#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3nam n GLU 2 N 0.00 0.00 -0.53 3.17 0.28 -1.24 -4.96 120.64 117.36 3nam n GLU 2 Ca 0.00 0.00 -0.23 0.00 -0.16 0.00 0.00 57.16 56.77 3nam n GLU 2 Cb 0.00 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 32.83 3nam n GLU 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3nam n ALA 3 N -0.91 2.51 0.26 -1.84 0.00 -1.26 -4.64 120.51 114.62 3nam n ALA 3 Ca 0.00 -1.70 0.15 0.00 0.00 0.00 0.00 53.44 51.89 3nam n ALA 3 Cb 0.00 -3.09 0.77 0.00 0.00 0.00 0.00 19.45 17.13 3nam n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3nam h ALA 4 N 7.84 1.00 0.00 0.00 0.00 -1.96 -3.11 119.26 123.03 3nam h ALA 4 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3nam h ALA 4 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3nam h ALA 4 CO 1.50 0.00 0.00 -2.39 0.00 0.00 0.00 179.25 178.36 3nam n HIS 5 N -2.57 0.54 0.03 0.00 1.44 -1.26 -2.92 115.22 110.48 3nam n HIS 5 Ca -0.01 0.25 0.02 0.00 -2.01 0.00 0.00 57.72 55.97 3nam n HIS 5 Cb 0.10 -0.90 -0.03 0.00 0.12 0.00 0.00 29.99 29.27 3nam n HIS 5 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 3nam n SER 6 N -2.03 3.33 0.00 4.39 3.41 -1.17 -2.01 113.62 119.55 3nam n SER 6 Ca 0.00 -0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 3nam n SER 6 Cb 0.09 1.17 0.00 0.00 -0.26 0.00 0.00 64.21 65.21 3nam n SER 6 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3nam n LYS 7 N -1.56 0.00 0.00 4.33 4.76 -1.15 -4.55 118.16 120.00 3nam n LYS 7 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 3nam n LYS 7 Cb 0.11 -0.13 0.00 0.00 -1.84 0.00 0.00 35.03 33.16 3nam n LYS 7 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 3nam n SER 8 N 0.00 0.00 0.00 4.39 3.41 -1.26 -4.79 113.62 115.37 3nam n SER 8 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3nam n SER 8 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3nam n SER 8 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3nam n THR 9 N 0.00 0.00 -0.13 6.66 -1.04 -1.26 -4.74 114.28 113.78 3nam n THR 9 Ca 0.00 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.83 3nam n THR 9 Cb 0.00 -0.50 -0.12 0.00 -1.82 0.00 0.00 70.33 67.89 3nam n THR 9 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 3nam n GLU 10 N -1.30 0.63 0.31 -2.82 0.00 -1.26 -3.84 120.64 112.36 3nam n GLU 10 Ca 0.00 0.15 0.14 0.00 0.00 0.00 0.00 57.16 57.45 3nam n GLU 10 Cb 0.26 -1.50 0.77 0.00 0.00 0.00 0.00 31.44 30.97 3nam n GLU 10 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 3nam h GLU 11 N -0.02 0.00 0.15 3.44 5.08 -1.90 0.28 114.58 121.60 3nam h GLU 11 Ca -0.56 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 57.44 3nam h GLU 11 Cb 1.86 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.11 3nam h GLU 11 CO -0.10 0.00 -1.89 0.00 -1.00 0.00 0.00 179.01 176.03 3nam h LEU 13 N 0.06 0.54 0.04 0.00 3.38 -0.96 -3.05 115.31 115.32 3nam h LEU 13 Ca -0.39 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.38 3nam h