#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 -4.24 117.00 118.68 3h0r n LEU 2 Ca 0.00 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 55.01 3h0r n LEU 2 Cb 0.00 0.00 0.49 0.00 0.53 0.00 0.00 43.42 44.44 3h0r n LEU 2 CO 0.00 0.00 0.83 -2.67 -1.11 0.00 0.00 177.39 174.44 3h0r n TRP 3 N 0.00 0.73 1.54 1.96 4.27 -1.26 -1.40 117.44 123.28 3h0r n TRP 3 Ca 0.00 0.31 0.14 0.00 -3.89 0.00 0.00 57.50 54.06 3h0r n TRP 3 Cb 0.00 -1.00 0.57 0.00 -1.36 0.00 0.00 31.31 29.52 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 -2.19 1.50 -3.68 -2.67 4.81 -1.26 -4.92 118.16 109.76 3h0r n LYS 4 Ca 0.01 -0.79 -0.29 0.00 -0.87 0.00 0.00 58.31 56.37 3h0r n LYS 4 Cb 0.17 -1.48 -0.04 0.00 0.02 0.00 0.00 35.03 33.70 3h0r n LYS 4 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 3h0r s LYS 5 N -2.04 3.56 0.87 1.64 1.02 -0.49 -4.83 119.74 119.46 3h0r s LYS 5 Ca 0.38 -0.22 -0.13 0.00 0.02 0.00 0.00 55.97 56.02 3h0r s LYS 5 Cb 0.21 -2.84 0.13 0.00 -0.52 0.00 0.00 37.83 34.81 3h0r s LYS 5 CO 0.35 0.43 1.23 -1.54 -0.92 0.00 0.00 175.35 174.90 3h0r s SER 6 N -2.83 3.94 0.44 2.83 1.04 -1.26 -4.82 113.70 113.04 3h0r s SER 6 Ca 0.40 0.55 0.21 0.00 0.48 0.00 0.00 55.95 57.58 3h0r s SER 6 Cb -0.12 -0.85 1.00 0.00 0.10 0.00 0.00 66.02 66.15 3h0r s SER 6 CO 0.27 -2.24 1.90 -0.07 0.98 0.00 0.00 173.24 174.08 3h0r h LEU 7 N -1.28 0.00 -0.08 2.42 3.38 -1.97 0.15 115.31 117.93 3h0r h LEU 7 Ca -0.45 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 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 0.54 0.26 -0.04 0.28 0.09 0.00 0.00 178.44 179.57 3h0r h SER 8 N 0.00 0.17 -0.36 -0.43 0.02 -1.98 0.18 113.55 111.15 3h0r h SER 8 Ca -0.00 -0.42 -0.03 0.00 -0.84 0.00 0.00 61.79 60.50 3h0r h SER 8 Cb 0.60 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 3h0r h SER 8 CO 0.03 0.55 0.13 -0.33 -1.14 0.00 0.00 176.83 176.07 3h0r h GLU 9 N -0.21 0.55 -0.29 3.45 5.08 -1.88 -2.40 114.58 118.87 3h0r h GLU 9 Ca 0.02 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3h0r h GLU 9 Cb 0.49 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 3h0r h GLU 9 CO 0.01 0.56 0.18 -0.07 -1.00 0.00 0.00 179.01 178.68 3h0r h LEU 10 N 0.43 0.35 0.01 1.33 4.07 -0.71 -2.86 115.31 117.94 3h0r h LEU 10 Ca 0.12 -0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.03 3h0r h LEU 10 Cb 0.22 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 41.87 3h0r h LEU 10 CO -0.01 0.30 -0.01 -0.09 -1.08 0.00 0.00 178.44 177.55 3h0r h ARG 11 N 0.37 -0.03 -0.45 1.13 2.43 -0.57 -1.29 114.38 115.97 3h0r h ARG 11 Ca 0.11 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.23 3h0r h ARG 11 Cb 0.02 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 3h0r h ARG 11 CO -0.02 -0.02 0.11 1.49 -1.51 0.00 0.00 179.97 180.02 3h0r h GLU 12 N -0.03 0.68 -0.18 0.20 4.81 -1.45 0.15 114.58 118.77 3h0r h GLU 12 Ca 0.00 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 59.02 3h0r h GLU 12 Cb 0.03 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 3h0r h GLU 12 CO -0.01 0.62 -0.27 -0.07 -0.73 0.00 0.00 179.01 178.56 3h0r h LEU 13 N 0.66 0.33 0.12 1.64 4.07 -1.28 -2.78 115.31 118.08 3h0r h LEU 13 Ca 0.15 -0.11 -0.30 0.00 0.08 0.00 0.00 57.88 57.70 3h0r h LEU 13 Cb 0.26 -0.09 0.03 0.00 1.08 0.00 0.00 40.66 41.93 3h0r h LEU 13 CO -0.00 0.60 -1.27 -0.07 -1.08 0.00 0.00 178.44 176.62 3h0r h LEU 14 N 0.29 0.82 -0.82 1.67 3.38 -0.23 -0.55 115.31 119.88 3h0r h LEU 14 Ca 0.04 -0.78 -0.08 0.00 0.09 0.00 0.00 57.88 57.16 3h0r h LEU 14 Cb 0.63 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3h0r h LEU 14 CO 0.05 1.59 0.06 0.11 0.09 0.00 0.00 178.44 180.33 3h0r h LYS 15 N 0.24 0.95 -0.64 1.13 1.57 -0.74 -2.78 116.57 116.30 3h0r h LYS 15 Ca -0.19 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3h0r h LYS 15 Cb 1.95 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 34.15 3h0r h LYS 15 CO 0.24 0.90 0.00 0.54 -0.57 0.00 0.00 179.45 180.56 3h0r n ARG 16 N -4.22 3.63 -0.57 3.15 1.74 -1.05 -4.94 116.66 114.40 3h0r n ARG 16 Ca 0.03 -2.43 0.00 0.00 -0.77 0.00 0.00 57.85 54.69 3h0r n ARG 16 Cb 0.29 -1.93 0.00 0.00 -1.02 0.00 0.00 32.46 29.81 3h0r n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0r n GLY 17 N 0.79 0.79 0.33 -0.13 0.00 -1.05 -4.82 105.19 101.10 3h0r n GLY 17 Ca 0.22 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.40 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 1.45 0.00 -4.50 1.61 5.08 -1.40 -3.41 114.58 113.40 3h0r h GLU 18 Ca 0.00 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.15 3h0r h GLU 18 Cb 0.00 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.08 3h0r h GLU 18 CO 0.00 0.00 -0.70 0.54 -1.00 0.00 0.00 179.01 177.85 3h0r s VAL 19 N -4.87 0.52 0.19 3.13 0.11 -0.73 -5.02 120.40 113.73 3h0r s VAL 19 Ca -0.05 -1.63 0.07 0.00 -2.93 0.00 0.00 61.98 57.44 3h0r s VAL 19 Cb 0.17 -1.29 -0.04 0.00 -1.53 0.00 0.00 36.38 33.69 3h0r s VAL 19 CO 0.64 -0.75 0.05 -0.94 -3.33 0.00 0.00 175.10 170.77 3h0r s SER 20 N -2.55 5.00 0.36 3.54 1.04 -1.26 -4.40 113.70 115.43 3h0r s SER 20 Ca 0.04 -0.35 0.10 0.00 0.48 0.00 0.00 55.95 56.22 3h0r s SER 20 Cb 0.01 -1.14 0.86 0.00 0.10 0.00 0.00 66.02 65.86 3h0r s SER 20 CO -0.04 0.06 1.86 -0.65 0.98 0.00 0.00 173.24 175.45 3h0r h PRO 21 N 2.43 0.62 -0.76 4.02 0.11 -1.89 -1.14 132.00 135.39 3h0r h PRO 21 Ca -0.47 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 3h0r h PRO 21 Cb 1.21 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.14 3h0r h PRO 21 CO 0.60 0.41 0.41 -0.22 -0.21 0.00 0.00 178.00 178.99 3h0r h LYS 22 N 0.64 1.07 -0.11 1.05 3.64 -1.89 -1.94 116.57 119.03 3h0r h LYS 22 Ca 0.46 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.71 3h0r h LYS 22 Cb 0.81 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.42 3h0r h LYS 22 CO -0.21 0.80 0.06 0.93 -2.27 0.00 0.00 179.45 178.75 3h0r h GLU 23 N 1.06 0.15 -0.35 1.90 5.08 -1.63 0.74 114.58 121.53 3h0r h GLU 23 Ca 0.27 -0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.67 3h0r h GLU 23 Cb 0.05 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.21 3h0r h GLU 23 CO -0.04 0.19 -0.04 0.28 -1.00 0.00 0.00 179.01 178.40 3h0r h VAL 24 N 0.07 0.70 -0.37 3.13 2.07 -1.25 0.13 116.25 120.72 3h0r h VAL 24 Ca 0.04 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 3h0r h VAL 24 Cb 0.09 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 3h0r h VAL 24 CO -0.01 0.01 0.17 0.58 0.02 0.00 0.00 177.57 178.34 3h0r h VAL 25 N 0.05 1.18 -0.69 2.57 2.07 -1.18 -2.62 116.25 117.63 3h0r h VAL 25 Ca 0.17 -0.52 0.08 0.00 0.82 0.00 0.00 66.70 67.25 3h0r h VAL 25 Cb 0.25 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 3h0r h VAL 25 CO -0.32 0.19 0.35 -0.33 0.02 0.00 0.00 177.57 177.48 3h0r h GLU 26 N 0.46 0.59 0.04 1.57 5.08 -0.09 0.85 114.58 123.08 3h0r h GLU 26 Ca 0.13 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.47 3h0r h GLU 26 Cb 0.15 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 3h0r h GLU 26 CO -0.01 0.39 -0.20 1.03 -1.00 0.00 0.00 179.01 179.21 3h0r h SER 27 N 0.61 -0.58 0.13 1.42 0.87 -0.46 -0.92 113.55 114.60 3h0r h SER 27 Ca 0.33 0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.90 3h0r h SER 27 Cb 0.32 0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.50 3h0r h SER 27 CO -0.25 -0.28 -0.25 -0.26 -0.53 0.00 0.00 176.83 175.27 3h0r h PHE 28 N -0.35 0.24 -0.57 2.24 0.04 -1.20 -2.13 116.94 115.21 3h0r h PHE 28 Ca 0.05 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.78 3h0r h PHE 28 Cb 0.40 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.46 3h0r h PHE 28 CO -0.23 0.45 0.37 -0.92 -0.60 0.00 0.00 178.31 177.39 3h0r h TYR 29 N 0.20 0.73 -0.10 -0.55 3.20 -0.33 0.19 116.97 120.30 3h0r h TYR 29 Ca 0.03 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 3h0r h TYR 29 Cb 0.55 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.57 3h0r h TYR 29 CO 0.01 0.47 0.03 -0.44 -1.64 0.00 0.00 178.16 176.59 3h0r h ASP 30 N 0.78 0.15 -0.95 -2.11 5.19 -0.69 0.20 116.42 118.99 3h0r h ASP 30 Ca 0.21 -0.21 0.14 0.00 -0.62 0.00 0.00 57.03 56.55 3h0r h ASP 30 Cb -0.07 -0.04 -0.09 0.00 0.18 0.00 0.00 39.33 39.31 3h0r h ASP 30 CO -0.04 0.32 0.57 -0.09 -3.12 0.00 0.00 179.24 176.87 3h0r h ARG 31 N -0.02 0.81 0.05 3.56 9.65 -1.20 0.24 114.38 127.48 3h0r h ARG 31 Ca 0.03 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 58.86 3h0r h ARG 31 Cb 0.22 -0.18 -0.00 0.00 -1.39 0.00 0.00 29.97 28.61 3h0r h ARG 31 CO -0.00 0.54 -0.04 -0.92 2.80 0.00 0.00 179.97 182.35 3h0r h TYR 32 N 0.84 -0.10 -0.71 2.20 3.20 -0.13 -2.45 116.97 119.83 3h0r h TYR 32 Ca 0.50 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.41 3h0r h TYR 32 Cb 0.61 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.88 3h0r h TYR 32 CO -0.03 -0.06 0.47 -0.91 -1.64 0.00 0.00 178.16 175.99 3h0r h ASN 33 N -0.10 0.72 -0.75 -2.11 2.35 0.81 0.35 115.58 116.86 3h0r h ASN 33 Ca -0.00 -0.01 0.09 0.00 -0.55 0.00 0.00 56.30 55.83 3h0r h ASN 33 Cb 0.08 -0.17 -0.07 0.00 0.05 0.00 0.00 38.32 38.22 3h0r h ASN 33 CO -0.00 0.50 0.40 1.56 -1.65 0.00 0.00 177.43 178.24 3h0r h GLN 34 N 0.84 0.67 0.00 0.81 4.20 -0.26 -3.38 115.11 117.99 3h0r h GLN 34 Ca 0.28 -0.04 -0.12 0.00 0.06 0.00 0.00 58.65 58.83 3h0r h GLN 34 Cb 0.08 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 3h0r h GLN 34 CO -0.08 0.44 -1.52 0.25 -0.67 0.00 0.00 178.83 177.26 3h0r n THR 35 N -4.80 0.47 -0.03 -0.54 -2.24 -0.49 -4.73 114.28 101.92 3h0r n THR 35 Ca 0.12 -0.31 -0.05 0.00 -2.27 0.00 0.00 64.05 61.53 3h0r n THR 35 Cb 0.26 -0.66 0.15 0.00 -2.10 0.00 0.00 70.33 67.98 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 0.60 -0.65 -0.78 4.57 -1.16 -1.06 114.58 116.11 3h0r h GLU 36 Ca -0.19 -0.24 0.07 0.00 -1.18 0.00 0.00 59.36 57.82 3h0r h GLU 36 Cb 1.35 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.87 3h0r h GLU 36 CO 0.01 0.81 0.43 1.49 -1.18 0.00 0.00 179.01 180.56 3h0r h GLU 37 N 0.53 0.61 0.00 1.92 4.81 -1.84 0.44 114.58 121.05 3h0r h GLU 37 Ca 0.07 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 3h0r h GLU 37 Cb 0.72 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.96 3h0r h GLU 37 CO 0.06 0.40 -0.09 0.87 -0.73 0.00 0.00 179.01 179.52 3h0r h LYS 38 N 0.63 0.00 0.00 1.92 1.57 -1.59 -3.42 116.57 115.68 3h0r h LYS 38 Ca 0.28 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.06 3h0r h LYS 38 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3h0r h LYS 38 CO -0.09 0.99 -0.00 0.28 -0.57 0.00 0.00 179.45 180.06 3h0r h VAL 39 N -1.00 1.53 -5.25 0.50 2.07 -0.98 -3.42 116.25 109.71 3h0r h VAL 39 Ca -0.02 -2.14 -0.27 0.00 0.82 0.00 0.00 66.70 65.08 3h0r h VAL 39 Cb 1.01 2.89 0.16 0.00 -1.52 0.00 0.00 31.29 33.82 3h0r h VAL 39 CO -0.01 0.52 -0.72 0.29 0.02 0.00 0.00 177.57 177.67 3h0r n LYS 40 N -4.64 -4.69 0.11 1.57 5.02 0.15 -1.04 118.16 114.64 3h0r n LYS 40 Ca -0.08 0.77 -0.04 0.00 -2.02 0.00 0.00 58.31 56.93 3h0r n LYS 40 Cb 0.41 -5.48 0.10 0.00 -0.02 0.00 0.00 35.03 30.04 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 0.53 0.82 -2.98 7.82 0.00 -1.88 -3.39 119.26 120.18 3h0r h ALA 41 Ca -0.53 -0.62 -0.66 0.00 0.00 0.00 0.00 54.91 53.09 3h0r h ALA 41 Cb 1.30 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 3h0r h ALA 41 CO 0.43 0.84 -0.55 0.71 0.00 0.00 0.00 179.25 180.68 3h0r s TYR 42 N -3.48 3.38 -0.18 0.00 1.51 -1.26 0.36 117.35 117.67 3h0r s TYR 42 Ca -0.02 0.32 -0.22 0.00 -1.01 0.00 0.00 57.07 56.13 3h0r s TYR 42 Cb 0.12 -1.82 -0.21 0.00 -0.11 0.00 0.00 41.96 39.94 3h0r s TYR 42 CO 0.79 0.60 0.36 0.82 -1.11 0.00 0.00 175.55 177.01 3h0r h ILE 43 N 3.59 1.11 -3.21 2.71 2.04 -0.67 -3.43 117.51 119.64 3h0r h ILE 43 Ca -0.51 -2.24 -0.59 0.00 1.00 0.00 0.00 64.86 62.52 3h0r h ILE 43 Cb 1.20 2.52 -0.40 0.00 -0.74 0.00 0.00 36.82 39.40 3h0r h ILE 43 CO 0.60 0.42 -0.75 -0.89 0.00 0.00 0.00 178.15 177.53 3h0r s THR 44 N -2.34 1.07 0.29 -0.27 2.01 -0.68 -4.99 115.64 110.72 3h0r s THR 44 Ca -0.26 -1.55 -0.29 0.00 0.31 0.00 0.00 61.69 59.90 3h0r s THR 44 Cb 0.04 -1.81 -0.10 0.00 0.01 0.00 0.00 72.50 70.65 3h0r s THR 44 CO 0.63 -0.67 1.22 -2.16 -0.69 0.00 0.00 174.62 172.94 3h0r s PRO 45 N 1.49 4.48 -0.08 4.92 0.04 -1.26 0.65 135.00 145.24 3h0r s PRO 45 Ca 0.10 2.01 0.12 0.00 0.04 0.00 0.00 61.00 63.27 3h0r s PRO 45 Cb -0.18 -3.14 0.19 0.00 0.04 0.00 0.00 34.50 31.41 3h0r s PRO 45 CO -0.22 -0.03 1.10 1.28 0.04 0.00 0.00 177.00 179.17 3h0r n LEU 46 N 1.28 1.47 -0.35 -3.56 4.77 0.11 -4.80 117.00 115.92 3h0r n LEU 46 Ca 0.01 -2.33 -0.02 0.00 -0.03 0.00 0.00 56.01 53.64 3h0r n LEU 46 Cb 0.43 -0.26 0.11 0.00 -2.33 0.00 0.00 43.42 41.37 3h0r n LEU 46 CO 0.57 0.57 1.26 1.88 -1.33 0.00 0.00 177.39 180.33 3h0r h TYR 47 N 0.07 1.15 -0.21 -1.77 -1.99 -1.76 0.10 116.97 112.57 3h0r h TYR 47 Ca -0.01 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.81 3h0r h TYR 47 Cb 1.17 -0.39 -0.06 0.00 2.00 0.00 0.00 36.73 39.46 3h0r h TYR 47 CO 0.08 0.69 -0.18 0.78 -0.00 0.00 0.00 178.16 179.52 3h0r h GLY 48 N 1.21 -0.07 1.50 3.88 0.00 -1.90 0.18 103.07 107.87 3h0r h GLY 48 Ca 0.36 0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.83 3h0r h GLY 48 CO -0.10 -0.17 -0.15 1.70 0.00 0.00 0.00 176.54 177.82 3h0r h LYS 49 N -0.19 0.60 -0.12 4.80 3.64 -1.75 -2.92 116.57 120.63 3h0r h LYS 49 Ca 0.13 -0.19 -0.14 0.00 -1.27 0.00 0.00 60.65 59.17 3h0r h LYS 49 Cb 0.38 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 3h0r h LYS 49 CO -0.33 0.72 -0.53 0.00 -2.27 0.00 0.00 179.45 177.05 3h0r h ALA 50 N 1.30 0.87 -0.44 5.00 0.00 -0.38 -1.63 119.26 123.99 3h0r h ALA 50 Ca 0.09 -0.50 0.06 0.00 0.00 0.00 0.00 54.91 54.57 3h0r h ALA 50 Cb 0.57 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 3h0r h ALA 50 CO 0.04 0.68 0.14 -0.07 0.00 0.00 0.00 179.25 180.03 3h0r h LEU 51 N 0.26 0.11 -0.53 0.00 4.07 -0.48 -0.48 115.31 118.26 3h0r h LEU 51 Ca 0.01 0.06 -0.10 0.00 0.08 0.00 0.00 57.88 57.92 3h0r h LEU 51 Cb 1.02 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.80 3h0r h LEU 51 CO 0.09 0.10 -0.07 0.11 -1.08 0.00 0.00 178.44 177.58 3h0r h LYS 52 N 0.29 0.99 0.00 1.13 1.57 -1.39 -2.97 116.57 116.19 3h0r h LYS 52 Ca 0.21 -0.35 -0.04 0.00 -1.87 0.00 0.00 60.65 58.60 3h0r h LYS 52 Cb 0.23 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3h0r h LYS 52 CO -0.24 1.03 -0.20 1.96 -0.57 0.00 0.00 179.45 181.43 3h0r h GLN 53 N 0.86 0.00 -0.17 3.15 4.20 -0.95 -2.84 115.11 119.36 3h0r h GLN 53 Ca 0.14 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.76 3h0r h GLN 53 Cb 0.63 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 3h0r h GLN 53 CO 0.04 0.20 -0.30 0.00 -0.67 0.00 0.00 178.83 178.10 3h0r h ALA 54 N 1.80 1.18 -0.49 3.87 0.00 -0.93 -3.02 119.26 121.67 3h0r h ALA 54 Ca -0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3h0r h ALA 54 Cb 0.59 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3h0r h ALA 54 CO 0.03 0.53 0.31 0.93 0.00 0.00 0.00 179.25 181.05 3h0r h GLU 55 N 0.29 0.66 -0.01 0.00 5.08 -1.52 -1.94 114.58 117.14 3h0r h GLU 55 Ca 0.04 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3h0r h GLU 55 Cb 0.68 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3h0r h GLU 55 CO 0.05 0.45 -0.15 0.45 -1.00 0.00 0.00 179.01 178.82 3h0r n SER 56 N -4.45 0.93 -4.63 1.42 2.88 -1.15 -4.85 113.62 103.78 3h0r n SER 56 Ca 0.04 -0.94 -0.43 0.00 -1.33 0.00 0.00 58.87 56.21 3h0r n SER 56 Cb 0.06 0.04 -0.03 0.00 -0.75 0.00 0.00 64.21 63.53 3h0r n SER 56 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 3h0r s LEU 57 N -2.36 4.02 0.00 2.46 0.20 -0.73 -4.89 118.68 117.38 3h0r s LEU 57 Ca 0.30 0.99 0.00 0.00 0.69 0.00 0.00 54.13 56.11 3h0r s LEU 57 Cb 0.20 -3.38 0.00 0.00 -0.43 0.00 0.00 46.19 42.58 3h0r s LEU 57 CO 0.46 -0.75 0.00 0.29 -0.29 0.00 0.00 176.35 176.06 3h0r n LYS 58 N 6.53 0.00 -1.82 1.98 5.02 -1.26 -4.94 118.16 123.67 3h0r n LYS 58 Ca 0.09 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.99 3h0r n LYS 58 Cb 0.47 -0.53 -0.03 0.00 -0.02 0.00 0.00 35.03 34.92 3h0r n LYS 58 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3h0r s GLU 59 N -1.96 2.61 0.43 1.97 0.41 -1.26 -4.86 118.70 116.05 3h0r s GLU 59 Ca 0.00 1.17 0.24 