 0.00 175.26 175.28 3h0r s ILE 287 N 1.74 4.35 -0.00 -3.70 -1.09 -1.26 -0.71 121.20 120.53 3h0r s ILE 287 Ca 0.45 -0.16 0.07 0.00 -2.23 0.00 0.00 60.65 58.77 3h0r s ILE 287 Cb -0.18 -3.03 -0.02 0.00 -1.58 0.00 0.00 42.46 37.65 3h0r s ILE 287 CO 0.18 0.34 -0.21 -0.54 -1.23 0.00 0.00 174.94 173.49 3h0r s LYS 288 N 1.57 1.59 0.03 2.79 1.02 0.31 -4.99 119.74 122.07 3h0r s LYS 288 Ca 0.06 -0.79 -0.30 0.00 0.02 0.00 0.00 55.97 54.96 3h0r s LYS 288 Cb -0.15 -1.58 -0.04 0.00 -0.52 0.00 0.00 37.83 35.53 3h0r s LYS 288 CO 0.04 0.43 1.05 -1.21 -0.92 0.00 0.00 175.35 174.74 3h0r s GLU 289 N -0.66 4.52 0.37 1.68 2.02 -1.26 -0.32 118.70 125.05 3h0r s GLU 289 Ca 0.08 1.54 0.08 0.00 0.02 0.00 0.00 54.97 56.69 3h0r s GLU 289 Cb -0.08 -3.42 -0.07 0.00 0.10 0.00 0.00 34.13 30.66 3h0r s GLU 289 CO -0.00 -0.11 -0.04 0.14 0.02 0.00 0.00 175.26 175.27 3h0r s VAL 290 N 0.98 2.19 -0.07 2.63 -7.23 -0.45 -4.82 120.40 113.62 3h0r s VAL 290 Ca 0.54 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.62 3h0r s VAL 290 Cb -0.24 -2.80 -0.03 0.00 0.56 0.00 0.00 36.38 33.87 3h0r s VAL 290 CO 0.29 -0.12 -0.06 -0.44 -0.31 0.00 0.00 175.10 174.46 3h0r s SER 291 N -3.67 4.71 -0.44 4.85 0.01 -1.26 -0.29 113.70 117.61 3h0r s SER 291 Ca 0.34 -0.00 0.05 0.00 1.31 0.00 0.00 55.95 57.65 3h0r s SER 291 Cb 0.05 -1.21 0.20 0.00 0.21 0.00 0.00 66.02 65.27 3h0r s SER 291 CO 0.18 0.36 0.43 0.18 0.41 0.00 0.00 173.24 174.79 3h0r n LEU 292 N 2.23 0.24 0.29 2.44 4.77 -1.26 -4.72 117.00 120.99 3h0r n LEU 292 Ca -0.18 -4.59 0.18 0.00 -0.03 0.00 0.00 56.01 51.39 3h0r n LEU 292 Cb 0.53 0.39 0.92 0.00 -2.33 0.00 0.00 43.42 42.93 3h0r n LEU 292 CO 0.27 1.92 1.15 1.55 -1.33 0.00 0.00 177.39 180.95 3h0r h PRO 293 N 5.08 0.00 -0.01 3.23 0.13 -1.96 -1.96 132.00 136.51 3h0r h PRO 293 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 3h0r h PRO 293 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 3h0r h PRO 293 CO 0.45 0.00 -0.32 0.72 -0.23 0.00 0.00 178.00 178.62 3h0r n HIS 294 N -3.20 0.00 -0.11 1.56 8.25 -1.26 -4.66 115.22 115.80 3h0r n HIS 294 Ca -0.01 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.53 3h0r n HIS 294 Cb 0.31 0.00 0.42 0.00 1.12 0.00 0.00 29.99 31.85 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 1.99 0.98 0.00 1.59 -1.51 -1.72 -0.27 116.25 117.31 3h0r h VAL 295 Ca 0.00 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 65.27 3h0r h VAL 295 Cb 0.58 0.35 0.00 0.00 -2.13 0.00 0.00 31.29 30.10 3h0r h VAL 295 CO 0.00 0.11 0.04 0.07 -1.23 0.00 0.00 177.57 176.56 3h0r h LYS 296 N 0.58 0.00 -0.00 5.19 2.10 -1.83 0.43 116.57 123.04 3h0r h LYS 296 Ca 0.27 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.92 3h0r h LYS 296 Cb 0.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.65 3h0r h LYS 296 CO -0.08 0.00 -0.05 0.66 -2.00 0.00 0.00 179.45 177.98 3h0r n TYR 297 N -2.95 0.00 -0.21 0.07 4.01 -0.11 -4.26 117.16 113.71 3h0r n TYR 297 Ca -0.03 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.73 3h0r n TYR 297 Cb 0.11 -0.12 0.12 0.00 -0.31 0.00 0.00 39.34 39.14 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 0.59 0.15 -0.10 7.72 0.02 -0.25 -2.24 113.55 119.45 3h0r h SER 298 Ca 0.00 0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 60.96 3h0r h SER 298 Cb 0.27 0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.91 3h0r h SER 298 CO 0.00 0.08 -0.29 0.40 -1.14 0.00 0.00 176.83 175.89 3h0r h ILE 299 N 0.36 1.40 -0.14 3.27 1.08 -1.79 0.16 117.51 121.86 3h0r h ILE 299 Ca 0.33 -1.62 -0.13 0.00 -0.39 0.00 0.00 64.86 63.04 3h0r h ILE 299 Cb 0.46 2.19 -0.01 0.00 -3.07 0.00 0.00 36.82 36.39 3h0r h ILE 299 CO -0.36 0.47 -0.49 1.55 -0.69 0.00 0.00 178.15 178.63 3h0r h PRO 300 N -0.09 0.36 0.27 2.37 0.13 -1.85 -0.65 132.00 132.54 3h0r h PRO 300 Ca -0.01 -0.20 -0.01 0.00 -0.87 0.00 0.00 66.00 64.91 3h0r h PRO 300 Cb 0.91 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.04 3h0r h PRO 300 CO 0.06 0.77 -0.18 1.15 -0.23 0.00 0.00 178.00 179.57 3h0r h THR 301 N 0.28 0.61 -0.94 1.56 2.02 -1.17 -2.82 112.91 112.45 3h0r h THR 301 Ca 0.01 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.19 3h0r h THR 301 Cb 0.97 0.61 -0.05 0.00 -1.74 0.00 0.00 68.15 67.95 3h0r h THR 301 CO 0.08 0.00 0.58 0.22 0.37 0.00 0.00 175.52 176.77 3h0r h TYR 302 N -0.45 1.24 -0.10 3.16 3.20 -0.57 -1.35 116.97 122.09 3h0r h TYR 302 Ca -0.02 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 3h0r h TYR 302 Cb 0.38 -0.41 0.00 0.00 1.54 0.00 0.00 36.73 38.24 3h0r h TYR 302 CO -0.10 0.81 0.00 0.66 -1.64 0.00 0.00 178.16 177.89 3h0r n TYR 303 N -4.37 0.21 -0.08 -3.82 4.01 -0.26 -0.53 117.16 112.32 3h0r n TYR 303 Ca 0.11 -0.09 -0.16 0.00 -0.16 0.00 0.00 57.90 57.60 3h0r n TYR 303 Cb 0.05 -0.05 -0.06 0.00 -0.31 0.00 0.00 39.34 38.97 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 -0.08 0.86 0.13 -0.72 5.41 -0.92 -4.60 119.36 119.43 3h0r n ILE 304 Ca 0.04 -0.23 -0.14 0.00 1.00 0.00 0.00 62.75 63.43 3h0r n ILE 304 Cb 0.19 -1.66 -0.08 0.00 -0.71 0.00 0.00 39.64 37.38 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 -0.52 0.83 0.67 1.39 2.04 -1.06 -2.52 117.51 118.34 3h0r h ILE 305 Ca -0.39 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.21 3h0r h ILE 305 Cb 1.36 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 3h0r h ILE 305 CO -0.23 0.05 -0.49 0.00 0.00 0.00 0.00 178.15 177.48 3h0r h ALA 306 N 0.35 -1.20 -0.75 1.87 0.00 -1.06 -1.22 119.26 117.25 3h0r h ALA 306 Ca -0.03 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 54.78 3h0r h ALA 306 Cb 0.31 0.65 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 3h0r h ALA 306 CO 0.05 -1.20 0.49 -1.35 0.00 0.00 0.00 179.25 177.24 3h0r h PRO 307 N -1.12 0.49 0.80 0.00 0.11 -1.77 0.99 132.00 131.51 3h0r h PRO 307 Ca -0.09 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.95 3h0r h PRO 307 Cb 0.92 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.93 3h0r h PRO 307 CO 0.04 0.33 -0.38 0.77 -0.21 0.00 0.00 178.00 178.54 3h0r h SER 308 N 0.51 -0.91 -0.32 -2.05 0.02 -0.97 -0.63 113.55 109.21 3h0r h SER 308 Ca 0.36 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.32 3h0r h SER 308 Cb 0.69 0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 3h0r h SER 308 CO -0.12 -0.60 0.17 -0.33 -1.14 0.00 0.00 176.83 174.80 3h0r h GLU 309 N -1.14 0.50 -0.50 3.45 5.08 -1.08 -2.28 114.58 118.60 3h0r h GLU 309 Ca -0.11 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.21 3h0r h GLU 309 Cb 0.83 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 3h0r h GLU 309 CO 0.18 0.40 0.32 0.00 -1.00 0.00 0.00 179.01 178.91 