LEU 13 Cb 2.04 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.65 3nam h LEU 13 CO 0.12 0.81 -0.02 0.00 0.09 0.00 0.00 178.44 179.44 3nam h ALA 14 N 1.23 -0.05 -0.93 1.53 0.00 -0.72 0.37 119.26 120.68 3nam h ALA 14 Ca 0.06 -0.29 0.27 0.00 0.00 0.00 0.00 54.91 54.95 3nam h ALA 14 Cb 0.75 0.02 -0.16 0.00 0.00 0.00 0.00 17.79 18.39 3nam h ALA 14 CO 0.06 -0.22 0.20 -0.92 0.00 0.00 0.00 179.25 178.37 3nam h TYR 15 N -0.66 0.27 0.00 0.00 3.20 -1.38 0.51 116.97 118.90 3nam h TYR 15 Ca -0.01 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3nam h TYR 15 Cb 0.59 0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.90 3nam h TYR 15 CO 0.13 -0.33 -1.06 1.19 -1.64 0.00 0.00 178.16 176.44 3nam n PHE 16 N -5.33 0.38 -2.86 -3.82 3.72 -1.16 -5.00 117.46 103.39 3nam n PHE 16 Ca 0.24 0.11 -0.07 0.00 -0.05 0.00 0.00 57.45 57.69 3nam n PHE 16 Cb 0.79 -0.54 0.03 0.00 -0.94 0.00 0.00 39.48 38.82 3nam n PHE 16 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3nam n GLY 17 N 1.33 -0.92 3.02 1.37 0.00 0.18 -5.05 105.19 105.11 3nam n GLY 17 Ca 0.01 0.39 -0.13 0.00 0.00 0.00 0.00 46.02 46.29 3nam n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3nam s VAL 18 N -3.17 0.44 -0.12 1.61 0.11 -0.08 -5.02 120.40 114.17 3nam s VAL 18 Ca 0.21 -0.77 -0.15 0.00 -2.93 0.00 0.00 61.98 58.34 3nam s VAL 18 Cb -0.03 -0.47 -0.05 0.00 -1.53 0.00 0.00 36.38 34.30 3nam s VAL 18 CO 0.61 -0.23 0.35 -0.94 -3.33 0.00 0.00 175.10 171.56 3nam s SER 19 N -1.08 6.56 0.30 3.54 1.04 -1.25 -4.67 113.70 118.14 3nam s SER 19 Ca -0.07 0.66 0.23 0.00 0.48 0.00 0.00 55.95 57.25 3nam s SER 19 Cb -0.07 -2.21 1.11 0.00 0.10 0.00 0.00 66.02 64.94 3nam s SER 19 CO 0.00 0.13 1.69 1.21 0.98 0.00 0.00 173.24 177.24 3nam n GLU 20 N 3.23 0.16 -0.00 4.02 2.13 -1.26 -0.27 120.64 128.65 3nam n GLU 20 Ca -0.11 0.56 0.06 0.00 0.66 0.00 0.00 57.16 58.32 3nam n GLU 20 Cb 0.52 -1.93 -0.08 0.00 0.27 0.00 0.00 31.44 30.22 3nam n GLU 20 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 3nam n THR 21 N -2.26 0.00 -0.07 6.31 -2.24 -1.26 -4.74 114.28 110.02 3nam n THR 21 Ca -0.00 -0.25 -0.14 0.00 -2.27 0.00 0.00 64.05 61.38 3nam n THR 21 Cb 0.11 0.59 -0.05 0.00 -2.10 0.00 0.00 70.33 68.88 3nam n THR 21 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3nam n THR 22 N -1.61 0.75 0.00 4.28 -1.04 -0.91 -5.05 114.28 110.69 3nam n THR 22 Ca -0.00 -0.19 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 3nam n THR 22 Cb 0.25 -1.65 0.00 0.00 -1.82 0.00 0.00 70.33 67.10 3nam n THR 22 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3nam n GLY 23 N 2.18 -1.30 3.85 3.41 0.00 0.63 -2.31 105.19 111.64 3nam n GLY 23 Ca -0.27 -2.09 -0.32 0.00 0.00 0.00 0.00 46.02 43.34 3nam n GLY 23 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3nam s LEU 24 N 0.00 3.98 0.44 0.99 1.43 -1.24 -3.79 118.68 120.48 3nam s LEU 24 Ca 0.00 1.31 -0.04 0.00 -1.03 0.00 0.00 54.13 54.37 3nam s LEU 24 Cb 0.00 -4.14 -0.04 0.00 0.03 0.00 0.00 46.19 42.05 