0.00 -0.41 0.00 0.00 54.97 55.97 3h0r s GLU 59 Cb 0.00 -4.42 0.68 0.00 -1.78 0.00 0.00 34.13 28.61 3h0r s GLU 59 CO 0.00 -2.71 1.72 0.00 -0.49 0.00 0.00 175.26 173.78 3h0r h ARG 60 N 16.23 0.00 -0.03 1.61 3.08 -1.94 -3.19 114.38 130.14 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 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3h0r h ARG 60 CO 1.14 0.18 0.00 -1.91 -1.07 0.00 0.00 179.97 178.31 3h0r n GLU 61 N -3.22 1.30 -1.74 0.04 2.13 -1.26 -4.68 120.64 113.21 3h0r n GLU 61 Ca 0.02 -0.44 -0.42 0.00 0.66 0.00 0.00 57.16 56.98 3h0r n GLU 61 Cb 0.49 -1.43 -0.02 0.00 0.27 0.00 0.00 31.44 30.76 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 -1.82 4.35 0.52 4.31 1.02 -1.21 -4.89 118.68 120.96 3h0r s LEU 62 Ca 0.38 2.94 0.24 0.00 0.02 0.00 0.00 54.13 57.71 3h0r s LEU 62 Cb 0.19 -3.62 1.36 0.00 0.02 0.00 0.00 46.19 44.14 3h0r s LEU 62 CO 0.30 -0.95 1.99 -0.65 0.02 0.00 0.00 176.35 177.07 3h0r h PRO 63 N 5.56 0.04 -0.15 1.29 0.11 -1.88 0.56 132.00 137.51 3h0r h PRO 63 Ca -0.46 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 3h0r h PRO 63 Cb 1.21 -0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.23 3h0r h PRO 63 CO 0.86 0.02 -0.52 1.28 -0.21 0.00 0.00 178.00 179.43 3h0r n LEU 64 N -4.39 3.21 -0.13 2.35 4.77 0.29 -4.98 117.00 118.12 3h0r n LEU 64 Ca 0.10 -4.04 -0.03 0.00 -0.03 0.00 0.00 56.01 52.01 3h0r n LEU 64 Cb 0.60 -0.51 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 3h0r n LEU 64 CO 0.37 1.52 0.16 0.33 -1.33 0.00 0.00 177.39 178.43 3h0r n PHE 65 N -1.05 -0.11 -1.47 -1.77 7.35 0.18 -1.25 117.46 119.35 3h0r n PHE 65 Ca 0.24 0.39 0.07 0.00 -0.76 0.00 0.00 57.45 57.40 3h0r n PHE 65 Cb 0.76 -0.54 0.13 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 -1.09 4.00 3.67 7.13 0.00 -1.26 -4.34 105.19 113.29 3h0r n GLY 66 Ca 0.01 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.62 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 -2.32 4.87 0.50 -0.61 -1.09 -0.38 -4.77 121.20 117.40 3h0r s ILE 67 Ca 0.29 1.64 -0.21 0.00 -2.23 0.00 0.00 60.65 60.14 3h0r s ILE 67 Cb 0.27 -4.14 -0.06 0.00 -1.58 0.00 0.00 42.46 36.95 3h0r s ILE 67 CO -0.02 0.02 1.17 -2.84 -1.23 0.00 0.00 174.94 172.04 3h0r s PRO 68 N 2.21 3.53 -0.12 2.79 0.02 -1.26 -0.23 135.00 141.94 3h0r s PRO 68 Ca 0.38 1.77 -0.05 0.00 0.02 0.00 0.00 61.00 63.12 3h0r s PRO 68 Cb -0.16 -2.24 0.06 0.00 0.02 0.00 0.00 34.50 32.17 3h0r s PRO 68 CO 0.12 -0.74 0.27 -1.50 -0.33 0.00 0.00 177.00 174.82 3h0r s ILE 69 N -1.59 -0.21 0.46 2.83 2.07 -0.53 -4.38 121.20 119.85 3h0r s ILE 69 Ca 0.68 0.20 -0.14 0.00 -1.41 0.00 0.00 60.65 59.98 3h0r s ILE 69 Cb -0.28 -0.44 -0.07 0.00 0.13 0.00 0.00 42.46 41.80 3h0r s ILE 69 CO 0.33 0.08 0.89 0.00 -1.91 0.00 0.00 174.94 174.33 3h0r s ALA 70 N 1.79 3.19 -0.03 1.50 0.00 -1.07 -1.76 121.76 125.39 3h0r s ALA 70 Ca -0.05 0.01 0.01 0.00 0.00 0.00 0.00 51.96 51.93 3h0r s ALA 70 Cb -0.11 -2.93 0.02 0.00 0.00 0.00 0.00 23.12 20.10 3h0r s ALA 70 CO -0.09 -0.13 -0.00 0.08 0.00 0.00 0.00 175.76 175.62 3h0r s VAL 71 N -2.51 0.18 0.34 0.00 1.01 -0.54 -1.59 120.40 117.30 3h0r s VAL 71 Ca 0.55 0.06 -0.29 0.00 0.00 0.00 0.00 61.98 62.31 3h0r s VAL 71 Cb -0.10 -0.26 -0.12 0.00 0.00 0.00 0.00 36.38 35.90 3h0r s VAL 71 CO 0.31 0.13 1.38 1.17 0.00 0.00 0.00 175.10 178.09 3h0r n LYS 72 N 3.98 2.31 -0.09 2.72 4.81 -0.79 -0.08 118.16 131.02 3h0r n LYS 72 Ca -0.25 0.81 -0.02 0.00 -0.87 0.00 0.00 58.31 57.98 3h0r n LYS 72 Cb 0.51 -2.46 0.02 0.00 0.02 0.00 0.00 35.03 33.12 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 0.95 2.88 -0.17 3.14 2.03 -0.89 -1.37 116.55 123.11 3h0r n ASP 73 Ca 0.05 -2.12 0.02 0.00 0.52 0.00 0.00 54.79 53.26 3h0r n ASP 73 Cb 0.36 -0.52 0.04 0.00 -0.72 0.00 0.00 41.12 40.28 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 0.34 1.99 -4.51 1.67 6.94 -1.26 -0.28 115.26 120.15 3h0r n ASN 74 Ca 0.04 -1.76 -0.35 0.00 -0.02 0.00 0.00 54.58 52.49 3h0r n ASN 74 Cb 0.56 -0.05 -0.12 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 4.38 -0.00 1.53 1.01 -0.47 -0.61 121.20 126.24 3h0r s ILE 75 Ca 0.06 -0.16 -0.30 0.00 0.00 0.00 0.00 60.65 60.24 3h0r s ILE 75 Cb 0.03 -3.00 -0.05 0.00 0.01 0.00 0.00 42.46 39.45 3h0r s ILE 75 CO 0.05 0.40 1.39 -0.76 0.00 0.00 0.00 174.94 176.02 3h0r s LEU 76 N 1.02 4.31 -0.19 2.97 1.02 -0.16 -4.89 118.68 122.76 3h0r s LEU 76 Ca 0.03 2.09 0.01 0.00 0.02 0.00 0.00 54.13 56.29 3h0r s LEU 76 Cb -0.14 -3.56 0.03 0.00 0.02 0.00 0.00 46.19 42.54 3h0r s LEU 76 CO 0.03 -0.71 -0.17 -0.69 0.02 0.00 0.00 176.35 174.83 3h0r s VAL 77 N 2.40 1.97 0.33 -1.59 1.01 -1.26 -1.48 120.40 121.78 3h0r s VAL 77 Ca 0.63 -1.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.31 3h0r s VAL 77 Cb -0.31 -1.86 -0.10 0.00 0.00 0.00 0.00 36.38 34.11 3h0r s VAL 77 CO 0.26 0.40 1.34 -0.70 0.00 0.00 0.00 175.10 176.41 3h0r s GLU 78 N 1.30 4.31 0.00 2.72 2.12 -1.24 -2.38 118.70 125.54 3h0r s GLU 78 Ca 0.02 2.27 0.00 0.00 0.36 0.00 0.00 54.97 57.63 3h0r s GLU 78 Cb -0.14 -3.06 0.00 0.00 0.26 0.00 0.00 34.13 31.19 3h0r s GLU 78 CO -0.11 -0.26 0.00 0.41 -0.54 0.00 0.00 175.26 174.76 3h0r n GLY 79 N 0.87 2.64 3.52 -1.50 0.00 -0.42 -4.97 105.19 105.32 3h0r n GLY 79 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.51 1.87 0.24 1.61 0.41 -1.00 -4.82 118.70 116.51 3h0r s GLU 80 Ca 0.00 -1.26 -0.31 0.00 -0.41 0.00 0.00 54.97 52.98 3h0r s GLU 80 Cb 0.00 -2.10 -0.12 0.00 -1.78 0.00 0.00 34.13 30.13 3h0r s GLU 80 CO 0.00 0.45 1.57 1.63 -0.49 0.00 0.00 175.26 178.42 3h0r n LYS 81 N 0.39 2.46 -3.98 1.61 5.02 -1.26 -2.17 118.16 120.22 3h0r n LYS 81 Ca -0.13 0.88 -0.31 0.00 -2.02 0.00 0.00 58.31 56.73 3h0r n LYS 81 Cb 0.54 -2.64 -0.15 0.00 -0.02 0.00 0.00 35.03 32.76 3h0r n LYS 81 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3h0r s THR 82 N 0.32 1.93 -0.31 -0.18 2.01 -0.61 -4.88 115.64 113.92 3h0r s THR 82 Ca 0.69 -1.79 0.20 0.00 0.31 0.00 0.00 61.69 61.10 3h0r s THR 82 Cb -0.56 -2.26 -0.27 0.00 0.01 0.00 0.00 72.50 69.41 3h0r s THR 82 CO 0.44 -0.33 0.55 0.35 -0.69 0.00 0.00 174.62 174.94 3h0r n THR 83 N 4.46 0.00 -2.14 -0.82 -2.24 -1.22 -4.68 114.28 107.65 3h0r n THR 83 Ca -0.05 -0.32 -0.10 0.00 -2.27 0.00 0.00 64.05 61.31 3h0r n THR 83 Cb 0.42 0.36 -0.01 0.00 -2.10 0.00 0.00 70.33 69.00 3h0r n THR 83 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h0r n ALA 85 N -1.63 -1.27 -2.45 0.00 0.00 -1.26 -1.16 120.51 112.73 3h0r n ALA 85 Ca -0.11 0.23 -0.26 0.00 0.00 0.00 0.00 53.44 53.29 3h0r n ALA 85 Cb 0.52 -4.62 -0.15 0.00 0.00 0.00 0.00 19.45 15.20 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 2.42 0.35 0.00 0.15 0.70 -1.62 113.70 112.43 3h0r s SER 86 Ca 0.65 -0.43 0.03 0.00 0.70 0.00 0.00 55.95 56.91 3h0r s SER 86 Cb -0.32 -0.24 0.64 0.00 -1.71 0.00 0.00 66.02 64.39 3h0r s SER 86 CO 0.80 0.22 1.95 0.11 1.20 0.00 0.00 173.24 177.52 3h0r h LYS 87 N 5.34 0.67 0.00 5.44 1.79 -1.84 -1.41 116.57 126.56 3h0r h LYS 87 Ca -0.40 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 3h0r h LYS 87 Cb 1.15 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.67 3h0r h LYS 87 CO 0.46 0.53 0.00 0.44 -1.08 0.00 0.00 179.45 179.81 3h0r n ILE 88 N -4.38 0.82 -0.54 1.86 -6.64 -0.80 -3.29 119.36 106.40 3h0r n ILE 88 Ca 0.04 0.22 0.01 0.00 -1.77 0.00 0.00 62.75 61.25 3h0r n ILE 88 Cb 0.13 -1.16 0.02 0.00 -1.44 0.00 0.00 39.64 37.20 3h0r n ILE 88 CO 0.00 0.00 0.00 0.18 -1.77 0.00 0.00 176.55 174.96 3h0r n LEU 89 N -2.26 1.42 -4.77 7.28 4.32 -1.01 -1.18 117.00 120.79 3h0r n LEU 89 Ca 0.02 -1.60 -0.38 0.00 -0.02 0.00 0.00 56.01 54.04 3h0r n LEU 89 Cb 0.23 -0.06 -0.02 0.00 -1.62 0.00 0.00 43.42 41.95 3h0r n LEU 89 CO 0.20 0.39 0.81 -1.83 -1.22 0.00 0.00 177.39 175.74 3h0r s GLU 90 N -0.96 4.06 0.00 3.23 -1.05 -0.56 -2.32 118.70 121.09 3h0r s GLU 90 Ca 0.05 1.75 0.00 0.00 -0.15 0.00 0.00 54.97 56.62 3h0r s GLU 90 Cb 0.04 -2.63 0.00 0.00 -0.44 0.00 0.00 34.13 31.10 3h0r s GLU 90 CO 0.00 -0.29 0.00 0.09 0.95 0.00 0.00 175.26 176.01 3h0r n ASN 91 N 0.01 0.00 -4.63 0.83 3.02 -1.26 -4.67 115.26 108.56 3h0r n ASN 91 Ca 0.05 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.17 3h0r n ASN 91 Cb 0.47 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.62 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 -3.53 2.82 -0.11 3.10 5.36 -0.98 -4.91 117.98 119.73 3h0r s PHE 92 Ca 0.00 0.95 -0.17 0.00 -0.96 0.00 0.00 56.93 56.75 3h0r s PHE 92 Cb 0.00 -3.88 -0.04 0.00 -0.34 0.00 0.00 43.02 38.76 3h0r s PHE 92 CO 0.00 -1.42 0.42 0.08 -1.46 0.00 0.00 175.22 172.84 3h0r s VAL 93 N 4.17 5.20 -0.07 3.12 1.01 -1.26 -1.58 120.40 130.99 3h0r s VAL 93 Ca 0.53 0.84 -0.30 0.00 0.00 0.00 0.00 61.98 63.05 3h0r s VAL 93 Cb -0.15 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 3h0r s VAL 93 CO 0.21 0.37 1.39 0.00 0.00 0.00 0.00 175.10 177.07 3h0r s ALA 94 N 0.39 3.60 -1.22 5.51 0.00 -0.92 -4.92 121.76 124.21 3h0r s ALA 94 Ca 0.23 0.74 0.29 0.00 0.00 0.00 0.00 51.96 53.22 3h0r s ALA 94 Cb -0.15 -3.63 1.33 0.00 0.00 0.00 0.00 23.12 20.68 3h0r s ALA 94 CO 0.09 -1.08 1.95 -2.30 0.00 0.00 0.00 175.76 174.42 3h0r n PRO 95 N 6.10 0.21 -3.68 0.00 -0.02 -1.26 -1.30 135.00 135.04 3h0r n PRO 95 Ca 0.14 0.02 -0.09 0.00 -2.02 0.00 0.00 63.50 61.54 3h0r n PRO 95 Cb 0.44 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.40 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 -2.78 -0.28 -0.07 6.00 1.13 -1.26 -4.93 117.35 115.16 3h0r s TYR 96 Ca 0.21 -0.06 -0.18 0.00 -1.41 0.00 0.00 57.07 55.62 3h0r s TYR 96 Cb 0.19 0.57 -0.05 0.00 -1.10 0.00 0.00 41.96 41.57 3h0r s TYR 96 CO 0.48 -1.02 0.51 -0.51 -2.51 0.00 0.00 175.55 172.49 3h0r s ASP 97 N -2.85 6.79 0.62 -0.18 1.01 -1.26 -3.60 116.67 117.21 3h0r s ASP 97 Ca 0.07 0.95 -0.18 0.00 0.71 0.00 0.00 52.55 54.10 3h0r s ASP 97 Cb -0.03 -2.31 -0.04 0.00 1.01 0.00 0.00 42.92 41.56 3h0r s ASP 97 CO -0.02 0.08 0.97 0.00 0.21 0.00 0.00 175.17 176.40 3h0r n ALA 98 N 3.12 0.14 -0.33 5.23 0.00 -0.55 -4.80 120.51 123.32 3h0r n ALA 98 Ca -0.08 -0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.36 3h0r n ALA 98 Cb 0.52 -2.11 0.17 0.00 0.00 0.00 0.00 19.45 18.02 3h0r n ALA 98 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3h0r h THR 99 N 0.35 1.02 -0.95 0.00 2.02 -1.60 -1.83 112.91 111.92 3h0r h THR 99 Ca -0.49 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.35 3h0r h THR 99 Cb 1.36 -0.08 -0.05 0.00 -1.74 0.00 0.00 68.15 67.65 3h0r h THR 99 CO 0.50 0.18 0.61 -0.37 0.37 0.00 0.00 175.52 176.81 3h0r h VAL 100 N 1.01 1.25 -0.46 3.16 -1.51 -1.85 -1.48 116.25 116.36 3h0r h VAL 100 Ca 0.41 -0.50 -0.13 0.00 -1.23 0.00 0.00 66.70 65.26 3h0r h VAL 100 Cb 0.24 -0.13 -0.01 0.00 -2.13 0.00 0.00 31.29 29.26 3h0r h VAL 100 CO -0.20 0.25 -0.20 0.40 -1.23 0.00 0.00 177.57 176.59 3h0r h ILE 101 N 1.30 1.27 -0.88 7.19 1.08 -1.68 0.09 117.51 125.88 3h0r h ILE 101 Ca 0.35 -1.36 0.03 0.00 -0.39 0.00 0.00 64.86 63.49 3h0r h ILE 101 Cb -0.11 1.13 -0.05 0.00 -3.07 0.00 0.00 36.82 34.72 3h0r h ILE 101 CO -0.07 0.47 0.57 -0.08 -0.69 0.00 0.00 178.15 178.35 3h0r h GLU 102 N 0.81 1.09 -0.04 2.37 4.81 -0.97 -1.02 114.58 121.64 3h0r h GLU 102 Ca 0.11 -0.07 -0.17 0.00 -0.13 0.00 0.00 59.36 59.10 3h0r h GLU 102 Cb 0.76 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 3h0r h GLU 102 CO 0.06 0.72 -0.74 0.00 -0.73 0.00 0.00 179.01 178.33 3h0r h ARG 103 N 1.13 0.25 -0.15 1.92 3.08 -0.74 -1.89 114.38 117.98 3h0r h ARG 103 Ca 0.34 -0.22 -0.05 0.00 0.07 0.00 0.00 59.98 60.13 3h0r h ARG 103 Cb -0.04 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 3h0r h ARG 103 CO -0.10 0.88 -0.11 -0.07 -1.07 0.00 0.00 179.97 179.50 3h0r h LEU 104 N 0.17 0.35 -0.88 3.04 3.38 -0.81 -2.66 115.31 117.90 3h0r h LEU 104 Ca -0.03 -0.45 0.02 0.00 0.09 0.00 0.00 57.88 57.51 3h0r h LEU 104 Cb 1.31 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.91 3h0r h LEU 104 CO 0.12 0.72 0.58 0.11 0.09 0.00 0.00 178.44 180.05 3h0r h LYS 105 N -0.02 1.12 0.00 1.13 1.57 -1.16 -0.55 116.57 118.66 3h0r h LYS 105 Ca 0.03 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 3h0r h LYS 105 Cb 0.61 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 3h0r h LYS 105 CO 0.03 0.74 -0.08 -0.22 -0.57 0.00 0.00 179.45 179.35 3h0r h LYS 106 N 1.16 0.00 -0.15 3.15 3.64 -1.33 -1.76 116.57 121.28 3h0r h LYS 106 Ca 0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 3h0r h LYS 106 Cb -0.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 3h0r h LYS 106 CO -0.09 0.08 0.00 0.00 -2.27 0.00 0.00 179.45 177.18 3h0r n ALA 107 N -2.25 2.51 -0.56 5.00 0.00 -0.30 -4.92 120.51 119.98 3h0r n ALA 107 Ca -0.02 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.81 3h0r n ALA 107 Cb 0.21 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 1.24 0.77 3.69 0.00 0.00 -0.66 -0.54 105.19 109.69 3h0r n GLY 108 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3h0r n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0r s ALA 109 N -2.94 1.59 -0.23 4.61 0.00 -0.65 -4.09 121.76 120.06 3h0r s ALA 109 Ca 0.00 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.37 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 -2.50 -0.07 -0.51 0.00 0.00 0.00 175.76 172.68 3h0r s LEU 110 N -6.41 2.55 -0.09 0.00 1.43 0.68 -4.58 118.68 112.26 3h0r s LEU 110 Ca 0.65 -1.10 -0.29 0.00 -1.03 0.00 0.00 54.13 52.35 3h0r s LEU 110 Cb -0.21 -1.23 -0.05 0.00 0.03 0.00 0.00 46.19 44.73 3h0r s LEU 110 CO 0.58 -0.20 1.71 -0.63 0.23 0.00 0.00 176.35 178.03 3h0r s ILE 111 N 1.37 3.52 -0.69 -0.59 1.09 -1.26 -1.45 121.20 123.19 3h0r s ILE 111 Ca -0.05 0.61 0.15 0.00 -1.10 0.00 0.00 60.65 60.26 3h0r s ILE 111 Cb -0.18 -3.44 -0.16 0.00 -1.06 0.00 0.00 42.46 37.62 3h0r s ILE 111 CO -0.07 -0.10 0.62 0.55 -0.10 0.00 0.00 174.94 175.84 3h0r n VAL 112 N 5.82 0.00 0.00 2.92 3.14 -0.72 -4.53 118.33 124.95 3h0r n VAL 112 Ca 0.19 -0.15 0.00 0.00 -2.96 0.00 0.00 64.34 61.41 3h0r n VAL 112 Cb 0.43 0.99 0.00 0.00 -1.06 0.00 0.00 33.84 34.20 3h0r n VAL 112 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3h0r n GLY 113 N 1.35 1.45 3.44 7.55 0.00 -1.26 0.06 105.19 117.78 3h0r n GLY 113 Ca 0.03 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.72 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 3.55 -0.02 1.61 -0.14 0.21 -1.47 119.74 121.49 3h0r s LYS 114 Ca 0.00 -0.58 -0.02 0.00 -1.36 0.00 0.00 55.97 54.01 3h0r s LYS 114 Cb 0.00 -2.84 -0.04 0.00 -1.68 0.00 0.00 37.83 33.27 3h0r s LYS 114 CO 0.00 0.18 0.15 -0.08 -0.76 0.00 0.00 175.35 174.84 3h0r s THR 115 N 0.49 5.22 0.68 2.17 -1.32 0.89 0.01 115.64 123.78 3h0r s THR 115 Ca -0.05 -0.20 -0.16 0.00 -1.21 0.00 0.00 61.69 60.07 3h0r s THR 115 Cb -0.15 -3.41 0.01 0.00 -1.51 0.00 0.00 72.50 67.44 3h0r s THR 115 CO 0.03 0.36 1.21 0.21 -2.21 0.00 0.00 174.62 174.23 3h0r s ASN 116 N -1.78 4.57 0.21 8.08 2.47 0.16 -2.10 114.94 126.54 3h0r s ASN 116 Ca 0.25 2.38 -0.17 0.00 0.42 0.00 0.00 52.86 55.73 3h0r s ASN 116 Cb -0.12 -2.59 0.02 0.00 -1.45 0.00 0.00 41.25 37.11 3h0r s ASN 116 CO 0.16 -2.01 0.53 -1.48 -3.72 0.00 0.00 177.10 170.57 3h0r s LEU 117 N -4.75 0.09 0.50 3.21 2.34 -1.26 -2.16 118.68 116.65 3h0r s LEU 117 Ca 0.76 -0.55 -0.23 0.00 0.06 0.00 0.00 54.13 54.17 3h0r s LEU 117 Cb -0.30 2.14 -0.06 0.00 -0.56 0.00 0.00 46.19 47.41 3h0r s LEU 117 CO 0.41 -1.09 1.29 -1.81 -1.06 0.00 0.00 176.35 174.10 3h0r s ASP 118 N -2.90 5.66 0.07 1.48 1.01 -1.12 -3.43 116.67 117.44 3h0r s ASP 118 Ca 0.11 2.62 -0.31 0.00 0.71 0.00 0.00 52.55 55.68 3h0r s ASP 118 Cb -0.01 -2.63 -0.10 0.00 1.01 0.00 0.00 42.92 41.19 3h0r s ASP 118 CO -0.00 -1.29 1.92 1.21 0.21 0.00 0.00 175.17 177.21 3h0r n GLU 119 N -0.73 2.83 -2.02 8.23 2.13 -0.87 -0.61 120.64 129.59 3h0r n GLU 119 Ca 0.09 1.03 -0.18 0.00 0.66 0.00 0.00 57.16 58.76 3h0r n GLU 119 Cb 0.46 -2.96 -0.04 0.00 0.27 0.00 0.00 31.44 29.17 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 6.72 -0.52 -1.68 4.31 3.72 -0.31 -2.78 117.46 126.92 3h0r n PHE 120 Ca 0.19 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.46 3h0r n PHE 120 Cb 0.39 -3.43 -0.04 0.00 -0.94 0.00 0.00 39.48 35.46 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 -0.58 -0.27 -3.50 4.37 0.00 