3h0r h ALA 310 N 1.68 0.64 -0.98 3.43 0.00 -0.58 0.10 119.26 123.56 3h0r h ALA 310 Ca 0.13 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.03 3h0r h ALA 310 Cb 0.07 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.62 3h0r h ALA 310 CO -0.02 0.05 0.64 0.66 0.00 0.00 0.00 179.25 180.59 3h0r h SER 311 N 0.65 1.11 -0.16 0.00 4.64 -0.53 -0.33 113.55 118.94 3h0r h SER 311 Ca 0.19 -0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.36 3h0r h SER 311 Cb -0.05 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 61.78 3h0r h SER 311 CO -0.06 0.79 -0.38 -1.28 -0.87 0.00 0.00 176.83 175.03 3h0r h SER 312 N 1.30 0.60 0.87 4.97 0.87 -1.28 -2.92 113.55 117.97 3h0r h SER 312 Ca 0.37 -0.57 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 3h0r h SER 312 Cb -0.11 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.67 3h0r h SER 312 CO -0.09 1.07 0.00 0.78 -0.53 0.00 0.00 176.83 178.06 3h0r h ASN 313 N 0.17 0.00 -0.01 6.23 2.35 -0.48 -2.84 115.58 121.00 3h0r h ASN 313 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3h0r h ASN 313 Cb 0.99 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.36 3h0r h ASN 313 CO 0.08 0.00 -0.16 0.18 -1.65 0.00 0.00 177.43 175.89 3h0r n LEU 314 N -3.00 2.42 0.32 1.61 4.32 -0.16 -4.31 117.00 118.20 3h0r n LEU 314 Ca 0.00 -0.82 0.19 0.00 -0.02 0.00 0.00 56.01 55.35 3h0r n LEU 314 Cb 0.27 -0.01 1.05 0.00 -1.62 0.00 0.00 43.42 43.12 3h0r n LEU 314 CO 0.25 0.42 1.15 0.00 -1.22 0.00 0.00 177.39 177.99 3h0r h ALA 315 N 4.37 1.28 0.00 -1.18 0.00 -1.30 -2.94 119.26 119.49 3h0r h ALA 315 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h0r h ALA 315 Cb 0.84 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3h0r h ALA 315 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 179.25 179.32 3h0r h ARG 316 N 0.00 0.00 -5.70 0.00 0.11 -1.80 -3.41 114.38 103.58 3h0r h ARG 316 Ca -0.00 0.00 -0.61 0.00 0.10 0.00 0.00 59.98 59.47 3h0r h ARG 316 Cb 0.01 0.00 -0.13 0.00 1.11 0.00 0.00 29.97 30.96 3h0r h ARG 316 CO 0.00 0.00 0.72 0.71 0.10 0.00 0.00 179.97 181.50 3h0r s TYR 317 N -3.23 2.57 0.00 4.08 2.02 -1.11 -4.72 117.35 116.96 3h0r s TYR 317 Ca 0.07 -0.44 0.00 0.00 -0.37 0.00 0.00 57.07 56.33 3h0r s TYR 317 Cb 0.09 -4.40 0.00 0.00 -0.40 0.00 0.00 41.96 37.25 3h0r s TYR 317 CO 0.59 -1.77 0.05 -0.40 -1.57 0.00 0.00 175.55 172.45 3h0r n ASP 318 N 8.17 0.00 -0.02 2.29 5.68 -1.26 -4.80 116.55 126.61 3h0r n ASP 318 Ca -0.00 -1.00 -0.00 0.00 -0.50 0.00 0.00 54.79 53.28 3h0r n ASP 318 Cb 0.47 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.45 3h0r n ASP 318 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h0r n GLY 319 N 0.00 0.45 0.10 6.12 0.00 -1.25 -4.60 105.19 106.02 3h0r n GLY 319 Ca 0.00 -0.09 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.88 1.50 0.21 1.61 0.31 -1.26 -4.77 118.33 113.04 3h0r n VAL 320 Ca -0.00 -0.01 0.08 0.00 -0.01 0.00 0.00 64.34 64.40 3h0r n VAL 320 Cb 0.06 -2.14 -0.12 0.00 -0.91 0.00 0.00 33.84 30.73 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 -4.45 0.85 -3.65 5.55 1.74 -1.26 -5.04 116.66 110.39 3h0r n ARG 321 Ca -0.28 -0.11 -0.02 0.00 -0.77 0.00 0.00 57.85 56.68 3h0r n ARG 321 Cb 0.59 -1.35 -0.01 0.00 -1.02 0.00 0.00 32.46 30.67 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 -2.96 -0.10 0.00 -1.55 1.13 -1.26 -5.17 117.35 107.43 3h0r s TYR 322 Ca -0.03 -0.06 0.00 0.00 -1.41 0.00 0.00 57.07 55.58 3h0r s TYR 322 Cb 0.11 0.57 0.00 0.00 -1.10 0.00 0.00 41.96 41.54 3h0r s TYR 322 CO 0.68 -0.46 0.00 0.41 -2.51 0.00 0.00 175.55 173.67 3h0r n GLY 323 N -0.41 -0.08 3.76 5.49 0.00 -1.26 -4.29 105.19 108.40 3h0r n GLY 323 Ca -0.07 -1.03 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 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 2.63 -0.03 1.61 5.04 -0.22 -4.89 117.35 121.49 3h0r s TYR 324 Ca 0.00 1.48 -0.01 0.00 -2.44 0.00 0.00 57.07 56.10 3h0r s TYR 324 Cb 0.00 -3.53 0.03 0.00 0.35 0.00 0.00 41.96 38.81 3h0r s TYR 324 CO 0.00 -2.05 0.03 0.50 -1.34 0.00 0.00 175.55 172.70 3h0r s ARG 325 N -2.82 -0.00 0.53 4.97 3.52 -1.26 -3.84 118.95 120.04 3h0r s ARG 325 Ca 0.67 0.23 -0.20 0.00 -0.13 0.00 0.00 55.73 56.30 3h0r s ARG 325 Cb -0.33 -0.36 -0.08 0.00 -1.56 0.00 0.00 34.95 32.63 3h0r s ARG 325 CO 0.39 -0.21 0.84 0.00 -0.81 0.00 0.00 175.30 175.51 3h0r n ALA 326 N 4.50 -0.27 0.08 6.12 0.00 -1.26 -4.94 120.51 124.74 3h0r n ALA 326 Ca -0.21 0.07 -0.21 0.00 0.00 0.00 0.00 53.44 53.09 3h0r n ALA 326 Cb 0.50 -2.01 -0.12 0.00 0.00 0.00 0.00 19.45 17.82 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 0.74 0.61 -5.39 0.00 1.57 -1.98 -3.45 116.57 108.67 3h0r h LYS 327 Ca -0.46 -0.78 -0.66 0.00 -1.87 0.00 0.00 60.65 56.88 3h0r h LYS 327 Cb 1.37 0.25 -0.26 0.00 0.08 0.00 0.00 32.23 33.67 3h0r h LYS 327 CO 0.52 1.35 -0.76 -1.21 -0.57 0.00 0.00 179.45 178.78 3h0r s GLU 328 N -3.05 3.35 -0.28 3.15 8.01 -1.26 -5.10 118.70 123.52 3h0r s GLU 328 Ca -0.09 -0.67 -0.25 0.00 0.01 0.00 0.00 54.97 53.97 3h0r s GLU 328 Cb 0.06 -2.64 0.11 0.00 -4.31 0.00 0.00 34.13 27.35 3h0r s GLU 328 CO 0.93 0.25 0.95 1.52 0.01 0.00 0.00 175.26 178.91 3h0r s TYR 329 N 0.27 -0.56 -0.02 1.61 1.13 -1.26 -4.85 117.35 113.67 3h0r s TYR 329 Ca -0.09 1.36 0.07 0.00 -1.41 0.00 0.00 57.07 57.00 3h0r s TYR 329 Cb -0.15 0.34 -0.24 0.00 -1.10 0.00 0.00 41.96 40.81 3h0r s TYR 329 CO 0.05 -0.27 0.75 0.87 -2.51 0.00 0.00 175.55 174.45 3h0r h LYS 330 N 4.41 0.07 0.00 -3.49 1.57 -1.99 -3.48 116.57 113.67 3h0r h LYS 330 Ca -0.28 -0.13 -0.13 0.00 -1.87 0.00 0.00 60.65 58.24 3h0r h LYS 330 Cb 1.17 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.50 3h0r h LYS 330 CO 0.09 0.76 -0.08 -0.40 -0.57 0.00 0.00 179.45 179.25 3h0r n ASP 331 N -3.21 -0.50 0.06 0.86 5.75 -1.26 -5.05 116.55 113.20 3h0r n ASP 331 Ca -0.16 -1.78 -0.05 0.00 -0.01 0.00 0.00 54.79 52.79 3h0r n ASP 331 Cb 1.03 0.96 0.14 0.00 -1.03 0.00 0.00 41.12 42.23 3h0r n ASP 331 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 3h0r h ILE 332 N 1.41 1.34 0.11 2.12 6.09 -1.98 -0.97 117.51 125.63 3h0r h ILE 332 Ca -0.11 -1.76 0.01 0.00 -1.37 0.00 0.00 64.86 61.63 3h0r h ILE 332 Cb 0.48 1.81 -0.01 0.00 0.47 0.00 0.00 36.82 39.57 3h0r h ILE 332 CO 0.15 0.53 -0.13 0.15 -3.07 0.00 0.00 178.15 175.77 3h0r h PHE 333 N 0.26 -0.35 -0.86 2.19 3.57 -1.99 0.11 116.94 119.87 3h0r h PHE 333 Ca 0.01 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 3h0r h PHE 333 Cb 0.99 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.83 3h0r h PHE 333 CO 0.02 -0.20 0.44 0.93 -2.23 0.00 0.00 178.31 177.26 3h0r h GLU 334 N -0.28 1.22 -0.04 1.11 5.08 -1.91 