3nam s LEU 24 CO 0.00 -0.28 0.72 0.42 0.23 0.00 0.00 176.35 177.44 3nam s THR 25 N -2.11 4.96 0.34 5.49 -4.23 -1.26 0.52 115.64 119.34 3nam s THR 25 Ca 0.55 0.04 0.11 0.00 -1.18 0.00 0.00 61.69 61.20 3nam s THR 25 Cb -0.10 -3.86 0.33 0.00 1.34 0.00 0.00 72.50 70.22 3nam s THR 25 CO 0.20 -0.75 1.78 1.55 -0.54 0.00 0.00 174.62 176.87 3nam h PRO 26 N 0.44 0.58 -0.39 3.99 0.13 -1.98 0.40 132.00 135.18 3nam h PRO 26 Ca -0.48 -0.04 -0.15 0.00 -0.87 0.00 0.00 66.00 64.47 3nam h PRO 26 Cb 1.21 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 3nam h PRO 26 CO 0.62 0.39 -0.34 0.22 -0.23 0.00 0.00 178.00 178.66 3nam h ASP 27 N 0.60 0.94 -0.01 1.44 3.58 -2.00 -2.63 116.42 118.34 3nam h ASP 27 Ca 0.58 -0.41 -0.00 0.00 0.42 0.00 0.00 57.03 57.62 3nam h ASP 27 Cb 1.13 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.92 3nam h ASP 27 CO -0.35 1.18 0.00 1.56 -2.88 0.00 0.00 179.24 178.76 3nam h GLN 28 N 0.75 0.02 -0.98 0.28 4.20 -1.37 -2.57 115.11 115.43 3nam h GLN 28 Ca 0.07 -0.01 0.20 0.00 0.06 0.00 0.00 58.65 58.98 3nam h GLN 28 Cb 0.91 -0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.59 3nam h GLN 28 CO 0.08 0.23 0.62 0.28 -0.67 0.00 0.00 178.83 179.36 3nam h VAL 29 N -0.18 0.69 -0.15 -0.54 2.07 -1.05 0.68 116.25 117.76 3nam h VAL 29 Ca 0.00 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 3nam h VAL 29 Cb 0.21 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 29.95 3nam h VAL 29 CO -0.00 0.12 -0.03 0.50 0.02 0.00 0.00 177.57 178.18 3nam h LYS 30 N 0.66 0.29 -0.12 1.57 3.64 -1.21 -2.18 116.57 119.21 3nam h LYS 30 Ca 0.55 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.81 3nam h LYS 30 Cb 1.00 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.80 3nam h LYS 30 CO -0.32 0.57 0.02 0.00 -2.27 0.00 0.00 179.45 177.44 3nam h ARG 31 N -0.01 0.21 -0.91 1.90 3.08 -0.92 -2.83 114.38 114.90 3nam h ARG 31 Ca 0.04 -0.06 0.07 0.00 0.07 0.00 0.00 59.98 60.10 3nam h ARG 31 Cb 0.46 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.42 3nam h ARG 31 CO 0.01 0.41 0.57 0.45 -1.07 0.00 0.00 179.97 180.34 3nam h HIS 32 N -0.03 1.05 -0.13 3.04 3.86 -0.93 -1.54 115.15 120.48 3nam h HIS 32 Ca 0.04 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.22 3nam h HIS 32 Cb 0.31 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 3nam h HIS 32 CO 0.02 0.51 -0.18 1.25 0.86 0.00 0.00 177.93 180.39 3nam h LEU 33 N 1.01 0.20 -0.25 2.43 5.85 -1.37 0.11 115.31 123.27 3nam h LEU 33 Ca 0.41 -0.05 -0.20 0.00 0.84 0.00 0.00 57.88 58.88 3nam h LEU 33 Cb 0.23 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3nam h LEU 33 CO -0.19 0.39 -0.90 -0.08 -0.34 0.00 0.00 178.44 177.32 3nam h GLU 34 N 0.19 0.17 0.01 1.25 4.57 -1.06 0.41 114.58 120.13 3nam h GLU 34 Ca 0.04 -0.20 -0.28 0.00 -1.18 0.00 0.00 59.36 57.74 3nam h GLU 34 Cb 0.44 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.04 3nam h GLU 34 CO 0.03 0.96 -1.56 -0.22 -1.18 0.00 0.00 179.01 177.04 3nam h LYS 35 N 0.09 