0.22 -4.79 120.51 115.96 3h0r n ALA 121 Ca -0.21 0.18 -0.40 0.00 0.00 0.00 0.00 53.44 53.01 3h0r n ALA 121 Cb 0.64 -1.53 -0.09 0.00 0.00 0.00 0.00 19.45 18.47 3h0r n ALA 121 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3h0r s MET 122 N -3.65 2.47 0.00 0.00 -1.94 -1.12 -4.65 119.30 110.41 3h0r s MET 122 Ca 0.00 -1.68 0.00 0.00 -1.71 0.00 0.00 55.69 52.30 3h0r s MET 122 Cb 0.00 -3.85 0.00 0.00 2.01 0.00 0.00 34.83 32.99 3h0r s MET 122 CO 0.00 -1.11 0.00 0.41 -0.01 0.00 0.00 175.02 174.31 3h0r n GLY 123 N 4.88 1.74 1.30 -0.03 0.00 -1.26 -4.49 105.19 107.33 3h0r n GLY 123 Ca -0.08 -1.58 0.03 0.00 0.00 0.00 0.00 46.02 44.39 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 1.43 0.00 1.61 7.64 -1.26 -2.55 113.62 120.49 3h0r n SER 124 Ca 0.00 -2.72 0.00 0.00 1.01 0.00 0.00 58.87 57.16 3h0r n SER 124 Cb 0.00 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 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 -0.17 0.00 0.00 6.43 3.41 -1.22 -2.57 113.62 119.50 3h0r n SER 125 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 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 0.25 6.66 -1.04 -1.08 -4.11 114.28 114.96 3h0r n THR 126 Ca 0.00 0.00 0.17 0.00 -2.04 0.00 0.00 64.05 62.18 3h0r n THR 126 Cb 0.00 -0.05 0.89 0.00 -1.82 0.00 0.00 70.33 69.35 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 1.44 0.00 -0.21 -2.82 5.08 -1.90 -0.92 114.58 115.24 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 0.28 -1.69 4.33 4.01 -1.26 -4.77 117.16 114.35 3h0r n TYR 128 Ca -0.00 -0.14 -0.44 0.00 -0.16 0.00 0.00 57.90 57.15 3h0r n TYR 128 Cb 0.24 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.24 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 0.14 3.13 0.00 7.72 2.88 -0.35 -2.05 113.62 125.08 3h0r n SER 129 Ca 0.09 1.12 0.11 0.00 -1.33 0.00 0.00 58.87 58.86 3h0r n SER 129 Cb 0.21 -1.47 0.51 0.00 -0.75 0.00 0.00 64.21 62.71 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 2.54 2.06 -0.11 -1.46 0.00 -0.64 -3.97 120.51 118.93 3h0r n ALA 130 Ca 0.13 -0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.26 3h0r n ALA 130 Cb 0.32 -1.35 -0.08 0.00 0.00 0.00 0.00 19.45 18.33 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 -1.39 0.00 -3.63 0.00 3.72 -1.26 -4.91 117.46 109.99 3h0r n PHE 131 Ca 0.08 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.45 3h0r n PHE 131 Cb 0.21 -0.79 -0.04 0.00 -0.94 0.00 0.00 39.48 37.92 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 -2.41 -0.07 0.36 1.38 -0.71 -1.25 -5.16 117.98 110.12 3h0r s PHE 132 Ca -0.30 0.11 -0.26 0.00 -1.04 0.00 0.00 56.93 55.44 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 0.41 -0.08 1.08 -1.25 -1.34 0.00 0.00 175.22 174.04 3h0r s PRO 133 N -1.30 4.30 0.20 1.99 0.04 -1.26 -4.66 135.00 134.31 3h0r s PRO 133 Ca 0.08 1.66 -0.15 0.00 0.04 0.00 0.00 61.00 62.63 3h0r s PRO 133 Cb -0.01 -2.78 -0.08 0.00 0.04 0.00 0.00 34.50 31.68 3h0r s PRO 133 CO -0.06 -0.05 0.61 0.99 0.04 0.00 0.00 177.00 178.53 3h0r s THR 134 N -1.46 4.78 -0.03 1.26 2.01 -1.26 -4.82 115.64 116.13 3h0r s THR 134 Ca 0.53 0.88 0.03 0.00 0.31 0.00 0.00 61.69 63.45 3h0r s THR 134 Cb -0.27 -3.73 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 3h0r s THR 134 CO 0.34 0.13 -0.12 -0.54 -0.69 0.00 0.00 174.62 173.74 3h0r s LYS 135 N -2.24 2.50 -0.15 4.92 1.02 -0.21 -4.34 119.74 121.23 3h0r s LYS 135 Ca 0.43 -0.71 -0.29 0.00 0.02 0.00 0.00 55.97 55.41 3h0r s LYS 135 Cb -0.14 -2.42 -0.04 0.00 -0.52 0.00 0.00 37.83 34.71 3h0r s LYS 135 CO 0.20 0.62 1.71 1.21 -0.92 0.00 0.00 175.35 178.16 3h0r s ASN 136 N -1.00 6.37 0.11 2.83 3.84 -0.17 -4.73 114.94 122.19 3h0r s ASN 136 Ca 0.13 1.90 0.08 0.00 0.21 0.00 0.00 52.86 55.18 3h0r s ASN 136 Cb -0.11 -2.53 0.41 0.00 -0.55 0.00 0.00 41.25 38.47 3h0r s ASN 136 CO 0.03 -1.22 1.24 -0.81 -2.79 0.00 0.00 177.10 173.55 3h0r n PRO 137 N 7.61 0.05 0.02 0.43 -0.04 -1.26 -0.98 135.00 140.83 3h0r n PRO 137 Ca 0.19 0.54 0.11 0.00 -0.04 0.00 0.00 63.50 64.30 3h0r n PRO 137 Cb 0.44 -1.65 0.08 0.00 -0.04 0.00 0.00 33.50 32.33 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 -1.75 0.22 -3.15 0.54 7.02 -1.26 -4.24 117.44 114.82 3h0r n TRP 138 Ca -0.00 0.06 0.05 0.00 -1.02 0.00 0.00 57.50 56.59 3h0r n TRP 138 Cb 0.02 -0.38 -0.00 0.00 -2.42 0.00 0.00 31.31 28.53 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 -3.67 -0.87 0.00 -0.99 -1.08 -0.15 -4.91 116.67 104.99 3h0r s ASP 139 Ca 0.06 0.18 0.12 0.00 -0.52 0.00 0.00 52.55 52.39 3h0r s ASP 139 Cb 0.15 1.58 0.68 0.00 -1.46 0.00 0.00 42.92 43.88 3h0r s ASP 139 CO 0.78 -0.16 1.23 0.18 0.52 0.00 0.00 175.17 177.72 3h0r n LEU 140 N 5.28 0.00 -0.07 -1.34 4.77 -0.91 0.46 117.00 125.18 3h0r n LEU 140 Ca 0.05 0.13 0.14 0.00 -0.03 0.00 0.00 56.01 56.31 3h0r n LEU 140 Cb 0.56 -0.13 0.65 0.00 -2.33 0.00 0.00 43.42 42.17 3h0r n LEU 140 CO -0.11 -0.08 0.91 -0.62 -1.33 0.00 0.00 177.39 176.16 3h0r n GLU 141 N -1.13 0.56 -4.39 3.23 1.02 -1.26 -4.73 120.64 113.93 3h0r n GLU 141 Ca 0.08 -0.14 -0.26 0.00 -0.02 0.00 0.00 57.16 56.82 3h0r n GLU 141 Cb 0.07 -1.50 -0.11 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 -2.53 1.71 0.40 3.49 0.52 0.17 -3.29 118.95 119.42 3h0r s ARG 142 Ca 0.28 -1.50 -0.20 0.00 -0.52 0.00 0.00 55.73 53.79 3h0r s ARG 142 Cb 0.20 -1.92 -0.10 0.00 0.52 0.00 0.00 34.95 33.64 3h0r s ARG 142 CO 0.48 0.40 0.91 0.14 0.02 0.00 0.00 175.30 177.24 3h0r s VAL 143 N -1.84 4.44 -2.15 3.52 -7.23 -0.61 -1.00 120.40 115.52 3h0r s VAL 143 Ca 0.24 1.40 0.29 0.00 -1.81 0.00 0.00 61.98 62.10 3h0r s VAL 143 Cb -0.08 -3.63 0.64 0.00 0.56 0.00 0.00 36.38 33.87 3h0r s VAL 143 CO 0.12 -0.26 1.91 -0.81 -0.31 0.00 0.00 175.10 175.76 3h0r n PRO 144 N -0.49 1.24 0.00 4.82 -0.04 -1.26 -4.49 135.00 134.78 3h0r n PRO 144 Ca 0.06 -0.50 0.00 0.00 -0.04 0.00 0.00 63.50 63.02 3h0r n PRO 144 Cb 0.54 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 3h0r n PRO 144 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h0r n GLY 145 N 1.14 -3.78 3.65 0.55 0.00 -1.26 -4.37 105.19 101.12 3h0r n GLY 145 Ca 0.19 -1.96 -0.06 0.00 0.00 0.00 0.00 46.02 44.20 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 -0.53 -0.33 0.22 -0.02 0.00 -1.06 -2.65 107.32 102.94 3h0r s GLY 146 Ca 0.00 0.47 0.23 0.00 0.00 0.00 0.00 44.72 45.42 3h0r s GLY 146 CO 0.00 0.13 1.20 1.48 0.00 0.00 0.00 173.10 175.91 3h0r h SER 147 N 2.00 0.00 0.00 1.64 4.64 -1.59 -3.38 113.55 116.86 3h0r h SER 147 Ca -0.24 -0.05 -0.09 0.00 -0.47 0.00 0.00 61.79 60.94 3h0r h SER 147 Cb 1.24 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.30 3h0r h SER 147 CO 0.28 0.03 -0.09 -1.20 -0.87 0.00 0.00 176.83 174.97 3h0r n SER 148 N -2.60 3.83 -0.02 4.97 7.64 -0.93 -2.81 113.62 123.71 3h0r n SER 148 Ca 0.01 -2.14 -0.09 0.00 1.01 0.00 0.00 58.87 57.66 3h0r n SER 148 Cb 0.52 -0.96 -0.03 0.00 -1.01 0.00 0.00 64.21 62.74 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 4.56 -0.04 1.66 0.23 0.00 -1.70 -2.49 103.07 105.28 3h0r h GLY 149 Ca 0.09 0.18 -0.08 0.00 0.00 0.00 0.00 47.33 47.51 3h0r h GLY 149 CO 0.19 -0.15 -0.23 -1.33 0.00 0.00 0.00 176.54 175.02 3h0r h GLY 150 N -0.16 0.43 1.76 4.60 0.00 -1.64 -1.48 103.07 106.58 3h0r h GLY 150 Ca 0.10 -0.34 -0.15 0.00 0.00 0.00 0.00 47.33 46.95 3h0r h GLY 150 CO -0.26 0.31 -0.60 1.76 0.00 0.00 0.00 176.54 177.74 3h0r h SER 151 N 0.36 0.28 0.02 0.19 0.02 -1.71 -1.49 113.55 111.22 3h0r h SER 151 Ca 0.06 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.85 3h0r h SER 151 Cb 0.61 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.07 3h0r h SER 151 CO 0.04 0.81 -0.01 0.00 -1.14 0.00 0.00 176.83 176.54 3h0r h ALA 152 N 1.19 -0.02 -0.42 3.77 0.00 -1.39 -3.20 119.26 119.20 3h0r h ALA 152 Ca -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3h0r h ALA 152 Cb 1.11 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3h0r h ALA 152 CO 0.09 -0.25 0.26 0.00 0.00 0.00 0.00 179.25 179.36 3h0r h ALA 153 N 0.41 0.53 0.00 0.00 0.00 -1.20 0.06 119.26 119.06 3h0r h ALA 153 Ca -0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3h0r h ALA 153 Cb 0.53 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3h0r h ALA 153 CO 0.00 0.00 -0.26 0.66 0.00 0.00 0.00 179.25 179.65 3h0r h SER 154 N 0.56 0.00 0.73 0.00 4.64 -1.41 -0.55 113.55 117.52 3h0r h SER 154 Ca 0.15 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.28 3h0r h SER 154 Cb -0.03 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 3h0r h SER 154 CO -0.03 0.26 -0.88 0.58 -0.87 0.00 0.00 176.83 175.89 3h0r h VAL 155 N 0.00 1.56 -0.08 0.95 2.07 -1.38 -0.82 116.25 118.55 3h0r h VAL 155 Ca -0.00 -2.81 -0.02 0.00 0.82 0.00 0.00 66.70 64.69 3h0r h VAL 155 Cb 0.47 2.55 -0.00 0.00 -1.52 0.00 0.00 31.29 32.79 3h0r h VAL 155 CO 0.03 0.81 -0.01 0.00 0.02 0.00 0.00 177.57 178.42 3h0r h ALA 156 N 1.05 0.11 0.00 1.67 0.00 0.02 -2.97 119.26 119.13 3h0r h ALA 156 Ca -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3h0r h ALA 156 Cb 1.53 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.30 3h0r h ALA 156 CO 0.13 -0.19 0.00 1.33 0.00 0.00 0.00 179.25 180.52 3h0r n VAL 157 N -4.81 0.44 -2.89 0.00 0.24 -0.31 -4.42 118.33 106.57 3h0r n VAL 157 Ca -0.07 -0.01 -0.17 0.00 -2.04 0.00 0.00 64.34 62.06 3h0r n VAL 157 Cb 0.22 -0.69 0.03 0.00 -1.47 0.00 0.00 33.84 31.93 3h0r n VAL 157 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3h0r n LEU 158 N -1.80 -2.49 0.00 1.34 4.77 -0.60 -4.89 117.00 113.34 3h0r n LEU 158 Ca 0.05 -0.24 0.11 0.00 -0.03 0.00 0.00 56.01 55.91 3h0r n LEU 158 Cb 0.32 -2.33 0.52 0.00 -2.33 0.00 0.00 43.42 39.60 3h0r n LEU 158 CO 0.25 0.22 0.87 -1.54 -1.33 0.00 0.00 177.39 175.86 3h0r n SER 159 N -1.45 0.00 -3.71 -1.43 3.41 -0.42 -4.69 113.62 105.33 3h0r n SER 159 Ca -0.07 0.37 -0.14 0.00 -0.26 0.00 0.00 58.87 58.77 3h0r n SER 159 Cb 0.58 -0.45 -0.09 0.00 -0.26 0.00 0.00 64.21 63.99 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 -2.90 -1.12 0.06 7.33 0.00 -1.04 -4.71 121.76 119.38 3h0r s ALA 160 Ca 0.14 1.14 0.11 0.00 0.00 0.00 0.00 51.96 53.36 3h0r s ALA 160 Cb 0.15 -0.58 0.05 0.00 0.00 0.00 0.00 23.12 22.74 3h0r s ALA 160 CO 0.41 -0.23 1.42 -1.00 0.00 0.00 0.00 175.76 176.36 3h0r h PRO 161 N 5.04 0.00 -3.78 0.00 0.13 -1.84 -3.33 132.00 128.22 3h0r h PRO 161 Ca -0.28 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.74 3h0r h PRO 161 Cb 1.18 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.14 3h0r h PRO 161 CO 0.26 0.73 -0.47 0.54 -0.23 0.00 0.00 178.00 178.82 3h0r s VAL 162 N -3.00 0.14 0.07 1.56 0.11 -1.26 -4.27 120.40 113.75 3h0r s VAL 162 Ca 0.02 -1.12 -0.17 0.00 -2.93 0.00 0.00 61.98 57.78 3h0r s VAL 162 Cb 0.10 -1.04 0.03 0.00 -1.53 0.00 0.00 36.38 33.94 3h0r s VAL 162 CO 0.77 -0.62 0.40 -0.55 -3.33 0.00 0.00 175.10 171.78 3h0r s SER 163 N -2.32 -0.25 -0.11 3.54 0.15 -0.57 -2.60 113.70 111.52 3h0r s SER 163 Ca -0.02 -0.13 0.01 0.00 0.70 0.00 0.00 55.95 56.51 3h0r s SER 163 Cb 0.01 0.44 -0.02 0.00 -1.71 0.00 0.00 66.02 64.74 3h0r s SER 163 CO -0.06 -0.73 -0.13 -0.76 1.20 0.00 0.00 173.24 172.76 3h0r s LEU 164 N -2.29 2.73 0.00 3.45 1.02 -0.62 -1.03 118.68 121.93 3h0r s LEU 164 Ca -0.02 -0.29 0.01 0.00 0.02 0.00 0.00 54.13 53.84 3h0r s LEU 164 Cb 0.00 -1.60 -0.00 0.00 0.02 0.00 0.00 46.19 44.61 3h0r s LEU 164 CO -0.06 0.21 0.03 0.61 0.02 0.00 0.00 176.35 177.16 3h0r n GLY 165 N 3.25 3.92 3.16 -3.19 0.00 -0.80 -1.89 105.19 109.64 3h0r n GLY 165 Ca -0.18 -1.94 -0.13 0.00 0.00 0.00 0.00 46.02 43.78 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 -1.50 1.27 -0.17 1.61 1.04 -1.26 -1.51 113.70 113.19 3h0r s SER 166 Ca 0.04 -0.86 -0.03 0.00 0.48 0.00 0.00 55.95 55.58 3h0r s SER 166 Cb 0.00 0.04 0.05 0.00 0.10 0.00 0.00 66.02 66.22 3h0r s SER 166 CO 0.03 -0.33 0.05 -0.62 0.98 0.00 0.00 173.24 173.35 3h0r s ASP 167 N -2.59 2.52 -0.20 7.02 -1.08 0.02 -3.26 116.67 119.11 3h0r s ASP 167 Ca 0.06 -0.63 0.11 0.00 -0.52 0.00 0.00 52.55 51.57 3h0r s ASP 167 Cb -0.01 -0.46 -0.20 0.00 -1.46 0.00 0.00 42.92 40.79 3h0r s ASP 167 CO -0.02 -0.30 -0.03 0.41 0.52 0.00 0.00 175.17 175.75 3h0r n THR 168 N 5.13 1.27 -2.12 1.71 -1.04 -1.26 -2.27 114.28 115.70 3h0r n THR 168 Ca -0.08 -0.67 -0.02 0.00 -2.04 0.00 0.00 64.05 61.24 3h0r n THR 168 Cb 0.48 -0.81 -0.02 0.00 -1.82 0.00 0.00 70.33 68.16 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 0.73 0.00 3.41 0.00 -1.26 -4.68 105.19 105.46 3h0r n GLY 169 Ca -0.33 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 0.12 0.68 0.00 -0.02 0.00 -1.26 -3.28 105.19 101.43 3h0r n GLY 170 Ca -0.10 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.00 3h0r n GLY 170 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h0r n SER 171 N 0.00 0.00 -0.13 1.61 7.64 -1.26 -0.83 113.62 120.65 3h0r n SER 171 Ca 0.00 0.47 -0.26 0.00 1.01 0.00 0.00 58.87 60.09 3h0r n SER 171 Cb 0.00 -0.49 -0.10 0.00 -1.01 0.00 0.00 64.21 62.61 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 -1.49 1.53 0.02 0.44 5.41 -1.20 -2.20 119.36 121.87 3h0r n ILE 172 Ca 0.04 -0.24 -0.12 0.00 1.00 0.00 0.00 62.75 63.43 3h0r n ILE 172 Cb 0.19 -1.96 -0.07 0.00 -0.71 0.00 0.00 39.64 37.10 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 0.05 -0.35 0.38 3.08 -1.71 -1.19 114.38 113.63 3h0r h ARG 173 Ca -0.56 -0.01 -0.16 0.00 0.07 0.00 0.00 59.98 59.32 3h0r h ARG 173 Cb 1.48 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.52 3h0r h ARG 173 CO -0.34 0.11 -0.42 -0.56 -1.07 0.00 0.00 179.97 177.69 3h0r h GLN 174 N -0.03 0.91 -0.67 0.04 -0.00 -1.29 0.37 115.11 114.45 3h0r h GLN 174 Ca 0.01 -0.51 0.04 0.00 -0.00 0.00 0.00 58.65 58.20 3h0r h GLN 174 Cb 0.08 0.03 -0.04 0.00 -0.00 0.00 0.00 27.48 27.55 3h0r h GLN 174 CO -0.00 1.16 0.44 -1.35 -0.00 0.00 0.00 178.83 179.07 3h0r h PRO 175 N 0.72 0.73 -0.67 0.06 0.11 -1.75 -0.47 132.00 130.73 3h0r h PRO 175 Ca 0.05 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 3h0r h PRO 175 Cb 1.02 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.93 3h0r h PRO 175 CO 0.10 0.48 0.30 0.00 -0.21 0.00 0.00 178.00 178.67 3h0r h ALA 176 N 1.62 1.26 0.04 -0.75 0.00 -0.52 -0.75 119.26 120.17 3h0r h ALA 176 Ca 0.27 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3h0r h ALA 176 Cb 0.14 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3h0r h ALA 176 CO -0.08 0.56 -0.02 1.03 0.00 0.00 0.00 179.25 180.73 3h0r h SER 177 N 0.95 -0.05 0.28 0.00 0.87 -0.43 -0.58 113.55 114.60 3h0r h SER 177 Ca 0.23 -0.31 -0.04 0.00 -1.23 0.00 0.00 61.79 60.44 3h0r h SER 177 Cb 0.14 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 3h0r h SER 177 CO -0.03 0.29 -0.18 -0.26 -0.53 0.00 0.00 176.83 176.12 3h0r h PHE 178 N -0.40 0.00 -0.10 2.24 -1.00 -0.92 -2.98 116.94 113.78 3h0r h PHE 178 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 3h0r h PHE 178 Cb 0.36 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.92 3h0r h PHE 178 CO 0.04 0.18 0.00 0.00 -1.61 0.00 0.00 178.31 176.92 3h0r n GLY 180 N 1.08 0.00 3.29 0.00 0.00 -0.76 -4.74 105.19 104.06 3h0r n GLY 180 Ca 0.12 -0.12 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 3h0r n GLY 180 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h0r s VAL 181 N -3.21 0.69 0.04 1.61 -7.23 -0.30 -4.88 120.40 107.13 3h0r s VAL 181 Ca 0.20 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 58.09 3h0r s VAL 181 Cb -0.09 -2.36 -0.05 0.00 0.56 0.00 0.00 36.38 34.45 3h0r s VAL 181 CO 0.44 -0.27 0.90 -0.63 -0.31 0.00 0.00 175.10 175.23 3h0r s ILE 182 N -3.65 4.73 -0.05 -0.62 1.01 0.16 -4.32 121.20 118.46 3h0r s ILE 182 Ca 0.30 1.90 -0.02 0.00 0.00 0.00 0.00 60.65 62.83 3h0r s ILE 182 Cb 0.07 -4.25 0.04 0.00 0.01 0.00 0.00 42.46 38.33 3h0r s ILE 182 CO 0.08 0.27 0.09 -0.83 0.00 0.00 0.00 174.94 174.55 3h0r s GLY 183 N 0.40 0.13 -0.10 6.18 0.00 -0.74 -0.65 107.32 112.54 3h0r s GLY 183 Ca 0.46 0.35 0.00 0.00 0.00 0.00 0.00 44.72 45.53 3h0r s GLY 183 CO 0.26 1.33 -0.11 -1.50 0.00 0.00 0.00 173.10 173.08 3h0r s ILE 184 N 1.95 3.27 -0.25 0.90 2.07 -0.25 -1.07 121.20 127.82 3h0r s ILE 184 Ca 0.01 -0.61 -0.05 0.00 -1.41 0.00 0.00 60.65 58.60 3h0r s ILE 184 Cb -0.12 -2.35 -0.00 0.00 0.13 0.00 0.00 42.46 40.11 3h0r