0.84 114.58 120.60 3h0r h GLU 334 Ca 0.01 -0.16 0.02 0.00 -1.00 0.00 0.00 59.36 58.23 3h0r h GLU 334 Cb 0.28 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 3h0r h GLU 334 CO -0.05 0.92 -0.11 1.98 -1.00 0.00 0.00 179.01 180.75 3h0r h MET 335 N 1.21 -0.16 0.64 2.33 4.05 -0.80 0.46 114.93 122.66 3h0r h MET 335 Ca 0.30 0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.70 3h0r h MET 335 Cb 0.08 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 3h0r h MET 335 CO -0.04 -0.11 -0.41 1.88 0.23 0.00 0.00 176.91 178.46 3h0r h TYR 336 N -0.17 -1.09 0.00 1.39 0.05 -0.45 -1.53 116.97 115.17 3h0r h TYR 336 Ca 0.05 -0.01 -0.10 0.00 0.05 0.00 0.00 58.73 58.73 3h0r h TYR 336 Cb 0.24 0.39 -0.01 0.00 1.01 0.00 0.00 36.73 38.36 3h0r h TYR 336 CO -0.19 -0.61 -0.46 0.00 -1.05 0.00 0.00 178.16 175.85 3h0r h ALA 337 N -0.75 1.24 0.21 3.88 0.00 -0.65 -2.31 119.26 120.89 3h0r h ALA 337 Ca -0.08 -0.42 -0.31 0.00 0.00 0.00 0.00 54.91 54.10 3h0r h ALA 337 Cb 0.81 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.55 3h0r h ALA 337 CO 0.07 0.58 -1.41 0.00 0.00 0.00 0.00 179.25 178.49 3h0r h ARG 338 N 0.00 0.45 -0.81 0.00 3.08 -0.94 -2.38 114.38 113.78 3h0r h ARG 338 Ca -0.00 -0.77 0.11 0.00 0.07 0.00 0.00 59.98 59.39 3h0r h ARG 338 Cb 0.82 0.29 -0.08 0.00 0.08 0.00 0.00 29.97 31.07 3h0r h ARG 338 CO 0.06 1.37 0.44 1.15 -1.07 0.00 0.00 179.97 181.92 3h0r h THR 339 N 0.01 0.84 -0.01 2.04 2.02 -1.08 -0.87 112.91 115.86 3h0r h THR 339 Ca -0.26 -0.24 -0.09 0.00 0.77 0.00 0.00 66.41 66.59 3h0r h THR 339 Cb 2.03 0.08 0.01 0.00 -1.74 0.00 0.00 68.15 68.52 3h0r h THR 339 CO 0.22 0.13 -0.34 0.03 0.37 0.00 0.00 175.52 175.92 3h0r h ARG 340 N 0.71 0.26 -0.74 6.66 3.08 -1.50 0.11 114.38 122.95 3h0r h ARG 340 Ca 0.41 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 3h0r h ARG 340 Cb 0.45 0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.53 3h0r h ARG 340 CO -0.29 0.96 0.44 0.22 -1.07 0.00 0.00 179.97 180.23 3h0r h ASP 341 N -0.34 0.88 0.93 7.04 3.58 -1.31 -0.04 116.42 127.16 3h0r h ASP 341 Ca -0.04 -0.05 -0.22 0.00 0.42 0.00 0.00 57.03 57.14 3h0r h ASP 341 Cb 1.07 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.86 3h0r h ASP 341 CO 0.07 0.68 -1.07 -0.33 -2.88 0.00 0.00 179.24 175.71 3h0r h GLU 342 N 1.02 0.03 0.00 0.28 5.08 -1.18 -3.36 114.58 116.45 3h0r h GLU 342 Ca 0.27 -0.05 -0.25 0.00 -1.00 0.00 0.00 59.36 58.33 3h0r h GLU 342 Cb -0.04 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 3h0r h GLU 342 CO -0.05 0.99 -1.52 0.78 -1.00 0.00 0.00 179.01 178.21 3h0r h GLY 343 N 2.88 0.00 -4.93 -3.84 0.00 -0.39 -3.47 103.07 93.33 3h0r h GLY 343 Ca -0.04 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.69 3h0r h GLY 343 CO 0.13 0.00 -0.16 -1.36 0.00 0.00 0.00 176.54 175.16 3h0r s PHE 344 N -2.70 3.74 0.92 5.60 0.08 -0.06 -2.20 117.98 123.37 3h0r s PHE 344 Ca -0.03 1.06 -0.12 0.00 0.12 0.00 0.00 56.93 57.96 3h0r s PHE 344 Cb 0.08 -2.35 0.14 0.00 -0.57 0.00 0.00 43.02 40.33 3h0r s PHE 344 CO 0.82 0.62 1.14 0.20 -0.10 0.00 0.00 175.22 177.89 3h0r s GLY 345 N -1.03 1.58 0.17 4.36 0.00 -1.26 -4.81 107.32 106.32 3h0r s GLY 345 Ca 0.25 -0.53 -0.15 0.00 0.00 0.00 0.00 44.72 44.29 3h0r s GLY 345 CO 0.15 0.04 1.76 -0.56 0.00 0.00 0.00 173.10 174.48 3h0r h PRO 346 N -1.54 0.33 -0.29 2.90 0.13 -1.96 -0.65 132.00 130.92 3h0r h PRO 346 Ca -0.51 -0.02 -0.17 0.00 -0.87 0.00 0.00 66.00 64.44 3h0r h PRO 346 Cb 1.33 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 3h0r h PRO 346 CO 0.61 0.22 -0.49 1.49 -0.23 0.00 0.00 178.00 179.60 3h0r h GLU 347 N 0.34 0.80 -0.12 0.86 4.57 -1.94 -1.31 114.58 117.78 3h0r h GLU 347 Ca 0.19 -0.47 -0.00 0.00 -1.18 0.00 0.00 59.36 57.90 3h0r h GLU 347 Cb 0.17 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 3h0r h GLU 347 CO -0.19 1.10 0.07 0.28 -1.18 0.00 0.00 179.01 179.10 3h0r h VAL 348 N 0.63 1.07 -0.91 0.32 2.07 -1.84 -1.92 116.25 115.67 3h0r h VAL 348 Ca 0.03 -0.19 0.08 0.00 0.82 0.00 0.00 66.70 67.44 3h0r h VAL 348 Cb 1.07 0.98 -0.07 0.00 -1.52 0.00 0.00 31.29 31.76 3h0r h VAL 348 CO 0.11 0.06 0.57 0.11 0.02 0.00 0.00 177.57 178.44 3h0r h LYS 349 N 0.12 0.96 -0.70 1.57 1.57 -0.94 -0.97 116.57 118.17 3h0r h LYS 349 Ca 0.04 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 3h0r h LYS 349 Cb 0.04 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.10 3h0r h LYS 349 CO -0.01 0.63 0.38 0.00 -0.57 0.00 0.00 179.45 179.89 3h0r h ARG 350 N 0.99 0.98 -0.03 3.15 3.08 -0.76 -1.74 114.38 120.05 3h0r h ARG 350 Ca 0.42 -0.12 -0.18 0.00 0.07 0.00 0.00 59.98 60.17 3h0r h ARG 350 Cb 0.27 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3h0r h ARG 350 CO -0.21 0.74 -0.78 0.00 -1.07 0.00 0.00 179.97 178.65 3h0r h ARG 351 N 0.96 0.23 -0.29 0.04 3.08 -0.95 -1.22 114.38 116.23 3h0r h ARG 351 Ca 0.25 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 3h0r h ARG 351 Cb 0.05 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3h0r h ARG 351 CO -0.04 0.89 0.06 0.82 -1.07 0.00 0.00 179.97 180.64 3h0r h ILE 352 N 0.14 1.22 0.41 2.04 2.04 -1.06 0.12 117.51 122.42 3h0r h ILE 352 Ca -0.03 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 3h0r h ILE 352 Cb 1.36 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 3h0r h ILE 352 CO 0.12 0.24 -0.33 0.24 0.00 0.00 0.00 178.15 178.43 3h0r h MET 353 N 0.31 -0.71 -0.58 2.37 2.86 -1.23 -0.81 114.93 117.14 3h0r h MET 353 Ca 0.09 0.05 0.07 0.00 -2.06 0.00 0.00 59.70 57.85 3h0r h MET 353 Cb 0.30 0.16 -0.06 0.00 0.06 0.00 0.00 31.60 32.07 3h0r h MET 353 CO 0.00 -0.47 0.26 1.25 1.06 0.00 0.00 176.91 179.01 3h0r h LEU 354 N -0.73 0.32 -0.72 1.22 5.85 -1.23 -2.39 115.31 117.63 3h0r h LEU 354 Ca -0.04 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 3h0r h LEU 354 Cb 0.64 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 3h0r h LEU 354 CO -0.01 0.21 0.43 1.23 -0.34 0.00 0.00 178.44 179.95 3h0r h GLY 355 N 0.48 1.04 2.00 3.75 0.00 -0.53 -0.16 103.07 109.64 3h0r h GLY 355 Ca 0.28 -0.44 -0.09 0.00 0.00 0.00 0.00 47.33 47.08 3h0r h GLY 355 CO -0.24 0.42 -0.43 -0.91 0.00 0.00 0.00 176.54 175.38 3h0r h THR 356 N 0.98 1.30 0.32 4.70 1.35 -0.90 -2.25 112.91 118.40 3h0r h THR 356 Ca 0.26 -1.48 -0.02 0.00 -0.55 0.00 0.00 66.41 64.62 3h0r h THR 356 Cb -0.03 1.