0.02 0.00 1.92 3.64 -0.95 -3.39 116.57 117.91 3nam h LYS 35 Ca -0.04 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3nam h LYS 35 Cb 1.54 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.37 3nam h LYS 35 CO 0.13 0.64 -1.11 0.66 -2.27 0.00 0.00 179.45 177.51 3nam n TYR 36 N -3.14 0.00 -2.38 1.91 4.01 0.35 -5.10 117.16 112.82 3nam n TYR 36 Ca -0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 3nam n TYR 36 Cb 1.03 -0.14 -0.00 0.00 -0.31 0.00 0.00 39.34 39.91 3nam n TYR 36 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3nam n GLY 37 N 1.75 -2.17 3.84 2.72 0.00 0.14 -4.91 105.19 106.55 3nam n GLY 37 Ca -0.01 -1.47 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 3nam n GLY 37 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3nam s HIS 38 N -0.41 3.31 -1.33 1.61 3.76 -1.26 -4.70 115.29 116.28 3nam s HIS 38 Ca 0.00 1.33 -0.12 0.00 -0.15 0.00 0.00 55.06 56.11 3nam s HIS 38 Cb 0.00 -2.85 0.12 0.00 1.11 0.00 0.00 32.58 30.96 3nam s HIS 38 CO 0.00 -1.05 1.91 -1.71 -0.85 0.00 0.00 174.74 173.04 3nam n ASN 39 N -2.99 4.72 -4.09 1.40 5.15 -0.19 -4.34 115.26 114.90 3nam n ASN 39 Ca 0.07 -2.99 -0.10 0.00 -0.60 0.00 0.00 54.58 50.95 3nam n ASN 39 Cb 0.54 -1.57 -0.08 0.00 -0.53 0.00 0.00 39.78 38.13 3nam n ASN 39 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3nam s GLU 40 N 1.80 1.23 -0.20 1.20 2.02 -1.26 -4.20 118.70 119.29 3nam s GLU 40 Ca 0.44 -1.41 -0.09 0.00 0.02 0.00 0.00 54.97 53.93 3nam s GLU 40 Cb 0.09 0.33 -0.04 0.00 0.10 0.00 0.00 34.13 34.61 3nam s GLU 40 CO -0.02 -0.43 0.10 -0.51 0.02 0.00 0.00 175.26 174.42 3nam s LEU 41 N -3.07 3.99 0.81 1.80 1.43 -1.26 -3.71 118.68 118.66 3nam s LEU 41 Ca 0.28 0.13 -0.16 0.00 -1.03 0.00 0.00 54.13 53.36 3nam s LEU 41 Cb 0.05 -2.03 -0.13 0.00 0.03 0.00 0.00 46.19 44.11 3nam s LEU 41 CO 0.07 0.16 -0.79 -2.65 0.23 0.00 0.00 176.35 173.37 3nam n PRO 42 N 3.65 0.00 0.00 1.29 -0.02 -1.26 -4.99 135.00 133.67 3nam n PRO 42 Ca -0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 3nam n PRO 42 Cb 0.52 -0.81 0.00 0.00 -0.02 0.00 0.00 33.50 33.19 3nam n PRO 42 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3nam n ALA 43 N -2.20 0.00 -2.65 3.55 0.00 -1.26 -5.09 120.51 112.86 3nam n ALA 43 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.12 3nam n ALA 43 Cb 0.49 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.86 3nam n ALA 43 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3nam s GLU 44 N -0.77 2.09 -0.60 0.00 8.01 -1.26 -5.08 118.70 121.09 3nam s GLU 44 Ca 0.00 -2.32 -0.27 0.00 0.01 0.00 0.00 54.97 52.39 3nam s GLU 44 Cb 0.00 -1.09 -0.02 0.00 -4.31 0.00 0.00 34.13 28.71 3nam s GLU 44 CO 0.00 -0.44 1.87 -1.83 0.01 0.00 0.00 175.26 174.87 3nam s GLU 45 N -3.79 2.64 0.00 1.61 -1.05 -1.26 -4.84 118.70 112.01 3nam s GLU 45 Ca 0.13 0.64 0.00 0.00 -0.15 0.00 0.00 54.97 55.59 3nam s GLU 45 Cb 0.01 -4.39 0.00 0.00 -0.44 0.00 0.00 34.13 29.32 3nam s GLU 45 CO 0.08 -2.72 0.74 0.41 0.95 0.00 