s ILE 184 CO -0.04 0.55 0.00 -0.75 -1.91 0.00 0.00 174.94 172.79 3h0r s LYS 185 N -0.11 3.29 0.95 3.50 2.20 -0.49 -2.01 119.74 127.06 3h0r s LYS 185 Ca -0.01 -0.70 -0.16 0.00 -0.36 0.00 0.00 55.97 54.74 3h0r s LYS 185 Cb -0.14 -3.14 0.22 0.00 -1.51 0.00 0.00 37.83 33.26 3h0r s LYS 185 CO 0.03 -0.28 1.29 -0.35 -0.36 0.00 0.00 175.35 175.68 3h0r n PRO 186 N 4.82 -1.28 -1.69 4.03 -0.04 -1.26 -1.07 135.00 138.50 3h0r n PRO 186 Ca -0.17 -1.99 -0.41 0.00 -0.04 0.00 0.00 63.50 60.89 3h0r n PRO 186 Cb 0.50 -1.33 0.01 0.00 -0.04 0.00 0.00 33.50 32.64 3h0r n PRO 186 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3h0r n THR 187 N -3.80 2.56 -1.74 0.52 -1.04 -1.26 -4.31 114.28 105.21 3h0r n THR 187 Ca 0.16 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 61.25 3h0r n THR 187 Cb 0.56 -1.51 -0.03 0.00 -1.82 0.00 0.00 70.33 67.53 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 -1.21 1.52 0.00 -1.42 5.04 -0.87 -1.07 117.35 119.35 3h0r s TYR 188 Ca 0.61 -0.29 0.00 0.00 -2.44 0.00 0.00 57.07 54.96 3h0r s TYR 188 Cb -0.52 -4.18 0.00 0.00 0.35 0.00 0.00 41.96 37.62 3h0r s TYR 188 CO 0.58 -5.17 0.00 0.41 -1.34 0.00 0.00 175.55 170.03 3h0r n GLY 189 N 4.43 1.59 0.13 8.97 0.00 -1.26 -4.93 105.19 114.12 3h0r n GLY 189 Ca 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 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 1.98 0.00 -4.97 1.61 2.43 -1.43 -1.19 114.38 112.81 3h0r h ARG 190 Ca 0.00 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 58.62 3h0r h ARG 190 Cb 0.00 0.00 -0.32 0.00 -0.42 0.00 0.00 29.97 29.23 3h0r h ARG 190 CO 0.00 0.62 -0.83 0.08 -1.51 0.00 0.00 179.97 178.33 3h0r s VAL 191 N -3.42 1.34 0.51 0.20 1.01 -1.26 0.09 120.40 118.86 3h0r s VAL 191 Ca -0.00 -0.63 -0.22 0.00 0.00 0.00 0.00 61.98 61.12 3h0r s VAL 191 Cb 0.12 -1.17 -0.07 0.00 0.00 0.00 0.00 36.38 35.25 3h0r s VAL 191 CO 0.75 0.39 1.16 -0.24 0.00 0.00 0.00 175.10 177.17 3h0r n SER 192 N 3.44 1.85 -0.99 3.32 2.88 -1.26 -4.73 113.62 118.13 3h0r n SER 192 Ca -0.20 0.97 0.08 0.00 -1.33 0.00 0.00 58.87 58.39 3h0r n SER 192 Cb 0.53 -1.46 0.24 0.00 -0.75 0.00 0.00 64.21 62.76 3h0r n SER 192 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3h0r n ARG 193 N -0.53 2.93 -2.14 -1.46 1.74 -1.26 -4.73 116.66 111.20 3h0r n ARG 193 Ca 0.10 -2.40 -0.43 0.00 -0.77 0.00 0.00 57.85 54.36 3h0r n ARG 193 Cb 0.43 -1.47 -0.02 0.00 -1.02 0.00 0.00 32.46 30.37 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 -1.21 2.13 0.00 -1.55 5.04 -1.26 -2.19 117.35 118.31 3h0r s TYR 194 Ca 0.36 0.58 0.00 0.00 -2.44 0.00 0.00 57.07 55.57 3h0r s TYR 194 Cb 0.20 -4.02 0.00 0.00 0.35 0.00 0.00 41.96 38.50 3h0r s TYR 194 CO 0.22 -2.79 0.00 0.41 -1.34 0.00 0.00 175.55 172.05 3h0r n GLY 195 N 4.76 0.76 3.58 8.97 0.00 -1.26 -1.44 105.19 120.55 3h0r n GLY 195 Ca 0.19 0.00 -0.40 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 4.19 -0.08 0.99 2.96 -0.93 -0.99 118.68 124.82 3h0r s LEU 196 Ca 0.00 0.05 -0.29 0.00 -0.22 0.00 0.00 54.13 53.67 3h0r s LEU 196 Cb 0.00 -2.36 -0.07 0.00 0.50 0.00 0.00 46.19 44.26 3h0r s LEU 196 CO 0.00 -0.24 2.02 -0.69 -1.32 0.00 0.00 176.35 176.12 3h0r s VAL 197 N 2.03 3.10 0.10 1.68 1.01 0.22 -4.89 120.40 123.64 3h0r s VAL 197 Ca 0.13 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 61.92 3h0r s VAL 197 Cb -0.16 -3.09 -0.06 0.00 0.00 0.00 0.00 36.38 33.06 3h0r s VAL 197 CO 0.11 -0.03 1.19 0.00 0.00 0.00 0.00 175.10 176.37 3h0r s ALA 198 N 5.93 3.40 0.00 5.51 0.00 -1.26 -4.94 121.76 130.39 3h0r s ALA 198 Ca 0.91 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.74 3h0r s ALA 198 Cb -0.37 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.32 3h0r s ALA 198 CO 0.38 -0.40 0.00 0.34 0.00 0.00 0.00 175.76 176.07 3h0r n PHE 199 N 3.50 0.00 -4.01 0.00 7.35 -1.26 -4.77 117.46 118.28 3h0r n PHE 199 Ca 0.07 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.44 3h0r n PHE 199 Cb 0.46 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 40.14 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 -4.48 2.71 0.47 3.13 0.00 -1.26 -2.84 121.76 119.49 3h0r s ALA 200 Ca 0.00 -1.92 0.13 0.00 0.00 0.00 0.00 51.96 50.17 3h0r s ALA 200 Cb 0.00 -1.78 1.08 0.00 0.00 0.00 0.00 23.12 22.43 3h0r s ALA 200 CO 0.00 -1.32 2.08 0.77 0.00 0.00 0.00 175.76 177.29 3h0r h SER 201 N 7.82 0.14 0.46 0.00 0.02 -1.93 0.57 113.55 120.63 3h0r h SER 201 Ca -0.17 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3h0r h SER 201 Cb 1.04 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.55 3h0r h SER 201 CO 0.50 0.15 -0.20 -1.54 -1.14 0.00 0.00 176.83 174.59 3h0r n SER 202 N -4.47 0.51 -0.01 3.07 3.41 -1.26 -4.17 113.62 110.70 3h0r n SER 202 Ca -0.01 -0.41 -0.01 0.00 -0.26 0.00 0.00 58.87 58.18 3h0r n SER 202 Cb 0.12 -0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.03 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 -1.09 0.00 -4.75 1.04 4.77 -0.59 -4.96 117.00 111.41 3h0r n LEU 203 Ca 0.11 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.68 3h0r n LEU 203 Cb 0.31 0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.44 3h0r n LEU 203 CO 0.27 0.04 1.07 0.47 -1.33 0.00 0.00 177.39 177.91 3h0r n ASP 204 N -2.04 3.49 -3.70 -1.43 8.00 0.09 -4.45 116.55 116.51 3h0r n ASP 204 Ca -0.03 1.22 -0.11 0.00 0.71 0.00 0.00 54.79 56.59 3h0r n ASP 204 Cb 0.53 -1.58 -0.10 0.00 -0.02 0.00 0.00 41.12 39.95 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 -2.04 0.42 0.42 -1.24 -1.52 -0.96 -4.87 119.66 109.87 3h0r s GLN 205 Ca 0.54 0.79 -0.26 0.00 -1.95 0.00 0.00 55.36 54.48 3h0r s GLN 205 Cb -0.50 0.02 -0.09 0.00 -0.22 0.00 0.00 33.01 32.22 3h0r s GLN 205 CO 0.63 -0.15 1.36 0.42 -0.25 0.00 0.00 175.29 177.31 3h0r s ILE 206 N 1.27 2.37 0.09 1.08 1.01 -1.26 -0.79 121.20 124.98 3h0r s ILE 206 Ca -0.08 0.34 -0.01 0.00 0.00 0.00 0.00 60.65 60.90 3h0r s ILE 206 Cb -0.08 -3.20 0.00 0.00 0.01 0.00 0.00 42.46 39.20 3h0r s ILE 206 CO -0.12 0.05 0.13 0.61 0.00 0.00 0.00 174.94 175.62 3h0r n GLY 207 N 0.62 2.83 3.10 6.18 0.00 -0.57 -4.48 105.19 112.87 3h0r n GLY 207 Ca 0.04 -1.43 -0.23 0.00 0.00 0.00 0.00 46.02 44.40 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 -2.54 1.17 -0.06 1.61 1.01 -0.85 -1.91 120.40 118.83 3h0r s VAL 208 Ca 0.08 -0.60 -0.02 0.00 0.00 0.00 0.00 61.98 61.43 3h0r s VAL 208 Cb -0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 3h0r s VAL 208 CO 0.05 0.34 0.06 -0.36 0.00 0.00 0.00 175.10 175.20 3h0r s PHE 209 N -0.07 3.31 0.38 5.22 0.08 -0.20 -1.09 117.98 125.60 3h0r s PHE 209 Ca 0.00 0.27 -0.16 0.00 0.12 0.00 0.00 56.93 57.17 3h0r s PHE 209 Cb -0.09 -1.80 0.06 0.00 -0.57 0.00 0.00 43.02 40.62 3h0r s PHE 209 CO 0.01 0.56 0.81 0.20 -0.10 0.00 0.00 175.22 176.70 3h0r s GLY 210 N -1.26 0.37 -0.06 4.36 0.00 0.18 -1.52 107.32 109.40 3h0r s GLY 210 Ca 0.17 -0.75 0.05 0.00 0.00 0.00 0.00 44.72 44.20 3h0r s GLY 210 CO 0.07 -0.17 0.02 0.54 0.00 0.00 0.00 173.10 173.56 3h0r n ARG 211 N -0.54 2.84 -4.83 2.90 1.74 -1.26 -0.66 116.66 116.85 3h0r n ARG 211 Ca -0.08 -0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.68 3h0r n ARG 211 Cb 0.60 -1.16 -0.13 0.00 -1.02 0.00 0.00 32.46 30.75 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 -2.15 2.32 0.50 5.56 0.52 -1.26 -4.46 118.95 119.98 3h0r s ARG 212 Ca -0.03 -0.81 0.17 0.00 -0.52 0.00 0.00 55.73 54.53 3h0r s ARG 212 Cb 0.02 -2.29 1.22 0.00 0.52 0.00 0.00 34.95 34.42 3h0r s ARG 212 CO 0.25 0.59 2.10 1.15 0.02 0.00 0.00 175.30 179.41 3h0r h THR 213 N 4.19 1.00 -0.26 0.02 2.02 -1.93 -1.72 112.91 116.23 3h0r h THR 213 Ca -0.47 -0.23 -0.15 0.00 0.77 0.00 0.00 66.41 66.33 3h0r h THR 213 Cb 1.15 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 3h0r h THR 213 CO 0.49 0.07 -0.44 -0.33 0.37 0.00 0.00 175.52 175.68 3h0r h GLU 214 N 0.00 0.66 -0.24 6.66 5.08 -1.95 -0.99 114.58 123.80 3h0r h GLU 214 Ca -0.00 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.02 3h0r h GLU 214 Cb 0.12 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3h0r h GLU 214 CO 0.01 0.97 0.12 -0.44 -1.00 0.00 0.00 179.01 178.66 3h0r h ASP 215 N 0.53 0.17 -0.37 1.42 3.32 -1.74 -2.05 116.42 117.71 3h0r h ASP 215 Ca 0.04 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 3h0r h ASP 215 Cb 0.97 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 3h0r h ASP 215 CO 0.09 0.13 0.01 0.58 -1.72 0.00 0.00 179.24 178.33 3h0r h VAL 216 N 0.25 1.26 -0.23 -1.35 2.07 -1.32 -2.01 116.25 114.91 3h0r h VAL 216 Ca 0.10 -0.97 -0.06 0.00 0.82 0.00 0.00 66.70 66.58 3h0r h VAL 216 Cb 0.02 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 3h0r h VAL 216 CO -0.07 0.32 -0.14 0.00 0.02 0.00 0.00 177.57 177.71 3h0r h ALA 217 N 0.88 1.35 0.07 1.67 0.00 -1.12 -1.76 119.26 120.34 3h0r h ALA 217 Ca 0.11 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 3h0r h ALA 217 Cb 0.45 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3h0r h ALA 217 CO 0.02 0.44 -0.03 1.25 0.00 0.00 0.00 179.25 180.93 3h0r h LEU 218 N 0.35 -0.08 -0.66 0.00 5.85 -1.21 -1.53 115.31 118.04 3h0r h LEU 218 Ca 0.07 -0.51 0.08 0.00 0.84 0.00 0.00 57.88 58.35 3h0r h LEU 218 Cb 0.46 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.44 3h0r h LEU 218 CO 0.03 0.52 0.32 0.58 -0.34 0.00 0.00 178.44 179.54 3h0r h VAL 219 N -0.72 0.87 -0.67 1.05 2.07 -1.29 -1.63 116.25 115.93 3h0r h VAL 219 Ca -0.01 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 3h0r h VAL 219 Cb 0.59 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 3h0r h VAL 219 CO 0.02 0.10 0.37 0.25 0.02 0.00 0.00 177.57 178.33 3h0r h LEU 220 N 0.57 0.84 -0.37 2.57 5.85 -1.37 -2.75 115.31 120.65 3h0r h LEU 220 Ca 0.31 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.97 3h0r h LEU 220 Cb 0.30 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 3h0r h LEU 220 CO -0.24 0.69 0.16 -0.08 -0.34 0.00 0.00 178.44 178.62 3h0r h GLU 221 N 0.92 0.32 -0.83 1.25 4.81 -0.44 -2.84 114.58 117.76 3h0r h GLU 221 Ca 0.24 -0.02 0.13 0.00 -0.13 0.00 0.00 59.36 59.58 3h0r h GLU 221 Cb 0.04 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.29 3h0r h GLU 221 CO -0.04 0.21 0.54 0.28 -0.73 0.00 0.00 179.01 179.27 3h0r h VAL 222 N 0.33 0.85 -0.40 0.32 2.07 -1.02 -3.26 116.25 115.14 3h0r h VAL 222 Ca 0.16 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3h0r h VAL 222 Cb 0.11 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 3h0r h VAL 222 CO -0.14 0.11 0.00 2.30 0.02 0.00 0.00 177.57 179.86 3h0r n ILE 223 N -4.53 2.04 -4.43 4.57 -5.35 -1.07 -4.85 119.36 105.74 3h0r n ILE 223 Ca 0.16 -1.52 -0.21 0.00 -0.27 0.00 0.00 62.75 60.90 3h0r n ILE 223 Cb 0.45 -0.05 -0.10 0.00 -1.74 0.00 0.00 39.64 38.20 3h0r n ILE 223 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 3h0r s SER 224 N -1.40 2.21 0.56 7.28 0.01 -1.23 -4.52 113.70 116.61 3h0r s SER 224 Ca 0.42 -1.41 0.00 0.00 1.31 0.00 0.00 55.95 56.27 3h0r s SER 224 Cb 0.31 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.57 3h0r s SER 224 CO 0.14 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.73 3h0r n GLY 225 N -0.67 -0.64 3.76 3.44 0.00 0.11 -4.94 105.19 106.26 3h0r n GLY 225 Ca -0.02 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.22 3.38 -0.11 1.61 -0.00 -1.25 -4.64 118.94 117.71 3h0r s TRP 226 Ca 0.00 1.60 0.01 0.00 -0.00 0.00 0.00 56.10 57.71 3h0r s TRP 226 Cb 0.00 -3.41 0.02 0.00 -0.00 0.00 0.00 33.47 30.08 3h0r s TRP 226 CO 0.00 -1.00 -0.14 0.34 -0.00 0.00 0.00 176.95 176.15 3h0r s ASP 227 N -0.79 2.37 0.59 5.86 2.15 -1.26 -5.01 116.67 120.58 3h0r s ASP 227 Ca 0.47 -0.40 0.37 0.00 0.43 0.00 0.00 52.55 53.41 3h0r s ASP 227 Cb -0.34 -1.04 1.77 0.00 -0.30 0.00 0.00 42.92 43.01 3h0r s ASP 227 CO 0.44 -0.01 2.14 1.05 -0.17 0.00 0.00 175.17 178.62 3h0r h GLU 228 N 7.59 0.00 -0.04 4.34 4.11 -1.96 -1.85 114.58 126.76 3h0r h GLU 228 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.11 3h0r h GLU 228 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3h0r h GLU 228 CO 0.48 0.02 0.00 1.63 0.07 0.00 0.00 179.01 181.21 3h0r n LYS 229 N -3.16 1.44 -3.80 1.06 5.02 -1.26 -4.71 118.16 112.76 3h0r n LYS 229 Ca -0.01 -0.65 -0.29 0.00 -2.02 0.00 0.00 58.31 55.34 3h0r n LYS 229 Cb 0.21 -1.44 -0.16 0.00 -0.02 0.00 0.00 35.03 33.62 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 -1.85 3.38 0.47 4.39 -1.08 -0.70 -4.78 116.67 116.50 3h0r s ASP 230 Ca 0.38 -1.06 0.16 0.00 -0.52 0.00 0.00 52.55 51.50 3h0r s ASP 230 Cb 0.19 -0.82 1.10 0.00 -1.46 0.00 0.00 42.92 41.94 3h0r s ASP 230 CO 0.31 -0.30 2.04 0.28 0.52 0.00 0.00 175.17 178.02 3h0r h SER 231 N 8.13 0.00 0.44 -0.34 0.02 -1.84 -2.52 113.55 117.43 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 0.14 -0.44 0.35 -1.14 0.00 0.00 176.83 176.12 3h0r n THR 232 N -4.33 0.00 -2.48 -2.27 -2.24 -1.26 -4.87 114.28 96.84 3h0r n THR 232 Ca -0.03 -0.03 -0.41 0.00 -2.27 0.00 0.00 64.05 61.32 3h0r n THR 232 Cb 0.21 0.28 -0.04 0.00 -2.10 0.00 0.00 70.33 68.68 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 -2.88 7.25 0.16 3.42 1.04 -0.95 -4.41 113.70 117.33 3h0r s SER 233 Ca 0.14 2.20 -0.17 0.00 0.48 0.00 0.00 55.95 58.60 3h0r s SER 233 Cb 0.18 -2.62 -0.07 0.00 0.10 0.00 0.00 66.02 63.61 3h0r s SER 233 CO 0.65 -0.20 0.61 0.00 0.98 0.00 0.00 173.24 175.28 3h0r s ALA 234 N -0.67 3.53 -1.36 5.32 0.00 -0.45 -4.76 121.76 123.37 3h0r s ALA 234 Ca 0.47 -0.01 -0.11 0.00 0.00 0.00 0.00 51.96 52.31 3h0r s ALA 234 Cb -0.31 -2.64 0.11 0.00 0.00 0.00 0.00 23.12 20.29 3h0r s ALA 234 CO 0.38 0.41 2.05 1.63 0.00 0.00 0.00 175.76 180.23 3h0r n LYS 235 N 0.94 3.35 -4.43 0.00 5.02 -1.26 -3.90 118.16 117.88 3h0r n LYS 235 Ca -0.05 -3.14 -0.22 0.00 -2.02 0.00 0.00 58.31 52.88 3h0r n LYS 235 Cb 0.51 -3.06 -0.16 0.00 -0.02 0.00 0.00 35.03 32.31 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 1.46 0.89 0.41 -0.18 1.01 -1.26 -5.07 120.40 117.65 3h0r s VAL 236 Ca 0.43 -0.37 -0.27 0.00 0.00 0.00 0.00 61.98 61.78 3h0r s VAL 236 Cb 0.12 -0.82 -0.10 0.00 0.00 0.00 0.00 36.38 35.58 3h0r s VAL 236 CO -0.04 0.29 1.47 -2.16 0.00 0.00 0.00 175.10 174.66 3h0r s PRO 237 N 0.53 3.94 -0.24 2.72 0.04 -1.26 -4.54 135.00 136.18 3h0r s PRO 237 Ca -0.09 2.52 -0.28 0.00 0.04 0.00 0.00 61.00 63.19 3h0r s PRO 237 Cb -0.13 -2.84 0.01 0.00 0.04 0.00 0.00 34.50 31.57 3h0r s PRO 237 CO 0.02 -0.65 0.99 0.08 0.04 0.00 0.00 177.00 177.47 3h0r s VAL 238 N -1.15 4.71 0.57 -0.36 1.01 -1.26 -5.02 120.40 118.90 3h0r s VAL 238 Ca 0.56 1.89 -0.21 0.00 0.00 0.00 0.00 61.98 64.22 3h0r s VAL 238 Cb -0.46 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.62 3h0r s VAL 238 CO 0.61 -0.17 1.32 -2.84 0.00 0.00 0.00 175.10 174.01 3h0r s PRO 239 N 3.14 3.03 -1.23 2.72 0.02 -1.26 -4.88 135.00 136.54 3h0r s PRO 239 Ca 0.42 2.13 -0.19 0.00 0.02 0.00 0.00 61.00 63.38 3h0r s PRO 239 Cb -0.15 -2.14 -0.01 0.00 0.02 0.00 0.00 34.50 32.22 3h0r s PRO 239 CO 0.07 -1.24 1.91 0.39 -0.33 0.00 0.00 177.00 177.80 3h0r n GLU 240 N -1.24 2.48 -0.05 5.54 4.71 -1.26 -4.77 120.64 126.05 3h0r n GLU 240 Ca 0.12 -2.74 -0.03 0.00 -0.01 0.00 0.00 57.16 54.49 3h0r n GLU 240 Cb 0.46 -3.44 0.20 0.00 -1.01 0.00 0.00 31.44 27.65 3h0r n GLU 240 CO 0.00 0.00 0.00 -1.49 0.09 0.00 0.00 177.13 175.73 3h0r h TRP 241 N 7.89 0.68 -0.01 -0.32 6.55 -1.90 -2.12 115.95 126.72 3h0r h TRP 241 Ca 0.41 -0.10 0.00 0.00 0.95 0.00 0.00 58.89 60.15 3h0r h TRP 241 Cb 0.82 -0.18 -0.00 0.00 -0.86 0.00 0.00 29.16 28.93 3h0r h TRP 241 CO 1.35 0.70 0.01 0.66 -1.05 0.00 0.00 178.44 180.11 3h0r h SER 242 N 0.59 0.00 0.13 -3.49 4.64 -1.86 -0.55 113.55 113.01 3h0r h SER 242 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3h0r h SER 242 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 3h0r h SER 242 CO 0.03 0.00 -0.29 -0.62 -0.87 0.00 0.00 176.83 175.07 3h0r n GLU 243 N -4.52 1.09 -0.04 4.77 -0.58 -0.84 -4.40 120.64 116.12 3h0r n GLU 243 Ca -0.03 -0.75 -0.01 0.00 -0.42 0.00 0.00 57.16 55.95 3h0r n GLU 243 Cb 0.10 -1.48 -0.09 0.00 -0.57 0.00 0.00 31.44 29.39 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 -0.30 1.44 0.05 3.49 4.07 -0.34 -4.54 120.64 124.50 3h0r n GLU 244 Ca 0.12 -0.05 0.02 0.00 -0.06 0.00 0.00 57.16 57.19 3h0r n GLU 244 Cb 0.40 -1.30 