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 3h0r h THR 356 CO -0.05 0.42 -0.15 0.15 -0.25 0.00 0.00 175.52 175.64 3h0r h PHE 357 N 0.00 -0.40 -0.39 4.73 3.04 -1.11 -2.31 116.94 120.50 3h0r h PHE 357 Ca -0.00 -0.01 0.11 0.00 3.98 0.00 0.00 57.97 62.05 3h0r h PHE 357 Cb 0.77 0.13 -0.02 0.00 2.56 0.00 0.00 35.95 39.39 3h0r h PHE 357 CO 0.00 -0.05 0.39 0.00 -2.02 0.00 0.00 178.31 176.63 3h0r h ALA 358 N -0.39 2.12 0.00 2.41 0.00 -0.91 -0.28 119.26 122.21 3h0r h ALA 358 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3h0r h ALA 358 Cb 0.52 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3h0r h ALA 358 CO 0.07 -0.59 -0.90 1.28 0.00 0.00 0.00 179.25 179.11 3h0r n LEU 359 N -3.83 0.86 -4.77 0.00 4.77 -0.86 -3.64 117.00 109.53 3h0r n LEU 359 Ca 0.07 -0.36 -0.41 0.00 -0.03 0.00 0.00 56.01 55.28 3h0r n LEU 359 Cb 0.57 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 3h0r n LEU 359 CO 0.29 0.21 0.97 -0.94 -1.33 0.00 0.00 177.39 176.59 3h0r s SER 360 N -3.05 6.76 0.32 -1.43 1.04 -0.12 -4.64 113.70 112.59 3h0r s SER 360 Ca 0.08 2.68 -0.29 0.00 0.48 0.00 0.00 55.95 58.90 3h0r s SER 360 Cb 0.16 -2.65 -0.12 0.00 0.10 0.00 0.00 66.02 63.51 3h0r s SER 360 CO 0.83 -0.54 1.41 0.00 0.98 0.00 0.00 173.24 175.92 3h0r n ALA 361 N 0.77 1.72 0.00 5.32 0.00 -1.26 -1.21 120.51 125.85 3h0r n ALA 361 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 3h0r n ALA 361 Cb 0.42 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.54 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 1.18 3.27 0.00 0.00 0.00 -1.26 -4.72 105.19 103.65 3h0r n GLY 362 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.12 0.00 -0.13 1.61 4.01 -0.40 -4.80 117.16 116.32 3h0r n TYR 363 Ca 0.00 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.66 3h0r n TYR 363 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.03 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 0.51 -0.77 -0.72 5.03 -1.26 -1.51 116.97 118.26 3h0r h TYR 364 Ca 0.00 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.30 3h0r h TYR 364 Cb 0.01 -0.17 -0.04 0.00 1.55 0.00 0.00 36.73 38.09 3h0r h TYR 364 CO 0.00 0.35 0.43 -0.44 -1.32 0.00 0.00 178.16 177.18 3h0r h ASP 365 N 0.53 0.96 1.70 -2.11 3.32 -1.87 -1.65 116.42 117.30 3h0r h ASP 365 Ca 0.14 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3h0r h ASP 365 Cb -0.03 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.28 3h0r h ASP 365 CO -0.03 0.77 -0.10 0.00 -1.72 0.00 0.00 179.24 178.16 3h0r h ALA 366 N 1.22 0.94 -3.00 3.45 0.00 -1.85 -2.59 119.26 117.44 3h0r h ALA 366 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3h0r h ALA 366 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3h0r h ALA 366 CO -0.05 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.86 3h0r n TYR 367 N -2.74 0.00 0.07 0.00 4.02 -0.58 -4.57 117.16 113.35 3h0r n TYR 367 Ca 0.04 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.82 3h0r n TYR 367 Cb 0.49 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.77 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 -0.46 -0.26 -0.72 3.20 -1.45 0.16 116.97 117.45 3h0r h TYR 368 Ca 0.00 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 3h0r h TYR 368 Cb 0.00 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 3h0r h TYR 368 CO 0.00 -0.25 0.16 1.25 -1.64 0.00 0.00 178.16 177.68 3h0r h LEU 369 N -0.30 0.31 -0.38 2.82 5.85 -1.53 -0.80 115.31 121.29 3h0r h LEU 369 Ca 0.05 -0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.80 3h0r h LEU 369 Cb 0.36 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.25 3h0r h LEU 369 CO -0.15 0.26 -0.00 0.50 -0.34 0.00 0.00 178.44 178.71 3h0r h LYS 370 N 0.34 0.09 -0.99 1.25 1.63 -1.05 -1.72 116.57 116.12 3h0r h LYS 370 Ca 0.09 -0.01 0.05 0.00 -0.85 0.00 0.00 60.65 59.93 3h0r h LYS 370 Cb -0.00 -0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 31.55 3h0r h LYS 370 CO -0.02 0.06 0.64 0.00 -3.45 0.00 0.00 179.45 176.69 3h0r h ALA 371 N 1.33 1.38 0.00 5.00 0.00 -0.32 -0.89 119.26 125.76 3h0r h ALA 371 Ca 0.18 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 3h0r h ALA 371 Cb 0.26 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3h0r h ALA 371 CO -0.31 0.51 -0.25 1.96 0.00 0.00 0.00 179.25 181.15 3h0r h GLN 372 N 1.22 0.00 0.04 0.00 1.08 -0.31 -0.05 115.11 117.09 3h0r h GLN 372 Ca 0.40 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.48 3h0r h GLN 372 Cb 0.05 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.50 3h0r h GLN 372 CO -0.14 0.25 -0.51 0.87 -0.95 0.00 0.00 178.83 178.36 3h0r h LYS 373 N 0.00 0.28 -0.41 1.46 1.57 -0.46 -3.05 116.57 115.95 3h0r h LYS 373 Ca -0.00 -0.35 0.07 0.00 -1.87 0.00 0.00 60.65 58.49 3h0r h LYS 373 Cb 0.72 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 3h0r h LYS 373 CO 0.03 1.08 0.28 0.28 -0.57 0.00 0.00 179.45 180.56 3h0r h VAL 374 N -0.37 0.94 -0.59 0.50 2.07 -0.99 -0.52 116.25 117.28 3h0r h VAL 374 Ca -0.08 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 3h0r h VAL 374 Cb 1.30 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 3h0r h VAL 374 CO 0.10 0.05 0.16 -0.09 0.02 0.00 0.00 177.57 177.81 3h0r h ARG 375 N 0.27 0.90 -0.25 1.57 2.43 -1.03 -1.59 114.38 116.69 3h0r h ARG 375 Ca 0.18 -0.18 -0.15 0.00 -0.81 0.00 0.00 59.98 59.01 3h0r h ARG 375 Cb 0.37 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3h0r h ARG 375 CO -0.04 0.80 -0.47 -0.09 -1.51 0.00 0.00 179.97 178.66 3h0r h ARG 376 N 0.87 0.67 -0.32 0.20 2.43 -1.00 -0.88 114.38 116.35 3h0r h ARG 376 Ca 0.19 -0.38 0.04 0.00 -0.81 0.00 0.00 59.98 59.02 3h0r h ARG 376 Cb 0.29 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.83 3h0r h ARG 376 CO -0.00 1.00 0.10 -0.07 -1.51 0.00 0.00 179.97 179.48 3h0r h LEU 377 N 0.53 0.10 -0.72 3.80 3.38 -1.10 -0.49 115.31 120.81 3h0r h LEU 377 Ca 0.03 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 3h0r h LEU 377 Cb 1.02 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 3h0r h LEU 377 CO 0.10 0.09 0.35 0.40 0.09 0.00 0.00 178.44 179.47 3h0r h ILE 378 N 0.23 1.23 -0.63 1.22 2.04 -1.17 -0.90 117.51 119.54 3h0r h ILE 378 Ca 0.14 -0.65 -0.04 0.00 1.00 0.00 0.00 64.86 65.31 3h0r h ILE 378 Cb 0.13 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 3h0r h ILE 378 CO -0.16 0.27 0.23 0.74 0.00 0.00 0.00 178.15 179.23 3h0r h THR 379 N 1.01 1.24 -0.33 -0.27 2.02 -0.92 -2.87 112.91 112.78 3h0r h THR 379 Ca 0.25 -0.78 -0.09 0.00 0.77 0.00 0.00 66.41 66.56 3h0r h THR 379 Cb 0.11 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 3h0r h THR 379 CO -0.03 0.30 -0.17 0.78 0.37 0.00 0.00 175.52 176.77 3h0r h ASN 380 N 0.88 0.60 -0.40 4.18 2.35 -0.58 -2.10 115.58 120.51 3h0r h ASN 380 Ca 0.21 -0.18 0.08 0.00 -0.55 0.00 0.00 56.30 55.86 3h0r h ASN 380 Cb 0.24 -0.16 -0.09 0.00 0.05 0.00 0.00 38.32 38.37 3h0r h ASN 380 CO -0.01 0.78 -0.21 0.44 -1.65 0.00 0.00 177.43 176.77 3h0r h ASP 381 N 0.54 -0.73 -0.03 