0.37 0.00 -0.06 0.00 0.00 31.44 30.84 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 1.16 0.00 6.31 -1.51 -1.43 -2.86 116.25 117.92 3h0r h VAL 245 Ca -0.20 -0.62 -0.06 0.00 -1.23 0.00 0.00 66.70 64.59 3h0r h VAL 245 Cb 1.28 0.93 -0.01 0.00 -2.13 0.00 0.00 31.29 31.36 3h0r h VAL 245 CO 0.01 0.21 -0.29 0.11 -1.23 0.00 0.00 177.57 176.38 3h0r h LYS 246 N 0.41 0.00 -7.31 5.19 1.57 -1.84 -3.40 116.57 111.19 3h0r h LYS 246 Ca 0.09 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.37 3h0r h LYS 246 Cb 0.24 0.00 0.15 0.00 0.08 0.00 0.00 32.23 32.71 3h0r h LYS 246 CO 0.00 0.29 0.26 0.15 -0.57 0.00 0.00 179.45 179.59 3h0r s LYS 247 N -3.28 1.54 -0.07 3.15 1.02 -1.08 -5.06 119.74 115.96 3h0r s LYS 247 Ca 0.03 1.09 0.01 0.00 0.02 0.00 0.00 55.97 57.12 3h0r s LYS 247 Cb 0.08 -1.82 0.02 0.00 -0.52 0.00 0.00 37.83 35.59 3h0r s LYS 247 CO 0.68 -2.12 -0.07 -2.00 -0.92 0.00 0.00 175.35 170.92 3h0r s GLU 248 N -4.85 1.24 -0.19 1.68 2.12 -1.26 -4.93 118.70 112.51 3h0r s GLU 248 Ca 0.63 -0.20 -0.06 0.00 0.36 0.00 0.00 54.97 55.69 3h0r s GLU 248 Cb -0.19 -1.23 -0.04 0.00 0.26 0.00 0.00 34.13 32.94 3h0r s GLU 248 CO 0.57 -0.14 0.04 0.08 -0.54 0.00 0.00 175.26 175.27 3h0r s VAL 249 N 1.22 4.47 0.29 3.70 1.01 -1.26 -5.09 120.40 124.73 3h0r s VAL 249 Ca -0.05 -0.14 -0.21 0.00 0.00 0.00 0.00 61.98 61.57 3h0r s VAL 249 Cb -0.14 -3.01 -0.09 0.00 0.00 0.00 0.00 36.38 33.14 3h0r s VAL 249 CO -0.02 0.45 0.82 -0.54 0.00 0.00 0.00 175.10 175.80 3h0r s LYS 250 N 0.59 4.32 -0.59 2.72 1.02 -1.26 -4.29 119.74 122.25 3h0r s LYS 250 Ca 0.02 1.01 -0.01 0.00 0.02 0.00 0.00 55.97 57.00 3h0r s LYS 250 Cb -0.13 -2.72 0.00 0.00 -0.52 0.00 0.00 37.83 34.46 3h0r s LYS 250 CO 0.02 0.28 0.13 0.41 -0.92 0.00 0.00 175.35 175.27 3h0r n GLY 251 N 0.38 0.17 3.79 -3.33 0.00 -1.26 -5.02 105.19 99.92 3h0r n GLY 251 Ca 0.01 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.48 3.36 -0.02 0.99 1.43 -1.26 -4.88 118.68 115.81 3h0r s LEU 252 Ca 0.06 1.82 0.05 0.00 -1.03 0.00 0.00 54.13 55.04 3h0r s LEU 252 Cb -0.03 -4.53 -0.01 0.00 0.03 0.00 0.00 46.19 41.65 3h0r s LEU 252 CO 0.08 -1.42 -0.18 -0.54 0.23 0.00 0.00 176.35 174.52 3h0r s LYS 253 N -4.35 1.49 -0.12 1.70 1.02 -1.26 -2.36 119.74 115.86 3h0r s LYS 253 Ca 0.63 -0.64 0.03 0.00 0.02 0.00 0.00 55.97 56.02 3h0r s LYS 253 Cb -0.17 -1.42 0.00 0.00 -0.52 0.00 0.00 37.83 35.72 3h0r s LYS 253 CO 0.43 0.37 -0.22 0.42 -0.92 0.00 0.00 175.35 175.43 3h0r s ILE 254 N -0.36 2.13 -0.12 2.17 1.01 0.20 -1.47 121.20 124.76 3h0r s ILE 254 Ca 0.06 -0.98 -0.12 0.00 0.00 0.00 0.00 60.65 59.61 3h0r s ILE 254 Cb -0.07 -1.83 -0.05 0.00 0.01 0.00 0.00 42.46 40.51 3h0r s ILE 254 CO -0.00 0.55 0.26 -0.83 0.00 0.00 0.00 174.94 174.92 3h0r s GLY 255 N 0.55 2.23 -0.31 6.18 0.00 -0.18 -0.77 107.32 115.02 3h0r s GLY 255 Ca -0.13 -0.48 -0.02 0.00 0.00 0.00 0.00 44.72 44.08 3h0r s GLY 255 CO 0.04 0.11 0.02 1.08 0.00 0.00 0.00 173.10 174.35 3h0r s LEU 256 N -0.29 3.99 0.01 0.66 1.43 0.63 -1.74 118.68 123.38 3h0r s LEU 256 Ca 0.17 -1.29 -0.30 0.00 -1.03 0.00 0.00 54.13 51.68 3h0r s LEU 256 Cb -0.13 -1.73 -0.07 0.00 0.03 0.00 0.00 46.19 44.29 3h0r s LEU 256 CO 0.05 -0.28 1.64 -2.84 0.23 0.00 0.00 176.35 175.15 3h0r s PRO 257 N 1.26 4.20 0.41 1.29 0.02 -1.26 -1.65 135.00 139.27 3h0r s PRO 257 Ca -0.04 2.25 0.14 0.00 0.02 0.00 0.00 61.00 63.36 3h0r s PRO 257 Cb -0.20 -3.77 0.98 0.00 0.02 0.00 0.00 34.50 31.54 3h0r s PRO 257 CO -0.01 -0.77 1.92 0.87 -0.33 0.00 0.00 177.00 178.68 3h0r h LYS 258 N 8.83 0.48 0.00 5.54 1.57 -0.70 -1.34 116.57 130.96 3h0r h LYS 258 Ca -0.41 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.30 3h0r h LYS 258 Cb 1.19 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 3h0r h LYS 258 CO 0.94 0.32 -0.21 0.93 -0.57 0.00 0.00 179.45 180.86 3h0r h GLU 259 N 0.49 0.00 0.00 3.15 3.07 -1.88 -2.58 114.58 116.83 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 0.75 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.66 3h0r h GLU 259 CO -0.13 0.21 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 -1.62 -2.90 116.94 116.79 3h0r h PHE 260 Ca -0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 3h0r h PHE 260 Cb 0.53 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.68 3h0r h PHE 260 CO 0.00 0.00 -0.11 0.74 -0.60 0.00 0.00 178.31 178.34 3h0r h PHE 261 N 0.00 0.00 0.00 -0.55 0.04 -1.55 -1.98 116.94 112.90 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 0.60 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.75 3h0r h PHE 261 CO 0.00 0.11 0.00 0.39 -0.60 0.00 0.00 178.31 178.21 3h0r n GLU 262 N -3.26 0.27 -2.84 1.51 -0.58 -1.10 -4.83 120.64 109.81 3h0r n GLU 262 Ca 0.00 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.33 3h0r n GLU 262 Cb 0.35 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.69 3h0r n GLU 262 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 3h0r s TYR 263 N -2.73 3.61 -0.29 -0.32 1.51 -0.75 -4.98 117.35 113.41 3h0r s TYR 263 Ca 0.23 1.51 -0.28 0.00 -1.01 0.00 0.00 57.07 57.52 3h0r s TYR 263 Cb 0.20 -3.00 -0.06 0.00 -0.11 0.00 0.00 41.96 38.99 3h0r s TYR 263 CO 0.49 0.01 2.27 0.39 -1.11 0.00 0.00 175.55 177.59 3h0r n GLU 264 N 3.97 1.72 -4.37 -0.62 1.02 -1.26 -4.99 120.64 116.11 3h0r n GLU 264 Ca 0.03 0.41 -0.32 0.00 -0.02 0.00 0.00 57.16 57.26 3h0r n GLU 264 Cb 0.51 -3.25 -0.10 0.00 -0.02 0.00 0.00 31.44 28.58 3h0r n GLU 264 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3h0r s LEU 265 N 9.15 3.30 0.30 -4.62 1.43 -1.26 -4.84 118.68 122.14 3h0r s LEU 265 Ca 1.01 -0.11 -0.29 0.00 -1.03 0.00 0.00 54.13 53.71 3h0r s LEU 265 Cb -0.33 -1.90 -0.10 0.00 0.03 0.00 0.00 46.19 43.89 3h0r s LEU 265 CO 0.34 0.27 1.44 -1.10 0.23 0.00 0.00 176.35 177.53 3h0r s GLN 266 N -1.54 4.24 0.31 1.70 -0.21 -0.08 -4.87 119.66 119.21 3h0r s GLN 266 Ca 0.18 2.37 0.04 0.00 0.02 0.00 0.00 55.36 57.98 3h0r s GLN 266 Cb -0.11 -3.06 0.67 0.00 1.00 0.00 0.00 33.01 31.51 3h0r s GLN 266 CO 0.09 -0.42 1.84 -1.35 -2.12 0.00 0.00 175.29 173.33 3h0r h PRO 267 N 4.20 0.84 -0.83 2.91 0.11 -1.99 -0.26 132.00 136.98 3h0r h PRO 267 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3h0r h PRO 267 Cb 1.22 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 3h0r h PRO 267 CO 0.72 0.56 0.52 1.96 -0.21 0.00 0.00 178.00 181.55 3h0r h GLN 268 N 0.86 1.12 -0.03 1.05 7.50 -1.98 -0.31 115.11 123.31 3h0r h GLN 268 Ca 0.50 -0.09 -0.00 0.00 0.50 0.00 0.00 58.65 59.55 3h0r h GLN 268 Cb 0.63 -0.24 -0.00 0.00 0.05 0.00 0.00 27.48 27.92 3h0r h GLN 268 CO -0.26 0.77 0.00 0.28 -1.50 0.00 0.00 178.83 178.12 3h0r h VAL 269 N 1.13 1.23 -0.28 -0.54 2.07 -1.44 -0.75 116.25 117.66 3h0r h VAL 269 Ca 0.30 -0.68 0.04 0.00 0.82 0.00 0.00 66.70 67.18 3h0r h VAL 269 Cb -0.08 1.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 3h0r h VAL 269 CO -0.06 0.18 0.05 0.50 0.02 0.00 0.00 177.57 178.26 3h0r h LYS 270 N -0.21 0.14 -0.18 1.57 3.64 -1.03 0.35 116.57 120.85 3h0r h LYS 270 Ca 0.01 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.43 3h0r h LYS 270 Cb 0.29 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.02 3h0r h LYS 270 CO 0.00 0.10 -0.17 1.49 -2.27 0.00 0.00 179.45 178.60 3h0r h GLU 271 N 0.15 -0.18 -0.86 1.90 4.81 -0.97 0.03 114.58 119.46 3h0r h GLU 271 Ca 0.13 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.40 3h0r h GLU 271 Cb 0.14 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.52 3h0r h GLU 271 CO -0.18 -0.12 0.56 0.00 -0.73 0.00 0.00 179.01 178.54 3h0r h ALA 272 N 0.91 1.13 -0.24 2.92 0.00 -0.74 -2.21 119.26 121.03 3h0r h ALA 272 Ca 0.12 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 3h0r h ALA 272 Cb 0.36 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3h0r h ALA 272 CO -0.29 0.41 -0.27 0.35 0.00 0.00 0.00 179.25 179.45 3h0r h PHE 273 N 1.09 0.74 -0.90 0.00 3.57 -0.29 -1.69 116.94 119.45 3h0r h PHE 273 Ca 0.34 -0.23 0.02 0.00 3.53 0.00 0.00 57.97 61.63 3h0r h PHE 273 Cb -0.02 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.52 3h0r h PHE 273 CO -0.02 0.95 0.59 0.93 -2.23 0.00 0.00 178.31 178.53 3h0r h GLU 274 N 0.31 1.15 -0.53 1.11 5.08 -0.88 -1.67 114.58 119.16 3h0r h GLU 274 Ca 0.03 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 3h0r h GLU 274 Cb 0.84 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 3h0r h GLU 274 CO 0.07 0.76 0.16 -0.97 -1.00 0.00 0.00 179.01 178.03 3h0r h ASN 275 N 1.18 0.78 -0.59 1.42 -0.73 -1.28 -0.32 115.58 116.04 3h0r h ASN 275 Ca 0.34 -0.21 0.10 0.00 1.87 0.00 0.00 56.30 58.40 3h0r h ASN 275 Cb -0.08 -0.20 -0.07 0.00 0.27 0.00 0.00 38.32 38.23 3h0r h ASN 275 CO -0.09 0.78 0.19 0.15 -0.37 0.00 0.00 177.43 178.10 3h0r h PHE 276 N 0.74 0.33 -0.16 0.67 3.57 -0.71 -0.49 116.94 120.89 3h0r h PHE 276 Ca 0.17 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.57 3h0r h PHE 276 Cb 0.29 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.97 3h0r h PHE 276 CO 0.02 0.06 -0.42 0.82 -2.23 0.00 0.00 178.31 176.56 3h0r h ILE 277 N 0.36 1.34 -0.81 1.41 1.08 -1.08 -1.63 117.51 118.18 3h0r h ILE 277 Ca 0.30 -1.68 0.01 0.00 -0.39 0.00 0.00 64.86 63.10 3h0r h ILE 277 Cb 0.39 1.99 -0.04 0.00 -3.07 0.00 0.00 36.82 36.09 3h0r h ILE 277 CO -0.32 0.51 0.54 0.11 -0.69 0.00 0.00 178.15 178.30 3h0r h LYS 278 N 0.21 1.07 -0.74 2.37 1.57 -0.86 0.21 116.57 120.40 3h0r h LYS 278 Ca -0.01 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 3h0r h LYS 278 Cb 1.03 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 33.07 3h0r h LYS 278 CO 0.09 0.71 0.28 1.49 -0.57 0.00 0.00 179.45 181.45 3h0r h GLU 279 N 1.10 1.12 -0.23 3.15 4.57 -1.05 -1.29 114.58 121.95 3h0r h GLU 279 Ca 0.30 -0.21 -0.04 0.00 -1.18 0.00 0.00 59.36 58.22 3h0r h GLU 279 Cb -0.13 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.28 3h0r h GLU 279 CO -0.06 0.93 -0.01 -0.07 -1.18 0.00 0.00 179.01 178.61 3h0r h LEU 280 N 1.08 0.42 -0.61 1.64 3.38 -0.88 -2.92 115.31 117.42 3h0r h LEU 280 Ca 0.25 -0.33 0.12 0.00 0.09 0.00 0.00 57.88 58.01 3h0r h LEU 280 Cb 0.24 -0.11 -0.10 0.00 0.09 0.00 0.00 40.66 40.78 3h0r h LEU 280 CO -0.02 0.64 0.05 -0.08 0.09 0.00 0.00 178.44 179.13 3h0r h GLU 281 N 0.18 0.16 -0.29 1.13 4.81 -0.26 -1.17 114.58 119.14 3h0r h GLU 281 Ca 0.06 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.34 3h0r h GLU 281 Cb 0.44 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 3h0r h GLU 281 CO 0.01 0.11 0.20 0.87 -0.73 0.00 0.00 179.01 179.48 3h0r h LYS 282 N 0.17 0.15 -0.00 1.92 1.57 -1.11 0.06 116.57 119.33 3h0r h LYS 282 Ca 0.32 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 3h0r h LYS 282 Cb 0.51 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.79 3h0r h LYS 282 CO -0.48 0.10 -0.05 0.39 -0.57 0.00 0.00 179.45 178.84 3h0r n GLU 283 N -4.48 0.80 0.00 3.15 -0.58 -0.46 -4.91 120.64 114.16 3h0r n GLU 283 Ca 0.03 -0.19 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 3h0r n GLU 283 Cb 0.26 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 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 1.20 1.02 3.73 0.62 0.00 0.01 -5.08 105.19 106.68 3h0r n GLY 284 Ca 0.17 0.00 -0.41 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 3.46 -0.03 1.61 0.40 -1.09 -4.65 117.98 115.68 3h0r s PHE 285 Ca 0.00 1.40 -0.26 0.00 -0.60 0.00 0.00 56.93 57.48 3h0r s PHE 285 Cb 0.00 -3.40 -0.04 0.00 0.51 0.00 0.00 43.02 40.10 3h0r s PHE 285 CO 0.00 -1.13 0.80 -2.00 0.70 0.00 0.00 175.22 173.59 3h0r s GLU 286 N 0.29 4.49 -0.20 0.44 2.12 -0.99 -4.27 118.70 120.57 3h0r s GLU 286 Ca 0.55 1.08 -0.04 0.00 0.36 0.00 0.00 54.97 56.91 3h0r s GLU 286 Cb -0.31 -3.44 -0.02 0.00 0.26 0.00 0.00 34.13 30.63 3h0r s GLU 286 CO 0.33 0.06 -0.03 0.42 -0.54 0.00 0.00 175.26 175.50 3h0r s ILE 287 N 0.74 3.67 -0.00 -3.70 -1.09 -1.26 -0.63 121.20 118.93 3h0r s ILE 287 Ca 0.42 -0.41 0.04 0.00 -2.23 0.00 0.00 60.65 58.47 3h0r s ILE 287 Cb -0.19 -2.65 -0.01 0.00 -1.58 0.00 0.00 42.46 38.03 3h0r s ILE 287 CO 0.22 0.44 -0.13 -0.54 -1.23 0.00 0.00 174.94 173.70 3h0r s LYS 288 N 1.02 1.02 0.01 2.79 1.02 0.05 -4.97 119.74 120.68 3h0r s LYS 288 Ca 0.01 -0.50 -0.30 0.00 0.02 0.00 0.00 55.97 55.19 3h0r s LYS 288 Cb -0.15 -0.99 -0.04 0.00 -0.52 0.00 0.00 37.83 36.14 3h0r s LYS 288 CO 0.01 0.27 1.08 -1.21 -0.92 0.00 0.00 175.35 174.58 3h0r s GLU 289 N -0.43 4.48 0.35 1.68 2.02 -1.26 -0.27 118.70 125.27 3h0r s GLU 289 Ca 0.04 1.57 0.09 0.00 0.02 0.00 0.00 54.97 56.69 3h0r s GLU 289 Cb -0.05 -3.43 -0.06 0.00 0.10 0.00 0.00 34.13 30.68 3h0r s GLU 289 CO -0.00 -0.18 0.01 0.14 0.02 0.00 0.00 175.26 175.24 3h0r s VAL 290 N 1.22 2.51 -0.10 2.63 -7.23 -0.66 -4.81 120.40 113.96 3h0r s VAL 290 Ca 0.54 -1.99 -0.02 0.00 -1.81 0.00 0.00 61.98 58.71 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 0.27 -0.18 -0.02 -0.44 -0.31 0.00 0.00 175.10 174.43 3h0r s SER 291 N -3.71 5.06 -0.44 4.85 0.01 -1.26 0.11 113.70 118.32 3h0r s SER 291 Ca 0.35 0.06 0.04 0.00 1.31 0.00 0.00 55.95 57.70 3h0r s SER 291 Cb 0.01 -1.50 0.17 0.00 0.21 0.00 0.00 66.02 64.90 3h0r s SER 291 CO 0.19 0.32 0.34 -0.76 0.41 0.00 0.00 173.24 173.75 3h0r s LEU 292 N -0.56 1.80 0.38 2.44 1.43 -1.26 -4.71 118.68 118.21 3h0r s LEU 292 Ca 0.09 -3.07 0.27 0.00 -1.03 0.00 0.00 54.13 50.39 3h0r s LEU 292 Cb -0.12 -0.59 1.36 0.00 0.03 0.00 0.00 46.19 46.87 3h0r s LEU 292 CO 0.02 -0.18 1.81 1.55 0.23 0.00 0.00 176.35 179.78 3h0r h PRO 293 N 5.76 0.00 -0.00 1.29 0.13 -1.96 -2.44 132.00 134.77 3h0r h PRO 293 Ca 0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.36 3h0r h PRO 293 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 3h0r h PRO 293 CO 0.41 0.00 -0.72 0.72 -0.23 0.00 0.00 178.00 178.18 3h0r n HIS 294 N -2.44 0.00 -0.03 1.56 8.25 -1.26 -4.67 115.22 116.64 3h0r n HIS 294 Ca -0.01 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.58 3h0r n HIS 294 Cb 0.09 0.00 0.54 0.00 1.12 0.00 0.00 29.99 31.75 3h0r n HIS 294 CO 0.00 0.00 0.00 -0.39 0.64 0.00 0.00 176.34 176.59 3h0r h VAL 295 N 0.19 0.89 0.00 1.59 -1.51 -1.81 0.30 116.25 115.90 3h0r h VAL 295 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.37 3h0r h VAL 295 Cb 0.40 0.56 0.00 0.00 -2.13 0.00 0.00 31.29 30.12 3h0r h VAL 295 CO 0.00 0.06 0.00 0.07 -1.23 0.00 0.00 177.57 176.47 3h0r h LYS 296 N 0.30 0.00 -0.01 5.19 2.10 -1.83 0.32 116.57 122.64 3h0r h LYS 296 Ca 0.23 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 3h0r h LYS 296 Cb 0.52 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.85 3h0r h LYS 296 CO -0.05 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.06 3h0r n TYR 297 N -2.65 0.00 -0.10 0.07 4.01 0.09 -4.32 117.16 114.28 3h0r n TYR 297 Ca -0.02 -0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.66 3h0r n TYR 297 Cb 0.09 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.13 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 1.50 -0.03 0.21 7.72 0.02 -0.48 -2.08 113.55 120.41 3h0r h SER 298 Ca 0.00 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 3h0r h SER 298 Cb 0.32 0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.95 3h0r h SER 298 CO 0.00 0.02 -0.10 0.40 -1.14 0.00 0.00 176.83 176.01 3h0r h ILE 299 N 0.16 0.84 -0.17 3.27 1.08 -1.79 0.57 117.51 121.47 3h0r h ILE 299 Ca 0.16 -0.26 -0.06 0.00 -0.39 0.00 0.00 64.86 64.31 3h0r h ILE 299 Cb 0.19 1.