5.81 3.32 -0.96 -2.12 116.42 122.26 3h0r h ASP 381 Ca 0.09 0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.30 3h0r h ASP 381 Cb 0.60 0.38 -0.00 0.00 0.22 0.00 0.00 39.33 40.53 3h0r h ASP 381 CO 0.04 -0.24 0.02 -0.26 -1.72 0.00 0.00 179.24 177.08 3h0r h PHE 382 N -0.14 0.04 -0.81 4.55 0.04 -1.30 -0.73 116.94 118.59 3h0r h PHE 382 Ca 0.19 0.00 0.06 0.00 2.80 0.00 0.00 57.97 61.02 3h0r h PHE 382 Cb 0.45 -0.01 -0.05 0.00 2.20 0.00 0.00 35.95 38.53 3h0r h PHE 382 CO -0.45 0.06 0.53 -0.07 -0.60 0.00 0.00 178.31 177.78 3h0r h LEU 383 N 0.02 0.80 -0.05 1.54 3.38 -1.17 0.15 115.31 119.97 3h0r h LEU 383 Ca 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3h0r h LEU 383 Cb 0.03 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.61 3h0r h LEU 383 CO -0.00 0.52 -0.16 0.50 0.09 0.00 0.00 178.44 179.39 3h0r h LYS 384 N 0.91 0.20 -0.69 1.13 3.64 -1.18 -2.95 116.57 117.63 3h0r h LYS 384 Ca 0.34 -0.15 0.15 0.00 -1.27 0.00 0.00 60.65 59.72 3h0r h LYS 384 Cb 0.18 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.98 3h0r h LYS 384 CO -0.12 0.77 0.47 0.00 -2.27 0.00 0.00 179.45 178.30 3h0r h ALA 385 N 0.44 2.23 0.00 5.00 0.00 -0.45 0.98 119.26 127.46 3h0r h ALA 385 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h0r h ALA 385 Cb 0.78 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3h0r h ALA 385 CO 0.03 -0.41 0.00 1.19 0.00 0.00 0.00 179.25 180.06 3h0r n PHE 386 N -4.45 0.00 0.07 0.00 3.72 0.47 -2.14 117.46 115.13 3h0r n PHE 386 Ca 0.13 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.44 3h0r n PHE 386 Cb 0.55 -0.18 0.02 0.00 -0.94 0.00 0.00 39.48 38.94 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 0.30 0.00 -1.08 5.08 -0.74 -3.34 114.58 114.80 3h0r h GLU 387 Ca 0.00 -0.28 -0.25 0.00 -1.00 0.00 0.00 59.36 57.83 3h0r h GLU 387 Cb 0.16 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.43 3h0r h GLU 387 CO 0.00 0.95 -2.05 0.39 -1.00 0.00 0.00 179.01 177.30 3h0r n GLU 388 N -3.77 0.66 -4.36 2.33 1.02 -1.00 -5.03 120.64 110.50 3h0r n GLU 388 Ca -0.04 0.03 -0.18 0.00 -0.02 0.00 0.00 57.16 56.95 3h0r n GLU 388 Cb 0.74 -1.61 -0.10 0.00 -0.02 0.00 0.00 31.44 30.45 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 -2.79 1.08 -0.22 2.62 -7.23 -0.91 -4.97 120.40 107.98 3h0r s VAL 389 Ca -0.08 -2.03 0.06 0.00 -1.81 0.00 0.00 61.98 58.12 3h0r s VAL 389 Cb 0.08 -2.45 -0.18 0.00 0.56 0.00 0.00 36.38 34.39 3h0r s VAL 389 CO 0.84 -0.24 -0.12 0.47 -0.31 0.00 0.00 175.10 175.73 3h0r n ASP 390 N -0.48 1.63 -4.19 4.85 8.00 -0.42 -4.42 116.55 121.51 3h0r n ASP 390 Ca -0.04 -0.09 -0.11 0.00 0.71 0.00 0.00 54.79 55.26 3h0r n ASP 390 Cb 0.64 0.04 -0.10 0.00 -0.02 0.00 0.00 41.12 41.68 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 -2.47 0.44 -0.12 2.53 -7.23 -0.86 -4.35 120.40 108.34 3h0r s VAL 391 Ca -0.25 -1.94 0.02 0.00 -1.81 0.00 0.00 61.98 58.00 3h0r s VAL 391 Cb 0.07 -2.01 -0.00 0.00 0.56 0.00 0.00 36.38 35.00 3h0r s VAL 391 CO 0.61 -0.55 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.04 3h0r s ILE 392 N -3.81 2.48 0.12 -0.62 1.01 -0.02 -1.05 121.20 119.31 3h0r s ILE 392 Ca 0.22 -0.86 0.08 0.00 0.00 0.00 0.00 60.65 60.09 3h0r s ILE 392 Cb 0.07 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 3h0r s ILE 392 CO 0.01 0.54 -0.13 0.00 0.00 0.00 0.00 174.94 175.36 3h0r s ALA 393 N 0.47 2.83 0.17 9.38 0.00 -0.68 0.12 121.76 134.06 3h0r s ALA 393 Ca -0.13 -1.33 -0.24 0.00 0.00 0.00 0.00 51.96 50.26 3h0r s ALA 393 Cb -0.17 -0.76 0.06 0.00 0.00 0.00 0.00 23.12 22.25 3h0r s ALA 393 CO 0.05 0.60 0.81 -1.54 0.00 0.00 0.00 175.76 175.68 3h0r s SER 394 N -2.28 -0.30 0.63 0.00 1.04 -0.54 -4.54 113.70 107.71 3h0r s SER 394 Ca 0.20 -0.34 -0.18 0.00 0.48 0.00 0.00 55.95 56.11 3h0r s SER 394 Cb -0.11 0.57 -0.02 0.00 0.10 0.00 0.00 66.02 66.56 3h0r s SER 394 CO 0.12 -1.01 1.26 -2.65 0.98 0.00 0.00 173.24 171.94 3h0r n PRO 395 N -0.42 1.15 -0.01 4.02 -0.02 -1.26 0.38 135.00 138.84 3h0r n PRO 395 Ca -0.08 0.45 -0.07 0.00 -2.02 0.00 0.00 63.50 61.78 3h0r n PRO 395 Cb 0.61 -2.49 0.12 0.00 -0.02 0.00 0.00 33.50 31.72 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 0.62 1.29 -3.78 3.45 2.02 -1.59 -3.40 112.91 111.52 3h0r h THR 396 Ca -0.51 -1.50 -0.20 0.00 0.77 0.00 0.00 66.41 64.97 3h0r h THR 396 Cb 1.34 1.48 -0.25 0.00 -1.74 0.00 0.00 68.15 68.98 3h0r h THR 396 CO 0.53 0.48 -0.69 -0.89 0.37 0.00 0.00 175.52 175.32 3h0r s THR 397 N -4.32 0.04 -0.48 3.16 2.01 -1.26 -4.38 115.64 110.41 3h0r s THR 397 Ca -0.08 -0.34 0.25 0.00 0.31 0.00 0.00 61.69 61.84 3h0r s THR 397 Cb 0.13 -0.13 0.27 0.00 0.01 0.00 0.00 72.50 72.78 3h0r s THR 397 CO 0.82 -0.19 1.75 1.55 -0.69 0.00 0.00 174.62 177.86 3h0r h PRO 398 N 5.54 0.00 -4.85 4.92 0.13 -1.88 -3.47 132.00 132.39 3h0r h PRO 398 Ca -0.27 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.55 3h0r h PRO 398 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.19 3h0r h PRO 398 CO 0.46 0.00 -0.65 0.95 -0.23 0.00 0.00 178.00 178.53 3h0r s THR 399 N -3.30 0.68 0.71 1.56 -4.23 -1.26 -0.90 115.64 108.90 3h0r s THR 399 Ca 0.05 -1.99 -0.12 0.00 -1.18 0.00 0.00 61.69 58.45 3h0r s THR 399 Cb 0.10 -2.29 0.02 0.00 1.34 0.00 0.00 72.50 71.67 3h0r s THR 399 CO 0.45 -0.33 1.08 -0.76 -0.54 0.00 0.00 174.62 174.53 3h0r s LEU 400 N -3.22 3.18 -0.13 4.79 1.43 -1.26 -4.95 118.68 118.51 3h0r s LEU 400 Ca 0.28 1.79 -0.41 0.00 -1.03 0.00 0.00 54.13 54.77 3h0r s LEU 400 Cb 0.06 -4.52 -0.19 0.00 0.03 0.00 0.00 46.19 41.58 3h0r s LEU 400 CO 0.07 -1.70 1.32 -2.65 0.23 0.00 0.00 176.35 173.63 3h0r n PRO 401 N -3.05 0.38 -2.56 1.29 -0.02 -1.26 -4.96 135.00 124.82 3h0r n PRO 401 Ca 0.09 0.14 -0.23 0.00 -2.02 0.00 0.00 63.50 61.48 3h0r n PRO 401 Cb 0.53 -1.69 0.07 0.00 -0.02 0.00 0.00 33.50 32.39 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 1.19 2.34 0.33 6.00 -0.12 -1.26 -4.85 117.98 121.61 3h0r s PHE 402 Ca 0.94 -0.06 -0.02 0.00 -0.05 0.00 0.00 56.93 57.73 3h0r s PHE 402 Cb -1.23 -2.91 -0.04 0.00 -0.63 0.00 0.00 43.02 38.21 3h0r s PHE 402 CO 0.61 -1.29 0.57 0.15 -0.05 0.00 0.00 175.22 175.22 3h0r s LYS 403 N -4.98 3.55 0.43 1.99 1.02 -1.26 -1.54 119.74 118.95 3h0r s LYS 403 Ca 0.61 -0.15 -0.25 0.00 0.02 0.00 0.00 55.97 56.20 3h0r s LYS 403 Cb -0.08 -2.63 -0.09 0.00 -0.52 0.00 0.00 37.83 34.50 3h0r s LYS 403 CO 0.42 0.15 1.34 1.19 -0.92 0.00 0.00 175.35 177.52 3h0r n PHE 404 N -1.45 2.36 -0.16 3.18 3.72 -1.21 -2.05 117.46 121.85 3h0r n PHE 404 Ca -0.03 0.48 0.00 0.00 -0.05 0.00 0.00 57.45 57.85 3h0r n PHE 404 Cb 0.55 -2.41 0.00 0.00 -0.94 0.00 0.00 39.48 36.68 3h0r n PHE 404 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h0r n GLY 405 N 0.72 2.56 0.17 1.37 0.00 -1.26 -4.87 105.19 103.88 3h0r n GLY 405 Ca 0.06 0.00 -0.02 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 2.07 0.12 -0.30 1.61 4.81 -1.82 -3.26 114.58 117.82 3h0r h GLU 406 Ca 0.00 -0.07 -0.24 0.00 -0.13 0.00 0.00 59.36 58.92 3h0r h GLU 406 Cb 0.00 0.00 -0.27 0.00 0.63 0.00 0.00 28.75 29.12 3h0r h GLU 406 CO 0.00 0.60 -0.80 0.54 -0.73 0.00 0.00 179.01 178.62 3h0r n ARG 407 N -3.95 1.95 -0.00 1.92 1.74 -1.26 -4.65 116.66 112.41 3h0r n ARG 407 Ca -0.02 -3.37 0.06 0.00 -0.77 0.00 0.00 57.85 53.76 3h0r n ARG 407 Cb 0.53 -1.53 -0.09 0.00 -1.02 0.00 0.00 32.46 30.35 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 -0.62 0.26 0.23 0.55 4.77 -1.23 -3.88 117.00 117.08 3h0r n LEU 408 Ca 0.22 -0.21 -0.10 0.00 -0.03 0.00 0.00 56.01 55.89 3h0r n LEU 408 Cb 0.88 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.92 3h0r n LEU 408 CO 0.11 0.06 0.35 -0.08 -1.33 0.00 0.00 177.39 176.50 3h0r h GLU 409 N 0.00 -0.60 -4.88 3.23 4.81 -1.83 -3.40 114.58 111.92 3h0r h GLU 409 Ca 0.00 0.04 -0.65 0.00 -0.13 0.00 0.00 59.36 58.62 3h0r h GLU 409 Cb 0.47 0.14 -0.19 0.00 0.63 0.00 0.00 28.75 29.79 3h0r h GLU 409 CO 0.00 -0.40 -0.55 1.21 -0.73 0.00 0.00 179.01 178.54 3h0r s ASN 410 N -3.86 5.71 0.48 1.04 2.47 -1.26 -4.98 114.94 114.54 3h0r s ASN 410 Ca -0.09 -0.18 0.25 0.00 0.42 0.00 0.00 52.86 53.26 3h0r s ASN 410 Cb 0.01 -2.05 1.30 0.00 -1.45 0.00 0.00 41.25 39.06 3h0r s ASN 410 CO 0.27 -0.09 1.86 -0.65 -3.72 0.00 0.00 177.10 174.78 3h0r h PRO 411 N 8.34 0.18 -0.90 0.43 0.11 -1.84 0.23 132.00 138.56 3h0r h PRO 411 Ca -0.35 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.80 3h0r h PRO 411 Cb 1.18 -0.04 -0.06 0.00 0.11 0.00 0.00 31.00 32.19 3h0r h PRO 411 CO 0.58 0.12 0.59 0.82 -0.21 0.00 0.00 178.00 179.89 3h0r h ILE 412 N 0.19 1.10 -0.19 4.15 2.04 -1.94 -0.95 117.51 121.91 3h0r h ILE 412 Ca 0.47 -0.36 0.01 0.00 1.00 0.00 0.00 64.86 65.98 3h0r h ILE 412 Cb 1.52 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 3h0r h ILE 412 CO -0.10 0.19 0.13 -0.33 0.00 0.00 0.00 178.15 178.04 3h0r h GLU 413 N 1.06 0.19 -0.35 2.37 5.08 -1.24 0.07 114.58 121.76 3h0r h GLU 413 Ca 0.38 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.57 3h0r h GLU 413 Cb 0.14 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 3h0r h GLU 413 CO -0.13 0.12 -0.41 1.98 -1.00 0.00 0.00 179.01 179.57 3h0r h MET 414 N 0.19 0.90 -0.66 2.33 4.05 -1.26 -3.21 114.93 117.26 3h0r h MET 414 Ca 0.07 -0.50 0.00 0.00 -0.28 0.00 0.00 59.70 59.00 3h0r h MET 414 Cb 0.06 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.86 3h0r h MET 414 CO -0.01 1.14 0.42 1.88 0.23 0.00 0.00 176.91 180.57 3h0r h TYR 415 N 0.71 0.85 0.00 1.39 0.05 -0.78 -2.44 116.97 116.74 3h0r h TYR 415 Ca 0.05 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.84 3h0r h TYR 415 Cb 1.00 -0.28 0.00 0.00 1.01 0.00 0.00 36.73 38.46 3h0r h TYR 415 CO 0.07 0.56 0.00 1.28 -1.05 0.00 0.00 178.16 179.01 3h0r n LEU 416 N -4.42 0.00 0.27 3.88 4.77 -0.91 -1.41 117.00 119.18 3h0r n LEU 416 Ca 0.07 0.41 0.13 0.00 -0.03 0.00 0.00 56.01 56.60 3h0r n LEU 416 Cb 0.06 -0.41 0.77 0.00 -2.33 0.00 0.00 43.42 41.51 3h0r n LEU 416 CO 0.36 -0.24 1.01 0.28 -1.33 0.00 0.00 177.39 177.47 3h0r h SER 417 N 0.00 0.00 0.02 -1.43 0.02 -1.57 -3.25 113.55 107.34 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 0.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.71 3h0r h SER 417 CO 0.00 0.09 -0.09 0.47 -1.14 0.00 0.00 176.83 176.17 3h0r n ASP 418 N -3.67 1.95 0.14 3.07 8.00 -0.50 -4.54 116.55 121.00 3h0r n ASP 418 Ca -0.02 -1.57 0.15 0.00 0.71 0.00 0.00 54.79 54.07 3h0r n ASP 418 Cb 0.20 0.07 0.72 0.00 -0.02 0.00 0.00 41.12 42.09 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 2.92 0.74 -0.00 0.53 3.07 -1.74 -0.26 117.51 122.77 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 0.68 0.85 0.00 0.00 -0.27 0.00 0.00 36.82 38.08 3h0r h ILE 419 CO 0.00 0.00 -0.85 0.18 -1.05 0.00 0.00 178.15 176.43 3h0r n LEU 420 N -4.26 1.03 -0.10 0.16 4.77 -1.26 -4.55 117.00 112.78 3h0r n LEU 420 Ca 0.03 -0.44 -0.12 0.00 -0.03 0.00 0.00 56.01 55.45 3h0r n LEU 420 Cb 0.36 -0.04 -0.12 0.00 -2.33 0.00 0.00 43.42 41.28 3h0r n LEU 420 CO 0.33 0.24 -1.14 0.35 -1.33 0.00 0.00 177.39 175.84 3h0r n THR 421 N -1.32 1.24 -0.11 -5.08 -2.24 -0.17 -4.57 114.28 102.03 3h0r n THR 421 Ca 0.05 -0.64 -0.02 0.00 -2.27 0.00 0.00 64.05 61.17 3h0r n THR 421 Cb 0.35 -0.87 0.21 0.00 -2.10 0.00 0.00 70.33 67.92 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 1.22 -1.00 2.28 -1.51 -1.39 -3.11 116.25 112.75 3h0r h VAL 422 Ca -0.49 -0.80 0.18 0.00 -1.23 0.00 0.00 66.70 64.36 3h0r h VAL 422 Cb 1.95 0.71 -0.10 0.00 -2.13 0.00 0.00 31.29 31.72 3h0r h VAL 422 CO -0.02 0.30 0.62 -0.65 -1.23 0.00 0.00 177.57 176.58 3h0r h PRO 423 N 0.75 0.74 -0.26 5.19 0.11 -1.84 -0.57 132.00 136.12 3h0r h PRO 423 Ca 0.16 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.15 3h0r h PRO 423 Cb 0.30 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 3h0r h PRO 423 CO 0.00 0.49 -0.18 0.00 -0.21 0.00 0.00 178.00 178.10 3h0r h ALA 424 N 1.63 1.21 -0.41 -0.75 0.00 -1.85 -2.09 119.26 116.99 3h0r h ALA 424 Ca 0.56 -0.30 -0.16 0.00 0.00 0.00 0.00 54.91 55.02 3h0r h ALA 424 Cb 0.88 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3h0r h ALA 424 CO -0.35 0.51 -0.35 -0.91 0.00 0.00 0.00 179.25 178.15 3h0r h ASN 425 N 0.42 1.02 -0.78 0.00 4.21 -1.28 0.99 115.58 120.15 3h0r h ASN 425 Ca 0.07 -0.45 0.04 0.00 1.21 0.00 0.00 56.30 57.17 3h0r h ASN 425 Cb 0.56 -0.28 -0.05 0.00 -1.12 0.00 0.00 38.32 37.43 3h0r h ASN 425 CO 0.04 1.25 0.49 -0.07 -1.29 0.00 0.00 177.43 177.85 3h0r h LEU 426 N 0.79 0.79 -0.12 1.61 3.38 -1.12 -2.39 115.31 118.24 3h0r h LEU 426 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3h0r h LEU 426 Cb 0.95 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.53 3h0r h LEU 426 CO 0.09 0.53 -0.21 0.00 0.09 0.00 0.00 178.44 178.95 3h0r n ALA 427 N -2.33 2.91 -1.10 1.53 0.00 -0.81 -4.86 120.51 115.85 3h0r n ALA 427 Ca 0.09 -0.26 -0.04 0.00 0.00 0.00 0.00 53.44 53.24 3h0r n ALA 427 Cb 0.11 -1.29 -0.02 0.00 0.00 0.00 0.00 19.45 18.26 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 1.41 0.65 3.86 0.00 0.00 -0.54 -4.98 105.19 105.58 3h0r n GLY 428 Ca 0.10 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.80 4.04 0.58 0.99 1.43 0.23 -1.73 118.68 123.41 3h0r s LEU 429 Ca 0.00 1.17 -0.18 0.00 -1.03 0.00 0.00 54.13 54.08 3h0r s LEU 429 Cb 0.00 -3.98 -0.04 0.00 0.03 0.00 0.00 46.19 42.20 3h0r s LEU 