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 3h0r h ILE 299 CO -0.23 0.06 -0.17 1.55 -0.69 0.00 0.00 178.15 178.67 3h0r h PRO 300 N -0.41 0.28 0.30 2.37 0.13 -1.84 -0.71 132.00 132.12 3h0r h PRO 300 Ca -0.03 -0.08 -0.01 0.00 -0.87 0.00 0.00 66.00 65.01 3h0r h PRO 300 Cb 0.31 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.41 3h0r h PRO 300 CO 0.05 0.46 -0.14 1.15 -0.23 0.00 0.00 178.00 179.28 3h0r h THR 301 N 0.26 0.71 -0.98 1.56 2.02 -1.26 -2.78 112.91 112.44 3h0r h THR 301 Ca 0.05 -0.02 0.01 0.00 0.77 0.00 0.00 66.41 67.22 3h0r h THR 301 Cb 0.46 0.72 -0.05 0.00 -1.74 0.00 0.00 68.15 67.55 3h0r h THR 301 CO 0.03 0.00 0.64 0.22 0.37 0.00 0.00 175.52 176.78 3h0r h TYR 302 N -0.41 1.24 -0.23 3.16 3.20 -0.59 -1.05 116.97 122.29 3h0r h TYR 302 Ca -0.04 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 3h0r h TYR 302 Cb 0.31 -0.42 0.00 0.00 1.54 0.00 0.00 36.73 38.16 3h0r h TYR 302 CO -0.05 0.79 0.00 0.66 -1.64 0.00 0.00 178.16 177.91 3h0r n TYR 303 N -4.39 0.52 -0.07 -3.82 4.01 -0.30 -0.65 117.16 112.46 3h0r n TYR 303 Ca 0.11 -0.21 -0.16 0.00 -0.16 0.00 0.00 57.90 57.49 3h0r n TYR 303 Cb 0.02 -0.12 -0.05 0.00 -0.31 0.00 0.00 39.34 38.88 3h0r n TYR 303 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 3h0r n ILE 304 N 0.24 0.82 0.13 -0.72 5.41 -0.85 -4.62 119.36 119.76 3h0r n ILE 304 Ca 0.09 -0.21 -0.14 0.00 1.00 0.00 0.00 62.75 63.49 3h0r n ILE 304 Cb 0.39 -1.66 -0.08 0.00 -0.71 0.00 0.00 39.64 37.57 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 -0.51 0.82 0.56 1.39 2.04 -1.06 -2.58 117.51 118.18 3h0r h ILE 305 Ca -0.38 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 3h0r h ILE 305 Cb 1.34 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.33 3h0r h ILE 305 CO -0.22 0.04 -0.38 0.00 0.00 0.00 0.00 178.15 177.59 3h0r h ALA 306 N 0.42 -0.92 -0.77 1.87 0.00 -1.14 -1.57 119.26 117.14 3h0r h ALA 306 Ca -0.03 -0.18 0.13 0.00 0.00 0.00 0.00 54.91 54.83 3h0r h ALA 306 Cb 0.28 0.48 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 3h0r h ALA 306 CO 0.05 -1.04 0.51 -1.35 0.00 0.00 0.00 179.25 177.42 3h0r h PRO 307 N -0.90 0.53 0.67 0.00 0.11 -1.76 0.41 132.00 131.06 3h0r h PRO 307 Ca -0.07 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.98 3h0r h PRO 307 Cb 0.74 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.74 3h0r h PRO 307 CO 0.05 0.35 -0.32 0.77 -0.21 0.00 0.00 178.00 178.64 3h0r h SER 308 N 0.55 -0.76 -0.44 -2.05 0.02 -1.01 -0.57 113.55 109.28 3h0r h SER 308 Ca 0.37 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.32 3h0r h SER 308 Cb 0.68 0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.39 3h0r h SER 308 CO -0.14 -0.43 0.29 -0.33 -1.14 0.00 0.00 176.83 175.08 3h0r h GLU 309 N -1.08 0.55 -0.45 3.45 5.08 -1.15 -2.09 114.58 118.89 3h0r h GLU 309 Ca -0.09 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.13 3h0r h GLU 309 Cb 0.72 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3h0r h GLU 309 CO 0.15 0.36 -0.14 0.00 -1.00 0.00 0.00 179.01 178.38 3h0r h ALA 310 N 1.73 0.89 -0.38 3.43 0.00 -0.76 0.48 119.26 124.66 3h0r h ALA 310 Ca 0.17 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3h0r h ALA 310 Cb -0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3h0r h ALA 310 CO -0.04 0.63 0.05 0.66 0.00 0.00 0.00 179.25 180.55 3h0r h SER 311 N 0.76 0.53 -0.05 0.00 4.64 -0.40 -1.09 113.55 117.94 3h0r h SER 311 Ca 0.12 -0.09 -0.05 0.00 -0.47 0.00 0.00 61.79 61.30 3h0r h SER 311 Cb 0.66 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3h0r h SER 311 CO 0.05 0.57 -0.15 -1.28 -0.87 0.00 0.00 176.83 175.15 3h0r h SER 312 N 0.56 0.22 0.86 4.97 0.87 -1.21 -2.97 113.55 116.84 3h0r h SER 312 Ca 0.12 -0.61 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 3h0r h SER 312 Cb 0.29 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 3h0r h SER 312 CO 0.00 0.79 0.00 0.78 -0.53 0.00 0.00 176.83 177.88 3h0r h ASN 313 N -0.34 0.00 0.01 6.23 2.35 -0.70 -2.90 115.58 120.23 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 0.77 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.14 3h0r h ASN 313 CO 0.03 0.00 -0.27 0.18 -1.65 0.00 0.00 177.43 175.72 3h0r n LEU 314 N -2.47 2.18 0.29 1.61 4.32 -0.43 -4.27 117.00 118.23 3h0r n LEU 314 Ca 0.02 -0.76 0.18 0.00 -0.02 0.00 0.00 56.01 55.43 3h0r n LEU 314 Cb 0.26 -0.01 0.97 0.00 -1.62 0.00 0.00 43.42 43.02 3h0r n LEU 314 CO 0.22 0.39 1.15 0.00 -1.22 0.00 0.00 177.39 177.93 3h0r h ALA 315 N 4.15 1.44 0.00 -1.18 0.00 -1.34 -2.76 119.26 119.57 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 0.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3h0r h ALA 315 CO 0.00 -0.10 0.00 2.89 0.00 0.00 0.00 179.25 182.04 3h0r n ARG 316 N -3.55 0.20 -2.85 0.00 1.85 -1.26 -4.58 116.66 106.47 3h0r n ARG 316 Ca -0.02 0.19 -0.43 0.00 -1.00 0.00 0.00 57.85 56.59 3h0r n ARG 316 Cb 0.16 -1.74 -0.04 0.00 -1.05 0.00 0.00 32.46 29.80 3h0r n ARG 316 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 3h0r s TYR 317 N -3.09 2.69 0.00 2.89 2.02 -1.04 -4.73 117.35 116.08 3h0r s TYR 317 Ca 0.11 -0.59 0.00 0.00 -0.37 0.00 0.00 57.07 56.21 3h0r s TYR 317 Cb 0.13 -4.31 0.00 0.00 -0.40 0.00 0.00 41.96 37.39 3h0r s TYR 317 CO 0.56 -1.66 0.03 -0.40 -1.57 0.00 0.00 175.55 172.51 3h0r n ASP 318 N 7.70 0.00 0.00 2.29 5.68 -1.26 -4.78 116.55 126.18 3h0r n ASP 318 Ca -0.02 -1.00 0.00 0.00 -0.50 0.00 0.00 54.79 53.27 3h0r n ASP 318 Cb 0.46 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 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 0.09 6.12 0.00 -1.25 -4.57 105.19 106.03 3h0r n GLY 319 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.78 1.48 0.12 1.61 0.31 -1.26 -4.78 118.33 113.04 3h0r n VAL 320 Ca 0.00 0.06 0.08 0.00 -0.01 0.00 0.00 64.34 64.47 3h0r n VAL 320 Cb 0.08 -2.19 -0.11 0.00 -0.91 0.00 0.00 33.84 30.70 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 -4.50 0.75 -3.73 5.55 1.74 -1.26 -5.04 116.66 110.16 3h0r n ARG 321 Ca -0.22 -0.12 -0.02 0.00 -0.77 0.00 0.00 57.85 56.72 3h0r n ARG 321 Cb 0.51 -1.34 -0.01 0.00 -1.02 0.00 0.00 32.46 30.60 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 -5.17 117.35 107.44 3h0r s TYR 322 Ca -0.04 -0.16 0.00 0.00 -1.41 0.00 0.00 57.07 55.46 3h0r s TYR 322 Cb 0.10 0.62 0.00 0.00 -1.10 0.00 0.00 41.96 41.58 3h0r s TYR 322 CO 0.64 -0.72 0.00 0.41 -2.51 0.00 0.00 175.55 173.38 3h0r n GLY 323 N -0.48 -0.15 3.77 5.49 0.00 -1.26 -4.31 105.19 108.24 3h0r n GLY 323 Ca -0.06 -1.04 -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 2.75 -0.02 1.61 5.04 -0.33 -4.91 117.35 121.49 3h0r s TYR 324 Ca 0.00 1.51 0.00 0.00 -2.44 0.00 0.00 57.07 56.14 3h0r s TYR 324 Cb 0.00 -3.44 0.03 0.00 0.35 0.00 0.00 41.96 38.90 3h0r s TYR 324 CO 0.00 -1.76 0.02 0.50 -1.34 0.00 0.00 175.55 172.98 3h0r s ARG 325 N -2.80 0.03 0.65 4.97 3.52 -1.26 -3.88 118.95 120.17 3h0r s ARG 325 Ca 0.66 0.17 -0.17 0.00 -0.13 0.00 0.00 55.73 56.26 3h0r s ARG 325 Cb -0.30 -0.31 -0.04 0.00 -1.56 0.00 0.00 34.95 32.74 3h0r s ARG 325 CO 0.36 -0.17 0.87 0.00 -0.81 0.00 0.00 175.30 175.55 3h0r n ALA 326 N 4.22 -0.25 0.08 6.12 0.00 -1.26 -4.94 120.51 124.47 3h0r n ALA 326 Ca -0.27 -0.08 -0.17 0.00 0.00 0.00 0.00 53.44 52.93 3h0r n ALA 326 Cb 0.50 -2.05 -0.14 0.00 0.00 0.00 0.00 19.45 17.76 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 0.15 0.26 -5.09 0.00 1.57 -1.97 -3.45 116.57 108.03 3h0r h LYS 327 Ca -0.48 -0.45 -0.66 0.00 -1.87 0.00 0.00 60.65 57.20 3h0r h LYS 327 Cb 1.36 0.17 -0.28 0.00 0.08 0.00 0.00 32.23 33.56 3h0r h LYS 327 CO 0.48 1.15 -0.74 -1.21 -0.57 0.00 0.00 179.45 178.56 3h0r s GLU 328 N -2.63 3.36 -0.25 3.15 2.02 -1.26 -5.09 118.70 118.00 3h0r s GLU 328 Ca -0.08 -0.65 -0.24 0.00 0.02 0.00 0.00 54.97 54.02 3h0r s GLU 328 Cb 0.07 -2.88 0.07 0.00 0.10 0.00 0.00 34.13 31.48 3h0r s GLU 328 CO 0.86 -0.09 0.69 1.52 0.02 0.00 0.00 175.26 178.27 3h0r s TYR 329 N 1.16 -0.75 -0.28 1.61 1.13 -1.26 -4.84 117.35 114.11 3h0r s TYR 329 Ca 0.02 1.82 0.22 0.00 -1.41 0.00 0.00 57.07 57.72 3h0r s TYR 329 Cb -0.14 0.26 -0.10 0.00 -1.10 0.00 0.00 41.96 40.87 3h0r s TYR 329 CO -0.02 -0.37 0.85 1.63 -2.51 0.00 0.00 175.55 175.13 3h0r n LYS 330 N 2.66 0.53 -3.82 -3.49 5.02 -1.26 -4.94 118.16 112.85 3h0r n LYS 330 Ca -0.14 -0.02 -0.06 0.00 -2.02 0.00 0.00 58.31 56.07 3h0r n LYS 330 Cb 0.55 -1.66 -0.00 0.00 -0.02 0.00 0.00 35.03 33.90 3h0r n LYS 330 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 3h0r s ASP 331 N -4.66 -0.14 0.38 4.39 1.47 -1.26 -5.03 116.67 111.81 3h0r s ASP 331 Ca -0.02 -0.70 0.08 0.00 1.18 0.00 0.00 52.55 53.09 3h0r s ASP 331 Cb 0.12 0.68 0.76 0.00 -0.34 0.00 0.00 42.92 44.14 3h0r s ASP 331 CO 0.83 -1.29 1.93 -0.29 0.68 0.00 0.00 175.17 177.04 3h0r h ILE 332 N 2.00 1.17 -0.02 2.11 6.09 -1.99 0.58 117.51 127.45 3h0r h ILE 332 Ca -0.24 -0.67 0.01 0.00 -1.37 0.00 0.00 64.86 62.58 3h0r h ILE 332 Cb 1.24 1.04 -0.01 0.00 0.47 0.00 0.00 36.82 39.56 3h0r h ILE 332 CO 0.29 0.22 -0.02 0.15 -3.07 0.00 0.00 178.15 175.73 3h0r h PHE 333 N 0.34 -0.04 -0.69 2.19 3.57 -1.99 -0.65 116.94 119.68 3h0r h PHE 333 Ca 0.07 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.52 3h0r h PHE 333 Cb 0.29 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 3h0r h PHE 333 CO 0.01 -0.02 0.21 0.93 -2.23 0.00 0.00 178.31 177.21 3h0r h GLU 334 N -0.02 1.05 -0.03 1.11 5.08 -1.59 0.36 114.58 120.55 3h0r h GLU 334 Ca 0.01 -0.21 0.03 0.00 -1.00 0.00 0.00 59.36 58.18 3h0r h GLU 334 Cb 0.04 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 3h0r h GLU 334 CO -0.03 0.90 -0.13 1.98 -1.00 0.00 0.00 179.01 180.73 3h0r h MET 335 N 1.01 -0.20 0.64 2.33 4.05 -0.65 0.52 114.93 122.64 3h0r h MET 335 Ca 0.22 0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.63 3h0r h MET 335 Cb 0.29 0.05 -0.00 0.00 -0.80 0.00 0.00 31.60 31.13 3h0r h MET 335 CO -0.01 -0.13 -0.41 1.88 0.23 0.00 0.00 176.91 178.47 3h0r h TYR 336 N -0.21 -1.10 -0.10 1.39 0.05 -0.84 -1.40 116.97 114.76 3h0r h TYR 336 Ca 0.06 -0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.79 3h0r h TYR 336 Cb 0.28 0.40 -0.01 0.00 1.01 0.00 0.00 36.73 38.41 3h0r h TYR 336 CO -0.20 -0.61 -0.09 0.00 -1.05 0.00 0.00 178.16 176.21 3h0r h ALA 337 N -1.28 1.66 0.18 3.88 0.00 -0.81 -2.27 119.26 120.61 3h0r h ALA 337 Ca -0.09 -0.15 -0.25 0.00 0.00 0.00 0.00 54.91 54.42 3h0r h ALA 337 Cb 0.80 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.55 3h0r h ALA 337 CO 0.08 0.25 -1.14 0.00 0.00 0.00 0.00 179.25 178.44 3h0r h ARG 338 N 0.15 0.37 -0.55 0.00 3.08 -0.94 -2.23 114.38 114.26 3h0r h ARG 338 Ca 0.03 -0.64 0.11 0.00 0.07 0.00 0.00 59.98 59.55 3h0r h ARG 338 Cb 0.26 0.24 -0.08 0.00 0.08 0.00 0.00 29.97 30.47 3h0r h ARG 338 CO 0.01 1.31 0.07 1.15 -1.07 0.00 0.00 179.97 181.44 3h0r h THR 339 N -0.18 0.63 -0.07 2.04 2.02 -0.99 -1.02 112.91 115.34 3h0r h THR 339 Ca -0.21 -0.07 -0.09 0.00 0.77 0.00 0.00 66.41 66.81 3h0r h THR 339 Cb 1.85 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.67 3h0r h THR 339 CO 0.18 0.04 -0.32 0.03 0.37 0.00 0.00 175.52 175.81 3h0r h ARG 340 N 0.20 0.34 -1.01 6.66 3.08 -1.51 0.13 114.38 122.26 3h0r h ARG 340 Ca 0.29 -0.27 0.02 0.00 0.07 0.00 0.00 59.98 60.08 3h0r h ARG 340 Cb 0.43 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.48 3h0r h ARG 340 CO -0.41 0.92 0.67 0.22 -1.07 0.00 0.00 179.97 180.30 3h0r h ASP 341 N -0.16 1.14 0.45 7.04 3.58 -1.30 -0.58 116.42 126.59 3h0r h ASP 341 Ca -0.02 -0.02 -0.24 0.00 0.42 0.00 0.00 57.03 57.17 3h0r h ASP 341 Cb 0.98 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.75 3h0r h ASP 341 CO 0.07 0.81 -1.03 -0.33 -2.88 0.00 0.00 179.24 175.88 3h0r h GLU 342 N 1.34 0.34 0.00 0.28 5.08 -1.18 -3.35 114.58 117.08 3h0r h GLU 342 Ca 0.38 -0.43 -0.16 0.00 -1.00 0.00 0.00 59.36 58.15 3h0r h GLU 342 Cb -0.10 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3h0r h GLU 342 CO -0.10 1.13 -1.27 0.78 -1.00 0.00 0.00 179.01 178.55 3h0r h GLY 343 N 1.40 0.00 -5.10 -3.84 0.00 -0.48 -3.46 103.07 91.59 3h0r h GLY 343 Ca -0.09 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.65 3h0r h GLY 343 CO 0.17 0.00 -0.14 -1.36 0.00 0.00 0.00 176.54 175.21 3h0r s PHE 344 N -2.91 3.67 1.17 5.60 0.08 -0.25 -1.90 117.98 123.45 3h0r s PHE 344 Ca -0.02 1.02 -0.19 0.00 0.12 0.00 0.00 56.93 57.86 3h0r s PHE 344 Cb 0.08 -2.43 0.28 0.00 -0.57 0.00 0.00 43.02 40.38 3h0r s PHE 344 CO 0.80 0.47 1.15 0.20 -0.10 0.00 0.00 175.22 177.74 3h0r s GLY 345 N -0.49 1.63 0.15 4.36 0.00 -1.26 -4.81 107.32 106.90 3h0r s GLY 345 Ca 0.26 -1.03 -0.05 0.00 0.00 0.00 0.00 44.72 43.89 3h0r s GLY 345 CO 0.14 -0.15 1.38 -2.55 0.00 0.00 0.00 173.10 171.91 3h0r h PRO 346 N -2.44 0.52 -0.12 2.90 0.11 -1.97 -1.44 132.00 129.56 3h0r h PRO 346 Ca -0.44 -0.44 -0.20 0.00 0.11 0.00 0.00 66.00 65.03 3h0r h PRO 346 Cb 1.28 0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.49 3h0r h PRO 346 CO 0.33 1.07 -0.74 1.49 -0.21 0.00 0.00 178.00 179.94 3h0r h GLU 347 N 0.35 0.61 -0.28 1.05 4.57 -1.94 -1.37 114.58 117.57 3h0r h GLU 347 Ca -0.04 -0.49 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 3h0r h GLU 347 Cb 1.37 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 30.04 3h0r h GLU 347 CO 0.14 1.11 0.17 0.28 -1.18 0.00 0.00 179.01 179.53 3h0r h VAL 348 N 0.42 1.09 -0.47 0.32 2.07 -1.85 -2.00 116.25 115.82 3h0r h VAL 348 Ca -0.04 -0.20 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 3h0r h VAL 348 Cb 1.34 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 3h0r h VAL 348 CO 0.14 0.09 0.02 0.11 0.02 0.00 0.00 177.57 177.95 3h0r h LYS 349 N 0.36 0.77 -0.73 1.57 1.57 -1.07 -0.61 116.57 118.43 3h0r h LYS 349 Ca 0.10 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 3h0r h LYS 349 Cb -0.01 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 3h0r h LYS 349 CO -0.02 0.77 0.46 0.00 -0.57 0.00 0.00 179.45 180.09 3h0r h ARG 350 N 0.73 0.99 -0.10 3.15 3.08 -0.97 -1.62 114.38 119.63 3h0r h ARG 350 Ca 0.15 -0.08 -0.19 0.00 0.07 0.00 0.00 59.98 59.93 3h0r h ARG 350 Cb 0.42 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 3h0r h ARG 350 CO 0.02 0.68 -0.71 0.00 -1.07 0.00 0.00 179.97 178.88 3h0r h ARG 351 N 1.00 0.47 -0.18 0.04 3.08 -0.91 -1.45 114.38 116.42 3h0r h ARG 351 Ca 0.27 -0.37 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 3h0r h ARG 351 Cb -0.06 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3h0r h ARG 351 CO -0.05 1.00 0.11 0.82 -1.07 0.00 0.00 179.97 180.78 3h0r h ILE 352 N 0.32 1.08 0.21 2.04 2.04 -0.99 0.17 117.51 122.38 3h0r h ILE 352 Ca -0.03 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.62 3h0r h ILE 352 Cb 1.29 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 3h0r h ILE 352 CO 0.13 0.08 -0.19 0.24 0.00 0.00 0.00 178.15 178.40 3h0r h MET 353 N 0.21 -0.41 -0.35 2.37 2.86 -1.21 -1.83 114.93 116.56 3h0r h MET 353 Ca 0.07 0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.79 3h0r h MET 353 Cb 0.03 0.09 -0.05 0.00 0.06 0.00 0.00 31.60 31.73 3h0r h MET 353 CO -0.01 -0.27 0.02 1.25 1.06 0.00 0.00 176.91 178.96 3h0r h LEU 354 N -0.42 -0.09 -0.33 1.22 5.85 -1.25 -2.67 115.31 117.60 3h0r h LEU 354 Ca -0.00 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.83 3h0r h LEU 354 Cb 0.39 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 3h0r h LEU 354 CO -0.04 -0.01 0.11 1.23 -0.34 0.00 0.00 178.44 179.39 3h0r h GLY 355 N 0.13 0.41 2.00 3.75 0.00 -0.44 -1.03 103.07 107.90 3h0r h GLY 355 Ca 0.17 -0.06 -0.05 0.00 0.00 0.00 0.00 47.33 47.39 3h0r h GLY 355 CO -0.27 0.02 -0.25 0.00 0.00 0.00 0.00 176.54 176.04 3h0r h THR 356 N 0.24 0.59 -0.04 4.70 1.03 -1.15 -0.46 112.91 117.82 3h0r h THR 356 Ca 0.15 -1.22 -0.03 0.00 -0.01 0.00 0.00 66.41 65.31 3h0r h THR 356 Cb 0.14 1.82 0.00 0.00 -1.07 0.00 0.00 68.15 69.04 3h0r h THR 356 CO -0.17 0.25 -0.09 0.15 -0.01 0.00 0.00 175.52 175.65 3h0r h PHE 357 N 0.00 0.16 -0.06 0.00 3.04 -1.26 -2.76 116.94 116.06 3h0r h PHE 357 Ca -0.00 -0.06 0.02 0.00 3.98 0.00 0.00 57.97 61.90 3h0r h PHE 357 Cb 0.80 -0.03 -0.00 0.00 2.56 0.00 0.00 35.95 39.28 3h0r h PHE 357 CO 0.00 0.70 0.06 0.00 -2.02 0.00 0.00 178.31 177.04 3h0r h ALA 358 N 0.44 1.76 0.00 2.41 0.00 -0.19 -1.13 119.26 122.55 3h0r h ALA 358 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h0r h ALA 358 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3h0r h ALA 358 CO 0.02 -0.09 -0.81 1.28 0.00 0.00 0.00 179.25 179.65 3h0r n LEU 359 N -4.06 0.78 -4.77 0.00 4.77 -0.28 -3.65 117.00 109.79 3h0r n LEU 359 Ca -0.02 -0.28 -0.39 0.00 -0.03 0.00 0.00 56.01 55.29 3h0r n LEU 359 Cb 0.15 -0.10 -0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3h0r n LEU 359 CO 0.30 0.19 0.97 -0.94 -1.33 0.00 0.00 177.39 176.57 3h0r s SER 360 N -3.05 6.31 0.31 -1.43 1.04 -0.43 -4.61 113.70 111.85 3h0r s SER 360 Ca 0.09 2.66 -0.30 0.00 0.48 0.00 0.00 55.95 58.89 3h0r s SER 360 Cb 0.17 -2.64 -0.12 0.00 0.10 0.00 0.00 66.02 63.53 3h0r s SER 360 CO 0.80 -0.85 1.50 0.00 0.98 0.00 0.00 173.24 175.67 3h0r n ALA 361 N 0.14 2.10 0.00 5.32 0.00 -1.26 -0.88 120.51 125.93 3h0r n ALA 361 Ca 0.04 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.85 3h0r n ALA 361 Cb 0.43 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.49 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 1.66 3.22 0.00 0.00 0.00 -1.26 -4.74 105.19 104.06 3h0r n GLY 362 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.23 0.00 -0.09 1.61 4.01 -0.64 -4.81 117.16 116.01 3h0r n TYR 363 Ca 0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.68 3h0r n TYR 363 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.04 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 0.05 -0.62 -0.72 5.03 -1.08 -0.48 116.97 119.16 3h0r h TYR 364 Ca 0.00 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.34 3h0r h TYR 364 Cb 0.00 0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.28 3h0r h TYR 364 CO 0.00 -0.02 0.40 -0.44 -1.32 0.00 0.00 178.16 176.78 3h0r h ASP 365 N 0.14 0.72 1.32 -2.11 3.32 -1.87 -1.70 116.42 116.25 3h0r h ASP 365 Ca 0.16 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3h0r h ASP 365 Cb 0.20 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3h0r h ASP 365 CO -0.24 0.53 -0.34 0.00 -1.72 0.00 0.00 179.24 177.47 3h0r h ALA 366 N 1.22 0.79 -3.00 3.45 0.00 -1.83 -2.46 119.26 117.42 3h0r h ALA 366 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3h0r h ALA 366 Cb -0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.71 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 -2.45 0.00 0.05 0.00 4.02 -0.21 -4.60 117.16 113.98 3h0r n TYR 367 Ca 0.04 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.81 3h0r n TYR 367 Cb 0.47 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.75 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 -0.76 0.03 -0.72 3.20 -1.49 0.68 116.97 117.91 3h0r h TYR 368 Ca 0.00 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.91 3h0r h TYR 368 Cb 0.00 0.34 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 3h0r h TYR 368 CO 0.00 -0.37 -0.14 1.25 -1.64 0.00 0.00 178.16 177.26 3h0r h LEU 369 N -0.42 -0.40 -0.56 2.82 5.85 -1.52 -0.52 115.31 120.56 3h0r h LEU 369 Ca 0.07 0.06 0.11 0.00 0.84 0.00 0.00 57.88 58.95 3h0r h LEU 369 Cb 0.51 0.16 -0.11 0.00 0.37 0.00 0.00 40.66 41.60 3h0r h LEU 369 CO -0.25 -0.20 -0.14 0.50 -0.34 0.00 0.00 178.44 178.01 3h0r h LYS 370 N -0.25 -0.00 -0.46 1.25 1.63 -1.14 -1.60 116.57 116.01 3h0r h LYS 370 Ca 0.04 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.79 3h0r h LYS 370 Cb 0.29 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 3h0r h LYS 370 CO -0.12 -0.00 0.08 0.00 -3.45 0.00 0.00 179.45 175.97 3h0r h ALA 371 N 1.56 1.29 0.00 5.00 0.00 -0.37 -1.17 119.26 125.57 3h0r h ALA 371 Ca 0.27 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3h0r h ALA 371 Cb 0.41 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3h0r h ALA 371 CO -0.58 0.49 -0.31 1.96 0.00 0.00 0.00 179.25 180.81 3h0r h GLN 372 N 0.67 0.00 0.01 0.00 1.08 -0.19 -0.32 115.11 116.37 3h0r h GLN 372 Ca 0.15 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.35 3h0r h GLN 372 Cb 0.30 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 3h0r h GLN 372 CO 0.00 0.31 -0.01 0.87 -0.95 0.00 0.00 178.83 179.06 3h0r h LYS 373 N 0.00 -0.01 -0.41 1.46 1.57 -0.53 -3.09 116.57 115.57 3h0r h LYS 373 Ca -0.00 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.87 3h0r h LYS 373 Cb 0.74 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 3h0r h LYS 373 CO 0.04 0.71 0.28 0.28 -0.57 0.00 0.00 179.45 180.19 3h0r h VAL 374 N -0.76 0.85 -0.67 0.50 2.07 -1.10 0.84 116.25 117.99 3h0r h VAL 374 Ca -0.00 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 3h0r h VAL 374 Cb 0.73 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 3h0r h VAL 374 CO 0.00 0.02 0.23 -0.09 0.02 0.00 0.00 177.57 177.75 3h0r h ARG 375 N 0.11 1.01 -0.09 1.57 2.43 -1.07 -0.88 114.38 117.45 3h0r h ARG 375 Ca 0.19 -0.19 -0.17 0.00 -0.81 0.00 0.00 59.98 59.01 3h0r h ARG 375 Cb 0.61 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 3h0r h ARG 375 CO -0.02 0.85 -0.65 -0.09 -1.51 0.00 0.00 179.97 178.55 3h0r h ARG 376 N 0.98 0.36 -0.06 0.20 2.43 -0.76 -0.63 114.38 116.90 3h0r h ARG 376 Ca 0.22 -0.27 0.01 0.00 -0.81 0.00 0.00 59.98 59.14 3h0r h ARG 376 Cb 0.25 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 3h0r h ARG 376 CO -0.01 0.89 -0.02 -0.07 -1.51 0.00 0.00 179.97 179.24 3h0r h LEU 377 N 0.26 -0.08 -0.52 3.80 3.38 -1.02 -0.30 115.31 120.83 3h0r h LEU 377 Ca -0.01 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.04 3h0r h LEU 377 Cb 1.20 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.94 3h0r h LEU 377 CO 0.11 -0.03 0.22 0.40 0.09 0.00 0.00 178.44 179.22 3h0r h ILE 378 N -0.02 0.87 -0.74 1.22 2.04 -1.05 -0.56 117.51 119.27 3h0r h ILE 378 Ca 0.03 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 3h0r h ILE 378 Cb 0.07 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 3h0r h ILE 378 CO -0.07 0.08 0.44 0.74 0.00 0.00 0.00 178.15 179.34 3h0r h THR 379 N 0.42 1.21 -0.40 -0.27 2.02 -0.82 -2.52 112.91 112.55 3h0r h THR 379 Ca 0.24 -0.48 -0.08 0.00 0.77 0.00 0.00 66.41 66.85 3h0r h THR 379 Cb 0.22 0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 66.80 3h0r h THR 379 CO -0.22 0.23 -0.10 0.78 0.37 0.00 0.00 175.52 176.58 3h0r h ASN 380 N 1.02 0.68 -0.45 4.18 2.35 -0.29 -1.68 115.58 121.39 3h0r h ASN 380 Ca 0.27 -0.19 0.09 0.00 -0.55 0.00 0.00 56.30 55.92 3h0r h ASN 380 Cb -0.02 -0.18 -0.10 0.00 0.05 0.00 0.00 38.32 38.07 3h0r h ASN 380 CO -0.05 0.82 -0.27 0.44 -1.65 0.00 0.00 177.43 176.72 3h0r h ASP 381 N 0.64 -0.92 -0.05 5.81 5.19 -0.69 -1.80 116.42 124.61 3h0r h ASP 381 Ca 0.11 0.19 -0.00 0.00 -0.62 0.00 0.00 57.03 56.71 3h0r h ASP 381 Cb 0.54 0.46 -0.00 0.00 0.18 0.00 0.00 39.33 40.51 3h0r h ASP 381 CO 0.03 -0.28 0.03 -0.26 -3.12 0.00 0.00 179.24 175.64 3h0r h PHE 382 N -0.17 0.06 -0.97 4.55 0.04 -1.16 -0.28 116.94 119.01 3h0r h PHE 382 Ca 0.21 0.00 0.10 0.00 2.80 0.00 0.00 57.97 61.08 3h0r h PHE 382 Cb 0.50 -0.02 -0.07 0.00 2.20 0.00 0.00 35.95 38.56 3h0r h PHE 382 CO -0.52 0.07 0.62 -0.07 -0.60 0.00 0.00 178.31 177.81 3h0r h LEU 383 N 0.03 0.91 -0.04 1.54 3.38 -1.14 0.13 115.31 120.12 3h0r h LEU 383 Ca 0.02 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3h0r h LEU 383 Cb 0.03 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 3h0r h LEU 383 CO -0.00 0.52 -0.05 0.50 0.09 0.00 0.00 178.44 179.50 3h0r h LYS 384 N 1.00 0.09 -0.41 1.13 3.64 -1.00 -3.04 116.57 117.97 3h0r h LYS 384 Ca 0.45 -0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.87 3h0r h LYS 384 Cb 0.39 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 3h0r h LYS 384 CO -0.21 0.59 0.28 0.00 -2.27 0.00 0.00 179.45 177.84 3h0r h ALA 385 N 0.51 2.17 0.00 5.00 0.00 -0.34 -1.46 119.26 125.13 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 0.58 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3h0r h ALA 385 CO 0.01 -0.27 0.00 1.19 0.00 0.00 0.00 179.25 180.18 3h0r n PHE 386 N -4.46 0.00 0.09 0.00 3.72 0.38 -2.04 117.46 115.15 3h0r n PHE 386 Ca 0.06 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.38 3h0r n PHE 386 Cb 0.37 -0.18 -0.00 0.00 -0.94 0.00 0.00 39.48 38.72 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 0.19 0.00 -1.08 5.08 -1.23 -3.36 114.58 114.18 3h0r h GLU 387 Ca 0.00 -0.20 -0.33 0.00 -1.00 0.00 0.00 59.36 57.83 3h0r h GLU 387 Cb 0.17 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.42 3h0r h GLU 387 CO 0.00 0.94 -2.05 0.39 -1.00 0.00 0.00 179.01 177.29 3h0r n GLU 388 N -3.66 0.66 -4.37 2.33 1.02 -0.98 -5.03 120.64 110.61 3h0r n GLU 388 Ca -0.03 0.15 -0.19 0.00 -0.02 0.00 0.00 57.16 57.07 3h0r n GLU 388 Cb 0.80 -1.66 -0.10 0.00 -0.02 0.00 0.00 31.44 30.46 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 -2.54 1.23 -0.23 2.62 -7.23 -0.86 -4.97 120.40 108.41 3h0r s VAL 389 Ca -0.08 -2.06 0.09 0.00 -1.81 0.00 0.00 61.98 58.12 3h0r s VAL 389 Cb 0.07 -2.43 -0.20 0.00 0.56 0.00 0.00 36.38 34.39 3h0r s VAL 389 CO 0.82 -0.28 -0.10 0.47 -0.31 0.00 0.00 175.10 175.70 3h0r n ASP 390 N -0.50 1.23 -4.11 4.85 8.00 -0.54 -4.42 116.55 121.06 3h0r n ASP 390 Ca -0.05 -0.08 -0.08 0.00 0.71 0.00 0.00 54.79 55.29 3h0r n ASP 390 Cb 0.64 0.19 -0.10 0.00 -0.02 0.00 0.00 41.12 41.83 3h0r n ASP 390 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3h0r s VAL 391 N -2.49 0.34 -0.10 2.53 -7.23 -0.99 -4.33 120.40 108.12 3h0r s VAL 391 Ca -0.24 -1.85 0.03 0.00 -1.81 0.00 0.00 61.98 58.12 3h0r s VAL 391 Cb 0.07 -1.58 -0.01 0.00 0.56 0.00 0.00 36.38 35.42 3h0r s VAL 391 CO 0.68 -0.95 -0.19 -0.63 -0.31 0.00 0.00 175.10 173.70 3h0r s ILE 392 N -3.85 2.54 0.17 -0.62 1.01 0.30 -1.01 121.20 119.74 3h0r s ILE 392 Ca 0.09 -0.86 0.11 0.00 0.00 0.00 0.00 60.65 59.99 3h0r s ILE 392 Cb 0.07 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 3h0r s ILE 392 CO -0.08 0.55 -0.24 0.00 0.00 0.00 0.00 174.94 175.17 3h0r s ALA 393 N 0.15 2.53 0.20 9.38 0.00 -0.71 0.08 121.76 133.39 3h0r s ALA 393 Ca -0.10 -1.56 -0.23 0.00 0.00 0.00 0.00 51.96 50.06 3h0r s ALA 393 Cb -0.16 -0.39 0.05 0.00 0.00 0.00 0.00 23.12 22.62 3h0r s ALA 393 CO 0.06 0.47 0.79 -1.54 0.00 0.00 0.00 175.76 175.54 3h0r s SER 394 N -2.48 -0.29 0.55 0.00 1.04 -0.54 -4.55 113.70 107.43 3h0r s SER 394 Ca 0.19 -0.41 -0.21 0.00 0.48 0.00 0.00 55.95 56.00 3h0r s SER 394 Cb -0.09 0.61 -0.05 0.00 0.10 0.00 0.00 66.02 66.60 3h0r s SER 394 CO 0.09 -1.10 1.31 -2.84 0.98 0.00 0.00 173.24 171.68 3h0r s PRO 395 N -3.64 3.17 0.31 4.02 0.02 -1.26 0.27 135.00 137.88 3h0r s PRO 395 Ca 0.09 2.12 0.08 0.00 0.02 0.00 0.00 61.00 63.31 3h0r s PRO 395 Cb -0.03 -2.22 0.50 0.00 0.02 0.00 0.00 34.50 32.76 3h0r s PRO 395 CO 0.01 -1.13 1.72 1.15 -0.33 0.00 0.00 177.00 178.42 3h0r h THR 396 N 1.39 1.31 -3.83 0.99 2.02 -1.58 -3.41 112.91 109.79 3h0r h THR 396 Ca -0.51 -1.51 -0.21 0.00 0.77 0.00 0.00 66.41 64.96 3h0r h THR 396 Cb 1.30 1.71 -0.25 0.00 -1.74 0.00 0.00 68.15 69.16 3h0r h THR 396 CO 0.57 0.45 -0.71 -0.89 0.37 0.00 0.00 175.52 175.30 3h0r s THR 397 N -4.13 0.06 -0.02 3.16 2.01 -1.26 -4.39 115.64 111.07 3h0r s THR 397 Ca -0.04 -0.37 0.31 0.00 0.31 0.00 0.00 61.69 61.90 3h0r s THR 397 Cb 0.14 -0.12 0.34 0.00 0.01 0.00 0.00 72.50 72.87 3h0r s THR 397 CO 0.76 -0.20 1.93 1.55 -0.69 0.00 0.00 174.62 177.98 3h0r h PRO 398 N 5.54 0.00 -4.49 4.92 0.13 -1.88 -3.46 132.00 132.76 3h0r h PRO 398 Ca -0.27 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.66 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 0.47 0.00 -0.65 0.95 -0.23 0.00 0.00 178.00 178.53 3h0r s THR 399 N -3.62 0.24 0.72 1.56 -4.23 -1.26 -0.90 115.64 108.16 3h0r s THR 399 Ca 0.01 -1.92 -0.13 0.00 -1.18 0.00 0.00 61.69 58.47 3h0r s THR 399 Cb 0.09 -2.00 0.03 0.00 1.34 0.00 0.00 72.50 71.96 3h0r s THR 399 CO 0.45 -0.53 1.12 -0.76 -0.54 0.00 0.00 174.62 174.37 3h0r s LEU 400 N -3.06 3.23 -0.32 4.79 1.43 -1.26 -4.94 118.68 118.54 3h0r s LEU 400 Ca 0.22 2.00 -0.39 0.00 -1.03 0.00 0.00 54.13 54.93 3h0r s LEU 400 Cb 0.07 -4.55 -0.17 0.00 0.03 0.00 0.00 46.19 41.57 3h0r s LEU 400 CO 0.01 -1.95 1.28 -2.65 0.23 0.00 0.00 176.35 173.27 3h0r n PRO 401 N -2.94 0.00 -2.64 1.29 -0.02 -1.26 -4.95 135.00 124.47 3h0r n PRO 401 Ca 0.10 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.36 3h0r n PRO 401 Cb 0.52 -1.31 0.08 0.00 -0.02 0.00 0.00 33.50 32.77 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 1.94 2.09 0.39 6.00 -0.12 -1.26 -4.84 117.98 122.17 3h0r s PHE 402 Ca 0.89 -0.20 -0.08 0.00 -0.05 0.00 0.00 56.93 57.48 3h0r s PHE 402 Cb -1.26 -2.83 -0.06 0.00 -0.63 0.00 0.00 43.02 38.24 3h0r s PHE 402 CO 0.66 -1.33 0.72 0.15 -0.05 0.00 0.00 175.22 175.37 3h0r s LYS 403 N -4.95 3.70 0.46 1.99 1.02 -1.26 -1.58 119.74 119.12 3h0r s LYS 403 Ca 0.62 0.30 -0.24 0.00 0.02 0.00 0.00 55.97 56.67 3h0r s LYS 403 Cb -0.07 -2.46 -0.08 0.00 -0.52 0.00 0.00 37.83 34.70 3h0r s LYS 403 CO 0.41 0.00 1.28 1.19 -0.92 0.00 0.00 175.35 177.32 3h0r n PHE 404 N -1.35 2.12 -0.12 3.18 3.72 -1.21 -2.06 117.46 121.74 3h0r n PHE 404 Ca 0.01 0.48 0.00 0.00 -0.05 0.00 0.00 57.45 57.89 3h0r n PHE 404 Cb 0.54 -2.36 0.00 0.00 -0.94 0.00 0.00 39.48 36.72 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 0.82 2.22 0.23 1.37 0.00 -1.26 -4.86 105.19 103.71 3h0r n GLY 405 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.07 3h0r n GLY 405 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h0r h GLU 406 N 1.74 0.43 -0.33 1.61 5.08 -1.82 -3.25 114.58 118.03 3h0r h GLU 406 Ca 0.00 -0.17 -0.25 0.00 -1.00 0.00 0.00 59.36 57.94 3h0r h GLU 406 Cb 0.00 -0.02 -0.24 0.00 0.50 0.00 0.00 28.75 28.99 3h0r h GLU 406 CO 0.00 0.67 -0.73 0.54 -1.00 0.00 0.00 179.01 178.50 3h0r n ARG 407 N -4.11 2.26 -0.00 2.33 1.74 -1.26 -4.64 116.66 112.98 3h0r n ARG 407 Ca -0.01 -3.55 0.04 0.00 -0.77 0.00 0.00 57.85 53.57 3h0r n ARG 407 Cb 0.42 -1.74 -0.06 0.00 -1.02 0.00 0.00 32.46 30.06 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 -0.77 0.25 0.12 0.55 4.77 -1.23 -3.83 117.00 116.86 3h0r n LEU 408 Ca 0.27 -0.30 -0.05 0.00 -0.03 0.00 0.00 56.01 55.90 3h0r n LEU 408 Cb 0.85 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.92 3h0r n LEU 408 CO 0.14 0.06 0.39 -0.08 -1.33 0.00 0.00 177.39 176.58 3h0r h GLU 409 N 0.00 -0.30 -4.91 3.23 4.81 -1.82 -3.40 114.58 112.18 3h0r h GLU 409 Ca 0.00 0.02 -0.65 0.00 -0.13 0.00 0.00 59.36 58.60 3h0r h GLU 409 Cb 0.29 0.07 -0.17 0.00 0.63 0.00 0.00 28.75 29.57 3h0r h GLU 409 CO 0.00 -0.20 -0.44 1.21 -0.73 0.00 0.00 179.01 178.85 3h0r s ASN 410 N -2.86 6.08 0.34 1.04 2.47 -1.26 -4.98 114.94 115.77 3h0r s ASN 410 Ca -0.05 -0.06 0.14 0.00 0.42 0.00 0.00 52.86 53.32 3h0r s ASN 410 Cb 0.00 -2.15 1.04 0.00 -1.45 0.00 0.00 41.25 38.70 3h0r s ASN 410 CO 0.14 -0.14 1.69 -0.65 -3.72 0.00 0.00 177.10 174.42 3h0r h PRO 411 N 8.37 0.39 -0.72 0.43 0.11 -1.84 -0.31 132.00 138.43 3h0r h PRO 411 Ca -0.33 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.83 3h0r h PRO 411 Cb 1.17 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 3h0r h PRO 411 CO 0.60 0.26 0.48 0.82 -0.21 0.00 0.00 178.00 179.94 3h0r h ILE 412 N 0.40 0.98 -0.85 4.15 2.04 -1.94 -0.88 117.51 121.41 3h0r h ILE 412 Ca 0.70 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 66.40 3h0r h ILE 412 Cb 1.56 0.23 -0.06 0.00 -0.74 0.00 0.00 36.82 37.81 3h0r h ILE 412 CO -0.53 0.13 0.56 -0.33 0.00 0.00 0.00 178.15 177.98 3h0r h GLU 413 N 0.70 0.88 -0.52 2.37 5.08 -1.34 -1.11 114.58 120.62 3h0r h GLU 413 Ca 0.32 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.52 3h0r h GLU 413 Cb 0.35 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3h0r h GLU 413 CO -0.11 0.58 -0.11 1.98 -1.00 0.00 0.00 179.01 180.35 3h0r h MET 414 N 0.90 1.00 -0.90 2.33 4.05 -1.25 -3.13 114.93 117.93 3h0r h MET 414 Ca 0.38 -0.38 0.05 0.00 -0.28 0.00 0.00 59.70 59.47 3h0r h MET 414 Cb 0.30 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 30.98 3h0r h MET 414 CO -0.15 1.06 0.57 1.88 0.23 0.00 0.00 176.91 180.50 3h0r h TYR 415 N 0.87 1.07 0.00 1.39 0.05 -1.05 -2.28 116.97 117.02 3h0r h TYR 415 Ca 0.13 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.94 3h0r h TYR 415 Cb 0.68 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 38.07 3h0r h TYR 415 CO 0.05 0.57 0.00 1.28 -1.05 0.00 0.00 178.16 179.01 3h0r n LEU 416 N -4.56 0.10 0.25 3.88 4.77 -0.88 -1.19 117.00 119.38 3h0r n LEU 416 Ca 0.13 0.55 0.13 0.00 -0.03 0.00 0.00 56.01 56.78 3h0r n LEU 416 Cb 0.14 -0.56 0.66 0.00 -2.33 0.00 0.00 43.42 41.33 3h0r n LEU 416 CO 0.32 -0.56 0.93 0.28 -1.33 0.00 0.00 177.39 177.03 3h0r h SER 417 N 0.00 0.00 -0.26 -1.43 0.02 -1.54 -3.25 113.55 107.09 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 0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.56 3h0r h SER 417 CO 0.00 0.14 0.00 0.47 -1.14 0.00 0.00 176.83 176.30 3h0r n ASP 418 N -3.47 3.08 0.10 3.07 8.00 -0.33 -4.57 116.55 122.42 3h0r n ASP 418 Ca -0.01 -1.95 0.16 0.00 0.71 0.00 0.00 54.79 53.71 3h0r n ASP 418 Cb 0.30 -0.16 0.69 0.00 -0.02 0.00 0.00 41.12 41.93 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 4.22 0.77 -0.01 0.53 3.07 -1.74 -0.52 117.51 