429 CO 0.00 -0.22 1.13 -2.16 0.23 0.00 0.00 176.35 175.33 3h0r s PRO 430 N -3.14 3.19 -0.14 1.29 0.04 -1.26 -4.60 135.00 130.39 3h0r s PRO 430 Ca 0.52 1.56 -0.19 0.00 0.04 0.00 0.00 61.00 62.93 3h0r s PRO 430 Cb -0.10 -1.99 0.05 0.00 0.04 0.00 0.00 34.50 32.50 3h0r s PRO 430 CO 0.21 -0.97 0.50 0.00 0.04 0.00 0.00 177.00 176.78 3h0r s ALA 431 N -1.92 -1.25 0.02 8.56 0.00 -0.11 -1.86 121.76 125.20 3h0r s ALA 431 Ca 0.71 1.22 0.04 0.00 0.00 0.00 0.00 51.96 53.93 3h0r s ALA 431 Cb -0.23 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.32 3h0r s ALA 431 CO 0.31 -0.26 -0.11 -1.50 0.00 0.00 0.00 175.76 174.20 3h0r s ILE 432 N -0.22 0.86 -0.12 0.00 2.07 -0.61 -1.22 121.20 121.96 3h0r s ILE 432 Ca -0.04 -0.75 0.02 0.00 -1.41 0.00 0.00 60.65 58.46 3h0r s ILE 432 Cb -0.03 -0.78 -0.01 0.00 0.13 0.00 0.00 42.46 41.77 3h0r s ILE 432 CO 0.03 0.03 -0.18 -0.55 -1.91 0.00 0.00 174.94 172.36 3h0r s SER 433 N -0.81 3.57 -0.06 4.50 0.15 -0.31 -1.35 113.70 119.39 3h0r s SER 433 Ca 0.01 -0.45 -0.00 0.00 0.70 0.00 0.00 55.95 56.21 3h0r s SER 433 Cb -0.06 -1.52 0.03 0.00 -1.71 0.00 0.00 66.02 62.75 3h0r s SER 433 CO 0.00 0.15 -0.02 -0.51 1.20 0.00 0.00 173.24 174.06 3h0r s ILE 434 N 0.44 0.44 -0.01 6.45 -1.16 0.80 -2.26 121.20 125.89 3h0r s ILE 434 Ca -0.13 0.01 -0.31 0.00 -0.51 0.00 0.00 60.65 59.71 3h0r s ILE 434 Cb -0.17 -0.53 -0.10 0.00 0.61 0.00 0.00 42.46 42.27 3h0r s ILE 434 CO 0.06 0.24 1.95 -2.65 -2.81 0.00 0.00 174.94 171.73 3h0r n PRO 435 N 4.62 2.62 -0.01 3.50 -0.02 -1.26 -0.88 135.00 143.57 3h0r n PRO 435 Ca -0.16 0.96 0.03 0.00 -2.02 0.00 0.00 63.50 62.31 3h0r n PRO 435 Cb 0.50 -2.89 -0.08 0.00 -0.02 0.00 0.00 33.50 31.02 3h0r n PRO 435 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3h0r n ILE 436 N 5.45 0.12 -3.78 4.25 -5.35 0.41 -4.88 119.36 115.58 3h0r n ILE 436 Ca 0.21 -0.27 -0.04 0.00 -0.27 0.00 0.00 62.75 62.39 3h0r n ILE 436 Cb 0.37 0.08 -0.01 0.00 -1.74 0.00 0.00 39.64 38.34 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 -2.62 -1.58 -0.12 -1.28 0.00 -1.22 -4.88 121.76 110.07 3h0r s ALA 437 Ca -0.04 0.03 0.01 0.00 0.00 0.00 0.00 51.96 51.96 3h0r s ALA 437 Cb 0.06 0.67 0.02 0.00 0.00 0.00 0.00 23.12 23.87 3h0r s ALA 437 CO 0.42 -1.05 -0.15 -1.58 0.00 0.00 0.00 175.76 173.41 3h0r s TRP 438 N -3.28 1.99 -0.14 0.00 0.52 -1.26 -1.36 118.94 115.40 3h0r s TRP 438 Ca 0.13 -0.97 0.00 0.00 0.02 0.00 0.00 56.10 55.28 3h0r s TRP 438 Cb -0.02 -1.45 0.02 0.00 -1.15 0.00 0.00 33.47 30.88 3h0r s TRP 438 CO 0.03 -0.51 -0.14 0.15 0.02 0.00 0.00 176.95 176.50 3h0r s LYS 439 N 1.10 2.27 -1.48 4.98 -0.14 0.11 -4.65 119.74 121.94 3h0r s LYS 439 Ca -0.04 -0.55 -0.06 0.00 -1.36 0.00 0.00 55.97 53.96 3h0r s LYS 439 Cb -0.14 -2.08 0.02 0.00 -1.68 0.00 0.00 37.83 33.95 3h0r s LYS 439 CO -0.03 -0.22 0.53 -0.25 -0.76 0.00 0.00 175.35 174.61 3h0r n ASP 440 N 4.73 -5.39 0.00 2.83 8.00 -1.26 -1.97 116.55 123.49 3h0r n ASP 440 Ca -0.17 -0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.05 3h0r n ASP 440 Cb 0.50 -4.39 0.00 0.00 -0.02 0.00 0.00 41.12 37.21 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 -1.38 1.09 3.40 0.44 0.00 -1.26 -5.05 105.19 102.43 3h0r n GLY 441 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 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 2.41 0.64 0.99 1.43 -0.83 -4.89 118.68 118.42 3h0r s LEU 442 Ca 0.00 -0.34 -0.18 0.00 -1.03 0.00 0.00 54.13 52.58 3h0r s LEU 442 Cb 0.00 -1.45 -0.01 0.00 0.03 0.00 0.00 46.19 44.75 3h0r s LEU 442 CO 0.00 0.33 1.23 -2.84 0.23 0.00 0.00 176.35 175.30 3h0r s PRO 443 N -0.73 2.69 -0.04 1.29 0.02 -1.26 -0.71 135.00 136.26 3h0r s PRO 443 Ca 0.11 1.88 0.03 0.00 0.02 0.00 0.00 61.00 63.04 3h0r s PRO 443 Cb -0.10 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.53 3h0r s PRO 443 CO 0.00 -1.44 -0.14 0.08 -0.33 0.00 0.00 177.00 175.18 3h0r s VAL 444 N -1.62 1.16 -0.12 3.83 1.01 -0.46 -4.68 120.40 119.53 3h0r s VAL 444 Ca 0.78 -0.57 -0.06 0.00 0.00 0.00 0.00 61.98 62.14 3h0r s VAL 444 Cb -0.32 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 3h0r s VAL 444 CO 0.37 0.34 0.09 -0.83 0.00 0.00 0.00 175.10 175.08 3h0r s GLY 445 N 0.13 2.04 -0.14 4.51 0.00 -1.26 -0.44 107.32 112.16 3h0r s GLY 445 Ca -0.04 -0.70 -0.06 0.00 0.00 0.00 0.00 44.72 43.92 3h0r s GLY 445 CO 0.02 -0.39 0.08 -0.32 0.00 0.00 0.00 173.10 172.48 3h0r s GLY 446 N -0.84 1.99 -0.15 0.20 0.00 -0.06 -1.61 107.32 106.85 3h0r s GLY 446 Ca 0.13 -0.72 -0.05 0.00 0.00 0.00 0.00 44.72 44.08 3h0r s GLY 446 CO 0.03 -0.22 0.04 1.62 0.00 0.00 0.00 173.10 174.56 3h0r s GLN 447 N -0.37 3.62 -0.13 2.90 0.74 0.16 -0.14 119.66 126.43 3h0r s GLN 447 Ca 0.10 -0.37 0.03 0.00 0.05 0.00 0.00 55.36 55.16 3h0r s GLN 447 Cb -0.12 -3.05 0.01 0.00 1.10 0.00 0.00 33.01 30.95 3h0r s GLN 447 CO 0.02 0.43 -0.21 -0.51 -0.55 0.00 0.00 175.29 174.46 3h0r s LEU 448 N -0.09 2.06 -0.20 3.68 1.43 -0.46 -1.47 118.68 123.62 3h0r s LEU 448 Ca 0.06 -0.58 -0.08 0.00 -1.03 0.00 0.00 54.13 52.49 3h0r s LEU 448 Cb -0.12 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 3h0r s LEU 448 CO 0.01 0.08 0.09 -0.63 0.23 0.00 0.00 176.35 176.14 3h0r s ILE 449 N 0.78 4.94 0.46 -0.59 1.01 0.12 -1.57 121.20 126.35 3h0r s ILE 449 Ca -0.08 0.02 0.07 0.00 0.00 0.00 0.00 60.65 60.66 3h0r s ILE 449 Cb -0.16 -3.25 -0.01 0.00 0.01 0.00 0.00 42.46 39.05 3h0r s ILE 449 CO -0.01 0.42 0.31 -0.83 0.00 0.00 0.00 174.94 174.83 3h0r s GLY 450 N 0.65 2.32 0.74 6.18 0.00 -0.78 -0.84 107.32 115.59 3h0r s GLY 450 Ca 0.05 -1.68 -0.11 0.00 0.00 0.00 0.00 44.72 42.98 3h0r s GLY 450 CO 0.01 -1.87 1.07 0.54 0.00 0.00 0.00 173.10 172.85 3h0r s LYS 451 N -4.10 2.60 -0.01 2.90 1.02 -1.26 -4.05 119.74 116.83 3h0r s LYS 451 Ca 0.39 0.84 -0.36 0.00 0.02 0.00 0.00 55.97 56.86 3h0r s LYS 451 Cb -0.00 -1.96 -0.15 0.00 -0.52 0.00 0.00 37.83 35.20 3h0r s LYS 451 CO 0.23 -1.31 1.59 0.72 -0.92 0.00 0.00 175.35 175.65 3h0r n HIS 452 N -3.26 1.97 -0.97 3.18 8.25 -1.26 -1.47 115.22 121.67 3h0r n HIS 452 Ca 0.07 0.41 0.00 0.00 -0.26 0.00 0.00 57.72 57.94 3h0r n HIS 452 Cb 0.55 -2.47 0.00 0.00 1.12 0.00 0.00 29.99 29.18 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 4.13 0.00 -2.09 4.41 7.02 -1.26 -4.93 117.44 124.72 3h0r n TRP 453 Ca 0.21 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 56.31 3h0r n TRP 453 Cb 0.22 -0.19 0.03 0.00 -2.42 0.00 0.00 31.31 28.95 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 -0.05 6.97 0.17 -0.99 2.03 -0.54 -4.61 116.55 119.54 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 0.02 -0.96 0.41 0.00 -0.72 0.00 0.00 41.12 39.87 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 3.02 0.09 -0.13 -0.67 3.07 -1.92 -3.15 114.58 114.89 3h0r h GLU 455 Ca 0.51 -0.02 0.04 0.00 -0.50 0.00 0.00 59.36 59.39 3h0r h GLU 455 Cb 0.21 -0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 28.04 3h0r h GLU 455 CO 1.30 0.33 -0.46 1.15 -1.40 0.00 0.00 179.01 179.93 3h0r h THR 456 N 0.08 0.10 -0.29 1.13 2.02 -1.98 0.38 112.91 114.34 3h0r h THR 456 Ca 0.01 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.25 3h0r h THR 456 Cb 0.47 0.10 -0.06 0.00 -1.74 0.00 0.00 68.15 66.92 3h0r h THR 456 CO 0.03 0.00 -0.10 0.74 0.37 0.00 0.00 175.52 176.56 3h0r h THR 457 N -0.52 0.64 -0.98 3.16 2.02 -1.94 0.47 112.91 115.76 3h0r h THR 457 Ca 0.06 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.41 3h0r h THR 457 Cb 0.65 0.64 -0.09 0.00 -1.74 0.00 0.00 68.15 67.61 3h0r h THR 457 CO -0.41 0.00 0.61 -0.07 0.37 0.00 0.00 175.52 176.02 3h0r h LEU 458 N -0.05 0.77 -0.13 2.58 4.07 -1.52 -1.01 115.31 120.02 3h0r h LEU 458 Ca 0.15 0.07 -0.23 0.00 0.08 0.00 0.00 57.88 57.94 3h0r h LEU 458 Cb 0.27 -0.08 0.01 0.00 1.08 0.00 0.00 40.66 41.94 3h0r h LEU 458 CO -0.33 0.34 -0.81 -0.07 -1.08 0.00 0.00 178.44 176.50 3h0r h LEU 459 N 0.79 0.94 -0.13 1.67 3.38 0.14 -2.75 115.31 119.35 3h0r h LEU 459 Ca 0.52 -0.64 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3h0r h LEU 459 Cb 0.77 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3h0r h LEU 459 CO -0.30 1.44 0.06 1.56 0.09 0.00 0.00 178.44 181.29 3h0r h GLN 460 N 0.52 0.19 -0.45 1.13 4.20 0.84 0.15 115.11 121.69 3h0r h GLN 460 Ca -0.06 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 3h0r h GLN 460 Cb 1.44 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 29.17 3h0r h GLN 460 CO 0.17 0.27 0.19 0.82 -0.67 0.00 0.00 178.83 179.61 3h0r h ILE 461 N 0.07 1.16 -0.44 2.54 2.04 -1.32 0.31 117.51 121.87 3h0r h ILE 461 Ca 0.04 -0.49 -0.10 0.00 1.00 0.00 0.00 64.86 65.31 3h0r h ILE 461 Cb 0.15 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 3h0r h ILE 461 CO -0.00 0.20 -0.13 -1.28 0.00 0.00 0.00 178.15 176.93 3h0r h SER 462 N 0.64 0.81 -0.20 1.72 0.87 -1.12 -0.03 113.55 116.23 3h0r h SER 462 Ca 0.16 -0.26 -0.09 0.00 -1.23 0.00 0.00 61.79 60.37 3h0r h SER 462 Cb 0.11 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 61.84 3h0r h SER 462 CO -0.02 0.95 -0.24 0.22 -0.53 0.00 0.00 176.83 177.21 3h0r h TYR 463 N 0.73 0.64 -0.74 2.24 3.20 -0.08 -2.45 116.97 120.52 3h0r h TYR 463 Ca 0.12 -0.20 0.17 0.00 3.14 0.00 0.00 58.73 61.95 3h0r h TYR 463 Cb 0.63 -0.13 -0.13 0.00 1.54 0.00 0.00 36.73 38.64 3h0r h TYR 463 CO 0.03 0.89 0.03 1.25 -1.64 0.00 0.00 178.16 178.73 3h0r h LEU 464 N 0.20 -0.28 -0.46 2.82 5.85 -0.28 -2.95 115.31 120.20 3h0r h LEU 464 Ca 0.03 0.18 -0.17 0.00 0.84 0.00 0.00 57.88 58.76 3h0r h LEU 464 Cb 0.80 0.31 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 3h0r h LEU 464 CO 0.06 -0.15 -0.65 -0.25 -0.34 0.00 0.00 178.44 177.11 3h0r h TRP 465 N 0.13 0.61 0.00 1.25 2.91 -0.78 -3.05 115.95 117.03 3h0r h TRP 465 Ca 0.40 -0.25 -0.09 0.00 1.13 0.00 0.00 58.89 60.09 3h0r h TRP 465 Cb 0.71 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 29.24 3h0r h TRP 465 CO -0.39 0.99 -0.44 1.05 -1.03 0.00 0.00 178.44 178.62 3h0r h GLU 466 N 0.34 0.00 -0.19 2.65 4.11 -1.28 0.32 114.58 120.54 3h0r h GLU 466 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 3h0r h GLU 466 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 3h0r h GLU 466 CO 0.12 0.44 0.12 1.96 0.07 0.00 0.00 179.01 181.71 3h0r h GLN 467 N 0.00 0.24 -0.28 1.06 1.08 -1.42 -2.87 115.11 112.93 3h0r h GLN 467 Ca -0.00 -0.01 -0.17 0.00 -1.45 0.00 0.00 58.65 57.01 3h0r h GLN 467 Cb 0.96 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 28.33 3h0r h GLN 467 CO 0.06 0.16 -0.51 0.87 -0.95 0.00 0.00 178.83 178.45 3h0r h LYS 468 N 0.25 0.79 -3.37 1.46 1.57 -1.43 -3.42 116.57 112.43 3h0r h LYS 468 Ca 0.07 -0.48 -0.53 0.00 -1.87 0.00 0.00 60.65 57.84 3h0r h LYS 468 Cb -0.03 0.05 -0.40 0.00 0.08 0.00 0.00 32.23 31.93 3h0r h LYS 468 CO -0.02 1.11 -0.76 0.12 -0.57 0.00 0.00 179.45 179.33 3h0r s PHE 469 N -4.15 0.95 -1.27 -1.35 5.36 0.11 -5.06 117.98 112.57 3h0r s PHE 469 Ca -0.10 -0.98 -0.13 0.00 -0.96 0.00 0.00 56.93 54.77 3h0r s PHE 469 Cb 0.11 -1.11 0.14 0.00 -0.34 0.00 0.00 43.02 41.82 3h0r s PHE 469 CO 0.87 -0.69 1.70 1.63 -1.46 0.00 0.00 175.22 177.28 3h0r n LYS 470 N 5.07 3.38 0.18 10.12 5.02 -1.10 -4.11 118.16 136.72 3h0r n LYS 470 Ca -0.07 -3.54 0.14 0.00 -2.02 0.00 0.00 58.31 52.82 3h0r n LYS 470 Cb 0.45 -3.09 0.52 0.00 -0.02 0.00 0.00 35.03 32.89 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 6.62 0.00 0.00 2.13 2.07 -1.91 -2.90 115.15 121.16 3h0r h HIS 471 Ca 0.39 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.91 3h0r h HIS 471 Cb 0.77 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.75 3h0r h HIS 471 CO 1.23 0.00 0.00 2.48 -3.07 0.00 0.00 177.93 178.57 3h0r n TYR 472 N -2.60 0.02 0.07 6.12 0.18 -1.26 -2.30 117.16 117.38 3h0r n TYR 472 Ca 0.02 0.01 0.02 0.00 1.88 0.00 0.00 57.90 59.83 3h0r n TYR 472 Cb 0.31 -0.51 -0.04 0.00 -0.38 0.00 0.00 39.34 38.72 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 -6.19 -3.48 5.08 -1.90 -3.44 114.58 104.65 3h0r h GLU 473 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 3h0r h GLU 473 Cb 0.30 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 3h0r h GLU 473 CO 0.00 0.29 1.24 0.15 -1.00 0.00 0.00 179.01 179.69 3h0r s LYS 474 N -3.00 3.01 -0.19 2.33 -0.14 -0.97 -4.97 119.74 115.81 3h0r s LYS 474 Ca -0.01 0.66 -0.01 0.00 -1.36 0.00 0.00 55.97 55.26 3h0r s LYS 474 Cb 0.08 -4.25 0.01 0.00 -1.68 0.00 0.00 37.83 31.99 3h0r s LYS 474 CO 0.79 -2.28 -0.15 0.42 -0.76 0.00 0.00 175.35 173.38 3h0r s ILE 475 N 7.50 2.54 0.93 2.17 1.01 -1.26 -5.06 121.20 129.03 3h0r s ILE 475 Ca 0.63 -0.78 -0.14 0.00 0.00 0.00 0.00 60.65 60.36 3h0r s ILE 475 Cb -0.13 -2.10 0.20 0.00 0.01 0.00 0.00 42.46 40.43 3h0r s ILE 475 CO 0.24 0.50 1.28 -2.16 0.00 0.00 0.00 174.94 174.80 3h0r s PRO 476 N 1.27 0.72 -1.01 2.79 0.04 -1.26 -4.31 135.00 133.24 3h0r s PRO 476 Ca 0.04 -0.56 -0.25 0.00 0.04 0.00 0.00 61.00 60.27 3h0r s PRO 476 Cb -0.14 -1.92 0.03 0.00 0.04 0.00 0.00 34.50 32.52 3h0r s PRO 476 CO -0.08 -2.31 0.59 1.28 0.04 0.00 0.00 177.00 176.52 3h0r n LEU 477 N -3.65 -0.42 0.00 -3.56 4.77 -1.26 -4.88 117.00 108.01 3h0r n LEU 477 Ca 0.16 -1.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.03 3h0r n LEU 477 Cb 0.60 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.27 3h0r n LEU 477 CO 0.45 0.66 0.00 0.35 -1.33 0.00 0.00 177.39 177.52