123.83 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 0.92 0.82 0.00 0.00 -0.27 0.00 0.00 36.82 38.29 3h0r h ILE 419 CO 0.00 0.00 -0.60 0.18 -1.05 0.00 0.00 178.15 176.68 3h0r n LEU 420 N -4.35 1.78 -0.09 0.16 4.77 -1.26 -4.56 117.00 113.45 3h0r n LEU 420 Ca 0.05 -0.69 -0.11 0.00 -0.03 0.00 0.00 56.01 55.23 3h0r n LEU 420 Cb 0.43 -0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.40 3h0r n LEU 420 CO 0.35 0.35 -1.12 0.35 -1.33 0.00 0.00 177.39 175.98 3h0r n THR 421 N -0.38 1.19 -0.11 -5.08 -2.24 -0.27 -4.60 114.28 102.80 3h0r n THR 421 Ca 0.08 -0.60 -0.02 0.00 -2.27 0.00 0.00 64.05 61.23 3h0r n THR 421 Cb 0.44 -0.88 0.21 0.00 -2.10 0.00 0.00 70.33 67.99 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 -0.98 2.28 -1.51 -1.37 -3.00 116.25 112.90 3h0r h VAL 422 Ca -0.47 -0.81 0.23 0.00 -1.23 0.00 0.00 66.70 64.43 3h0r h VAL 422 Cb 1.90 0.72 -0.12 0.00 -2.13 0.00 0.00 31.29 31.66 3h0r h VAL 422 CO -0.02 0.30 0.55 -0.65 -1.23 0.00 0.00 177.57 176.52 3h0r h PRO 423 N 0.75 0.54 -0.34 5.19 0.11 -1.84 -1.20 132.00 135.21 3h0r h PRO 423 Ca 0.16 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.17 3h0r h PRO 423 Cb 0.30 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.27 3h0r h PRO 423 CO 0.00 0.36 -0.08 0.00 -0.21 0.00 0.00 178.00 178.07 3h0r h ALA 424 N 1.72 1.23 -0.26 -0.75 0.00 -1.84 -1.84 119.26 117.51 3h0r h ALA 424 Ca 0.62 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 55.11 3h0r h ALA 424 Cb 1.16 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3h0r h ALA 424 CO -0.48 0.50 -0.50 -0.91 0.00 0.00 0.00 179.25 177.87 3h0r h ASN 425 N 0.53 0.79 -0.72 0.00 4.21 -1.39 0.12 115.58 119.13 3h0r h ASN 425 Ca 0.10 -0.40 -0.03 0.00 1.21 0.00 0.00 56.30 57.18 3h0r h ASN 425 Cb 0.46 -0.23 -0.03 0.00 -1.12 0.00 0.00 38.32 37.40 3h0r h ASN 425 CO 0.02 1.15 0.33 -0.07 -1.29 0.00 0.00 177.43 177.58 3h0r h LEU 426 N 0.57 0.96 -0.26 1.61 3.38 -1.07 -2.38 115.31 118.11 3h0r h LEU 426 Ca 0.02 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3h0r h LEU 426 Cb 1.07 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.57 3h0r h LEU 426 CO 0.10 0.84 -0.16 0.00 0.09 0.00 0.00 178.44 179.32 3h0r n ALA 427 N -2.39 2.85 -1.23 1.53 0.00 -0.72 -4.86 120.51 115.68 3h0r n ALA 427 Ca 0.06 -0.29 -0.07 0.00 0.00 0.00 0.00 53.44 53.13 3h0r n ALA 427 Cb 0.15 -1.29 -0.03 0.00 0.00 0.00 0.00 19.45 18.28 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 1.31 0.92 3.87 0.00 0.00 -0.40 -4.98 105.19 105.92 3h0r n GLY 428 Ca 0.13 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.68 4.16 0.60 0.99 1.43 0.28 -2.06 118.68 122.41 3h0r s LEU 429 Ca 0.00 0.97 -0.17 0.00 -1.03 0.00 0.00 54.13 53.90 3h0r s LEU 429 Cb 0.00 -3.73 -0.03 0.00 0.03 0.00 0.00 46.19 42.46 3h0r s LEU 429 CO 0.00 -0.09 1.11 -2.16 0.23 0.00 0.00 176.35 175.45 3h0r s PRO 430 N -2.83 3.07 -0.18 1.29 0.04 -1.26 -4.59 135.00 130.55 3h0r s PRO 430 Ca 0.48 1.48 -0.23 0.00 0.04 0.00 0.00 61.00 62.77 3h0r s PRO 430 Cb -0.11 -1.98 0.06 0.00 0.04 0.00 0.00 34.50 32.51 3h0r s PRO 430 CO 0.21 -1.05 0.60 0.00 0.04 0.00 0.00 177.00 176.80 3h0r s ALA 431 N -2.10 -1.51 0.03 8.56 0.00 -0.23 -2.08 121.76 124.43 3h0r s ALA 431 Ca 0.69 1.53 0.06 0.00 0.00 0.00 0.00 51.96 54.24 3h0r s ALA 431 Cb -0.22 -0.71 -0.02 0.00 0.00 0.00 0.00 23.12 22.17 3h0r s ALA 431 CO 0.35 -0.30 -0.17 -1.50 0.00 0.00 0.00 175.76 174.13 3h0r s ILE 432 N -0.12 1.36 -0.09 0.00 2.07 -0.57 -1.40 121.20 122.45 3h0r s ILE 432 Ca -0.03 -1.03 0.02 0.00 -1.41 0.00 0.00 60.65 58.20 3h0r s ILE 432 Cb -0.03 -1.20 -0.02 0.00 0.13 0.00 0.00 42.46 41.34 3h0r s ILE 432 CO 0.03 0.15 -0.17 -0.55 -1.91 0.00 0.00 174.94 172.49 3h0r s SER 433 N -1.02 3.74 -0.04 4.50 0.15 -0.23 -1.63 113.70 119.17 3h0r s SER 433 Ca 0.05 -0.35 0.01 0.00 0.70 0.00 0.00 55.95 56.35 3h0r s SER 433 Cb -0.08 -1.26 0.02 0.00 -1.71 0.00 0.00 66.02 62.99 3h0r s SER 433 CO 0.01 0.22 -0.03 -0.63 1.20 0.00 0.00 173.24 174.02 3h0r s ILE 434 N -0.01 0.37 0.08 6.45 -1.09 -0.00 -1.79 121.20 125.21 3h0r s ILE 434 Ca -0.05 -0.04 -0.31 0.00 -2.23 0.00 0.00 60.65 58.02 3h0r s ILE 434 Cb -0.14 -0.42 -0.08 0.00 -1.58 0.00 0.00 42.46 40.23 3h0r s ILE 434 CO 0.04 0.18 1.50 -2.84 -1.23 0.00 0.00 174.94 172.60 3h0r s PRO 435 N 0.89 4.26 -0.00 2.79 0.02 -1.26 0.79 135.00 142.48 3h0r s PRO 435 Ca -0.11 2.17 0.01 0.00 0.02 0.00 0.00 61.00 63.10 3h0r s PRO 435 Cb -0.14 -3.43 -0.02 0.00 0.02 0.00 0.00 34.50 30.93 3h0r s PRO 435 CO -0.01 -0.59 0.03 0.44 -0.33 0.00 0.00 177.00 176.54 3h0r n ILE 436 N 4.39 0.02 -3.82 2.83 -5.35 0.78 -4.85 119.36 113.36 3h0r n ILE 436 Ca 0.14 -0.04 -0.05 0.00 -0.27 0.00 0.00 62.75 62.53 3h0r n ILE 436 Cb 0.42 0.11 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 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 -2.09 -1.36 -0.10 -1.28 0.00 -1.22 -4.88 121.76 110.84 3h0r s ALA 437 Ca -0.01 -0.28 0.01 0.00 0.00 0.00 0.00 51.96 51.69 3h0r s ALA 437 Cb 0.01 0.72 0.02 0.00 0.00 0.00 0.00 23.12 23.86 3h0r s ALA 437 CO 0.06 -1.04 -0.12 -1.58 0.00 0.00 0.00 175.76 173.09 3h0r s TRP 438 N -2.83 1.63 -0.13 0.00 0.52 -1.26 -1.43 118.94 115.44 3h0r s TRP 438 Ca 0.16 -0.73 0.00 0.00 0.02 0.00 0.00 56.10 55.54 3h0r s TRP 438 Cb -0.03 -1.24 0.02 0.00 -1.15 0.00 0.00 33.47 31.07 3h0r s TRP 438 CO 0.06 -0.42 -0.11 0.15 0.02 0.00 0.00 176.95 176.65 3h0r s LYS 439 N 1.12 1.90 -1.53 4.98 -0.14 0.26 -4.66 119.74 121.67 3h0r s LYS 439 Ca -0.05 -0.40 -0.04 0.00 -1.36 0.00 0.00 55.97 54.11 3h0r s LYS 439 Cb -0.14 -1.83 0.01 0.00 -1.68 0.00 0.00 37.83 34.19 3h0r s LYS 439 CO -0.02 -0.24 0.46 -0.25 -0.76 0.00 0.00 175.35 174.53 3h0r n ASP 440 N 4.83 -5.65 0.00 2.83 8.00 -1.26 -1.81 116.55 123.49 3h0r n ASP 440 Ca -0.15 -0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.12 3h0r n ASP 440 Cb 0.50 -4.61 0.00 0.00 -0.02 0.00 0.00 41.12 36.99 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 -1.35 1.33 3.55 0.44 0.00 -1.26 -5.04 105.19 102.86 3h0r n GLY 441 Ca -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 3h0r n GLY 441 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h0r s LEU 442 N 0.00 3.01 0.60 0.99 1.43 -0.75 -4.91 118.68 119.05 3h0r s LEU 442 Ca 0.00 -0.12 -0.19 0.00 -1.03 0.00 0.00 54.13 52.80 3h0r s LEU 442 Cb 0.00 -1.67 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 3h0r s LEU 442 CO 0.00 0.34 1.22 -2.84 0.23 0.00 0.00 176.35 175.30 3h0r s PRO 443 N -0.94 2.91 -0.05 1.29 0.02 -1.26 -0.57 135.00 136.39 3h0r s PRO 443 Ca 0.13 1.87 0.03 0.00 0.02 0.00 0.00 61.00 63.05 3h0r s PRO 443 Cb -0.11 -1.92 0.01 0.00 0.02 0.00 0.00 34.50 32.50 3h0r s PRO 443 CO 0.03 -1.27 -0.13 0.08 -0.33 0.00 0.00 177.00 175.38 3h0r s VAL 444 N -1.56 1.12 -0.14 3.83 1.01 -0.52 -4.66 120.40 119.48 3h0r s VAL 444 Ca 0.78 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 62.17 3h0r s VAL 444 Cb -0.32 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 3h0r s VAL 444 CO 0.34 0.34 0.12 -0.83 0.00 0.00 0.00 175.10 175.07 3h0r s GLY 445 N 0.36 2.08 -0.14 4.51 0.00 -1.26 -0.16 107.32 112.72 3h0r s GLY 445 Ca -0.08 -0.68 -0.07 0.00 0.00 0.00 0.00 44.72 43.89 3h0r s GLY 445 CO 0.02 -0.22 0.11 -0.32 0.00 0.00 0.00 173.10 172.70 3h0r s GLY 446 N -0.52 2.07 -0.12 0.20 0.00 0.24 -1.59 107.32 107.59 3h0r s GLY 446 Ca 0.12 -0.68 -0.03 0.00 0.00 0.00 0.00 44.72 44.13 3h0r s GLY 446 CO 0.02 -0.25 -0.01 1.62 0.00 0.00 0.00 173.10 174.48 3h0r s GLN 447 N -0.57 3.37 -0.14 2.90 0.74 0.14 -0.82 119.66 125.29 3h0r s GLN 447 Ca 0.12 -0.46 0.02 0.00 0.05 0.00 0.00 55.36 55.09 3h0r s GLN 447 Cb -0.12 -2.88 0.01 0.00 1.10 0.00 0.00 33.01 31.13 3h0r s GLN 447 CO 0.02 0.46 -0.20 -0.51 -0.55 0.00 0.00 175.29 174.51 3h0r s LEU 448 N -0.21 1.99 -0.21 3.68 1.43 -0.65 -1.46 118.68 123.24 3h0r s LEU 448 Ca 0.05 -0.56 -0.07 0.00 -1.03 0.00 0.00 54.13 52.52 3h0r s LEU 448 Cb -0.13 -1.34 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 3h0r s LEU 448 CO 0.02 0.05 0.07 -0.63 0.23 0.00 0.00 176.35 176.09 3h0r s ILE 449 N 0.95 4.58 0.48 -0.59 1.01 0.11 -1.51 121.20 126.23 3h0r s ILE 449 Ca -0.05 -0.10 0.07 0.00 0.00 0.00 0.00 60.65 60.58 3h0r s ILE 449 Cb -0.15 -3.10 0.02 0.00 0.01 0.00 0.00 42.46 39.24 3h0r s ILE 449 CO -0.04 0.40 0.45 -0.83 0.00 0.00 0.00 174.94 174.93 3h0r s GLY 450 N 0.96 2.15 0.75 6.18 0.00 -0.89 -0.54 107.32 115.93 3h0r s GLY 450 Ca 0.04 -1.72 -0.11 0.00 0.00 0.00 0.00 44.72 42.93 3h0r s GLY 450 CO 0.03 -1.77 1.09 0.54 0.00 0.00 0.00 173.10 172.98 3h0r s LYS 451 N -4.27 2.51 0.01 2.90 1.02 -1.26 -4.11 119.74 116.54 3h0r s LYS 451 Ca 0.46 0.66 -0.35 0.00 0.02 0.00 0.00 55.97 56.76 3h0r s LYS 451 Cb -0.03 -1.97 -0.13 0.00 -0.52 0.00 0.00 37.83 35.18 3h0r s LYS 451 CO 0.27 -1.32 1.70 0.72 -0.92 0.00 0.00 175.35 175.80 3h0r n HIS 452 N -3.24 2.20 -0.99 3.18 8.25 -1.26 -1.51 115.22 121.85 3h0r n HIS 452 Ca 0.07 0.22 0.00 0.00 -0.26 0.00 0.00 57.72 57.75 3h0r n HIS 452 Cb 0.56 -2.56 0.00 0.00 1.12 0.00 0.00 29.99 29.10 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 4.86 0.00 -1.91 4.41 7.02 -1.26 -4.93 117.44 125.62 3h0r n TRP 453 Ca 0.20 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.32 3h0r n TRP 453 Cb 0.26 -0.12 0.04 0.00 -2.42 0.00 0.00 31.31 29.07 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 -0.04 6.93 -0.01 -0.99 2.03 -0.57 -4.63 116.55 119.28 3h0r n ASP 454 Ca 0.00 -3.80 0.02 0.00 0.52 0.00 0.00 54.79 51.53 3h0r n ASP 454 Cb 0.02 -0.91 0.37 0.00 -0.72 0.00 0.00 41.12 39.88 3h0r n ASP 454 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 3h0r h GLU 455 N 2.69 0.54 -0.36 -0.67 3.07 -1.92 -3.06 114.58 114.88 3h0r h GLU 455 Ca 0.52 -0.07 0.07 0.00 -0.50 0.00 0.00 59.36 59.38 3h0r h GLU 455 Cb 0.41 -0.11 -0.09 0.00 -0.84 0.00 0.00 28.75 28.13 3h0r h GLU 455 CO 1.33 0.45 -0.42 1.15 -1.40 0.00 0.00 179.01 180.11 3h0r h THR 456 N 0.54 0.12 -0.40 1.13 2.02 -1.98 0.16 112.91 114.51 3h0r h THR 456 Ca 0.14 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.34 3h0r h THR 456 Cb 0.10 0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 66.60 3h0r h THR 456 CO -0.02 0.00 0.20 0.74 0.37 0.00 0.00 175.52 176.81 3h0r h THR 457 N -0.35 0.98 -0.92 3.16 2.02 -1.93 0.26 112.91 116.14 3h0r h THR 457 Ca 0.13 -0.14 0.15 0.00 0.77 0.00 0.00 66.41 67.32 3h0r h THR 457 Cb 0.59 0.54 -0.09 0.00 -1.74 0.00 0.00 68.15 67.44 3h0r h THR 457 CO -0.54 0.07 0.53 -0.07 0.37 0.00 0.00 175.52 175.88 3h0r h LEU 458 N 0.41 0.69 -0.19 2.58 4.07 -1.43 -1.21 115.31 120.23 3h0r h LEU 458 Ca 0.17 0.08 -0.19 0.00 0.08 0.00 0.00 57.88 58.02 3h0r h LEU 458 Cb 0.07 -0.04 0.01 0.00 1.08 0.00 0.00 40.66 41.78 3h0r h LEU 458 CO -0.11 0.30 -0.63 -0.07 -1.08 0.00 0.00 178.44 176.85 3h0r h LEU 459 N 0.75 0.88 -0.23 1.67 3.38 0.84 -2.74 115.31 119.86 3h0r h LEU 459 Ca 0.50 -0.59 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3h0r h LEU 459 Cb 0.68 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3h0r h LEU 459 CO -0.34 1.32 0.11 1.56 0.09 0.00 0.00 178.44 181.18 3h0r h GLN 460 N 0.48 0.33 -0.61 1.13 4.20 0.30 0.90 115.11 121.85 3h0r h GLN 460 Ca -0.02 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 3h0r h GLN 460 Cb 1.25 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.94 3h0r h GLN 460 CO 0.13 0.33 0.28 0.82 -0.67 0.00 0.00 178.83 179.72 3h0r h ILE 461 N 0.24 1.20 -0.61 2.54 2.04 -1.34 0.49 117.51 122.08 3h0r h ILE 461 Ca 0.08 -0.60 -0.07 0.00 1.00 0.00 0.00 64.86 65.27 3h0r h ILE 461 Cb 0.11 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 3h0r h ILE 461 CO -0.01 0.24 0.09 -1.28 0.00 0.00 0.00 178.15 177.19 3h0r h SER 462 N 0.86 0.95 -0.43 1.72 0.87 -1.04 -0.18 113.55 116.30 3h0r h SER 462 Ca 0.21 -0.22 -0.04 0.00 -1.23 0.00 0.00 61.79 60.51 3h0r h SER 462 Cb 0.11 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 3h0r h SER 462 CO -0.03 0.96 0.10 0.22 -0.53 0.00 0.00 176.83 177.56 3h0r h TYR 463 N 0.93 0.73 -0.73 2.24 3.20 0.24 -2.11 116.97 121.48 3h0r h TYR 463 Ca 0.19 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.90 3h0r h TYR 463 Cb 0.42 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 3h0r h TYR 463 CO 0.03 0.68 0.20 1.25 -1.64 0.00 0.00 178.16 178.68 3h0r h LEU 464 N 0.57 1.08 -0.90 2.82 5.85 -0.74 -3.06 115.31 120.92 3h0r h LEU 464 Ca 0.14 -0.22 -0.10 0.00 0.84 0.00 0.00 57.88 58.53 3h0r h LEU 464 Cb 0.32 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3h0r h LEU 464 CO 0.00 1.02 -0.30 -0.25 -0.34 0.00 0.00 178.44 178.57 3h0r h TRP 465 N 1.09 0.51 0.00 1.25 2.91 -0.85 -2.94 115.95 117.92 3h0r h TRP 465 Ca 0.23 -0.12 -0.07 0.00 1.13 0.00 0.00 58.89 60.06 3h0r h TRP 465 Cb 0.34 -0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 28.86 3h0r h TRP 465 CO 0.03 0.71 -0.35 1.05 -1.03 0.00 0.00 178.44 178.84 3h0r h GLU 466 N 0.39 0.00 -0.33 2.65 4.11 -1.29 0.28 114.58 120.39 3h0r h GLU 466 Ca 0.05 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.46 3h0r h GLU 466 Cb 0.73 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3h0r h GLU 466 CO 0.06 0.35 0.13 1.96 0.07 0.00 0.00 179.01 181.58 3h0r h GLN 467 N 0.00 0.50 -0.22 1.06 1.08 -1.44 -2.96 115.11 113.14 3h0r h GLN 467 Ca -0.00 -0.10 -0.17 0.00 -1.45 0.00 0.00 58.65 56.94 3h0r h GLN 467 Cb 0.91 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 28.26 3h0r h GLN 467 CO 0.05 0.51 -0.54 0.87 -0.95 0.00 0.00 178.83 178.77 3h0r h LYS 468 N 0.39 0.65 -3.16 1.46 1.57 -1.36 -3.42 116.57 112.70 3h0r h LYS 468 Ca 0.11 -0.40 -0.53 0.00 -1.87 0.00 0.00 60.65 57.96 3h0r h LYS 468 Cb 0.20 0.04 -0.40 0.00 0.08 0.00 0.00 32.23 32.15 3h0r h LYS 468 CO -0.01 1.02 -0.77 0.12 -0.57 0.00 0.00 179.45 179.25 3h0r s PHE 469 N -4.05 0.75 -1.33 -1.35 5.36 0.96 -5.06 117.98 113.26 3h0r s PHE 469 Ca -0.08 -0.96 -0.11 0.00 -0.96 0.00 0.00 56.93 54.81 3h0r s PHE 469 Cb 0.11 -1.07 0.13 0.00 -0.34 0.00 0.00 43.02 41.85 3h0r s PHE 469 CO 0.85 -0.74 1.95 1.63 -1.46 0.00 0.00 175.22 177.46 3h0r n LYS 470 N 5.12 3.39 0.17 10.12 5.02 -1.13 -4.20 118.16 136.66 3h0r n LYS 470 Ca -0.06 -3.28 0.13 0.00 -2.02 0.00 0.00 58.31 53.08 3h0r n LYS 470 Cb 0.44 -3.04 0.57 0.00 -0.02 0.00 0.00 35.03 32.98 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 5.91 0.00 0.00 2.13 2.07 -1.92 -2.61 115.15 120.74 3h0r h HIS 471 Ca 0.44 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.96 3h0r h HIS 471 Cb 0.65 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.63 3h0r h HIS 471 CO 1.31 0.00 0.00 2.48 -3.07 0.00 0.00 177.93 178.65 3h0r n TYR 472 N -2.41 0.00 0.08 6.12 0.18 -1.26 -2.33 117.16 117.53 3h0r n TYR 472 Ca 0.01 0.00 0.07 0.00 1.88 0.00 0.00 57.90 59.87 3h0r n TYR 472 Cb 0.20 -0.46 -0.03 0.00 -0.38 0.00 0.00 39.34 38.67 3h0r n TYR 472 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 3h0r n GLU 473 N -1.46 0.61 -2.37 -3.48 1.02 -0.98 -4.78 120.64 109.20 3h0r n GLU 473 Ca 0.05 0.16 -0.41 0.00 -0.02 0.00 0.00 57.16 56.95 3h0r n GLU 473 Cb 0.21 -1.82 -0.03 0.00 -0.02 0.00 0.00 31.44 29.78 3h0r n GLU 473 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3h0r s LYS 474 N -3.21 3.10 -0.20 3.49 -0.14 -0.99 -4.98 119.74 116.82 3h0r s LYS 474 Ca -0.01 0.23 -0.01 0.00 -1.36 0.00 0.00 55.97 54.82 3h0r s LYS 474 Cb 0.09 -4.21 0.01 0.00 -1.68 0.00 0.00 37.83 32.04 3h0r s LYS 474 CO 0.80 -2.20 -0.12 0.42 -0.76 0.00 0.00 175.35 173.48 3h0r s ILE 475 N 6.64 2.68 0.70 2.17 1.01 -1.26 -5.06 121.20 128.09 3h0r s ILE 475 Ca 0.49 -0.74 -0.07 0.00 0.00 0.00 0.00 60.65 60.34 3h0r s ILE 475 Cb -0.10 -2.18 0.06 0.00 0.01 0.00 0.00 42.46 40.24 3h0r s ILE 475 CO 0.20 0.48 1.02 -2.16 0.00 0.00 0.00 174.94 174.48 3h0r s PRO 476 N 1.38 2.24 -1.16 2.79 0.04 -1.26 -4.23 135.00 134.80 3h0r s PRO 476 Ca 0.05 -0.21 -0.26 0.00 0.04 0.00 0.00 61.00 60.62 3h0r s PRO 476 Cb -0.14 -2.16 0.01 0.00 0.04 0.00 0.00 34.50 32.26 3h0r s PRO 476 CO -0.08 -1.22 0.74 1.28 0.04 0.00 0.00 177.00 177.76 3h0r n LEU 477 N -2.92 -1.76 0.00 -3.56 4.77 -1.26 -4.79 117.00 107.48 3h0r n LEU 477 Ca 0.08 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 3h0r n LEU 477 Cb 0.60 -2.05 0.00 0.00 -2.33 0.00 0.00 43.42 39.64 3h0r n LEU 477 CO 0.52 0.60 0.00 0.35 -1.33 0.00 0.00 177.39 177.54