0.00 175.26 174.73 3nam n GLY 46 N 5.70 1.23 3.64 -3.83 0.00 -1.26 -4.84 105.19 105.82 3nam n GLY 46 Ca 0.21 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.77 3nam n GLY 46 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3nam n LYS 47 N 1.34 2.24 -3.06 1.61 4.81 -1.26 -4.94 118.16 118.91 3nam n LYS 47 Ca 0.00 0.77 -0.26 0.00 -0.87 0.00 0.00 58.31 57.96 3nam n LYS 47 Cb 0.24 -2.87 -0.01 0.00 0.02 0.00 0.00 35.03 32.41 3nam n LYS 47 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3nam s SER 48 N 5.43 6.30 0.52 3.14 0.15 -1.26 -4.95 113.70 123.04 3nam s SER 48 Ca 0.95 0.68 0.22 0.00 0.70 0.00 0.00 55.95 58.50 3nam s SER 48 Cb -0.55 -2.13 1.41 0.00 -1.71 0.00 0.00 66.02 63.03 3nam s SER 48 CO 0.45 -0.40 2.12 0.25 1.20 0.00 0.00 173.24 176.86 3nam h LEU 49 N 0.62 0.00 -0.37 3.45 5.85 -1.99 0.09 115.31 122.96 3nam h LEU 49 Ca -0.48 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.05 3nam h LEU 49 Cb 1.21 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 3nam h LEU 49 CO 0.62 0.08 -0.74 -0.25 -0.34 0.00 0.00 178.44 177.80 3nam h TRP 50 N 0.00 0.61 0.07 1.25 -0.00 -2.00 -2.97 115.95 112.91 3nam h TRP 50 Ca -0.00 -0.27 -0.24 0.00 -0.00 0.00 0.00 58.89 58.37 3nam h TRP 50 Cb 0.16 -0.09 -0.01 0.00 -0.00 0.00 0.00 29.16 29.22 3nam h TRP 50 CO 0.00 1.04 -1.13 0.93 -0.00 0.00 0.00 178.44 179.28 3nam h GLU 51 N 0.31 0.15 -0.46 2.65 5.08 -1.76 -2.72 114.58 117.83 3nam h GLU 51 Ca -0.03 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.06 3nam h GLU 51 Cb 1.32 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.65 3nam h GLU 51 CO 0.13 1.12 0.22 1.25 -1.00 0.00 0.00 179.01 180.73 3nam h LEU 52 N 0.04 0.59 -0.64 1.33 6.46 -1.03 0.15 115.31 122.22 3nam h LEU 52 Ca -0.08 -0.12 -0.15 0.00 -0.12 0.00 0.00 57.88 57.41 3nam h LEU 52 Cb 1.88 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 41.65 3nam h LEU 52 CO 0.17 0.55 -0.61 -0.37 -0.62 0.00 0.00 178.44 177.56 3nam h VAL 53 N 0.59 1.38 -0.33 1.05 -1.51 -1.60 -2.58 116.25 113.26 3nam h VAL 53 Ca 0.16 -1.98 -0.10 0.00 -1.23 0.00 0.00 66.70 63.54 3nam h VAL 53 Cb 0.11 2.00 -0.01 0.00 -2.13 0.00 0.00 31.29 31.25 3nam h VAL 53 CO -0.02 0.59 -0.22 0.40 -1.23 0.00 0.00 177.57 177.09 3nam h ILE 54 N 0.19 1.27 -0.65 7.19 1.08 -1.12 -1.25 117.51 124.21 3nam h ILE 54 Ca -0.01 -1.27 0.07 0.00 -0.39 0.00 0.00 64.86 63.26 3nam h ILE 54 Cb 1.12 1.25 -0.04 0.00 -3.07 0.00 0.00 36.82 36.08 3nam h ILE 54 CO 0.10 0.41 0.43 -0.33 -0.69 0.00 0.00 178.15 178.07 3nam h GLU 55 N 0.55 0.62 -0.67 2.37 5.08 -0.32 -1.27 114.58 120.95 3nam h GLU 55 Ca 0.08 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 3nam h GLU 55 Cb 0.67 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 3nam h GLU 55 CO 0.05 0.41 0.44 1.96 -1.00 0.00 0.00 179.01 180.87 3nam h GLN 56 N 0.64 0.79 -1.06 2.33 1.08 -0.94 -2.96 115.11 115.00 3nam h GLN 56 Ca 0.28 -0.05 -0.68 0.00 -1.45 0.00 0.00 58.65 56.76 3nam h GLN 56 Cb 0.29 -0.18 -0.30 0.00 -0.05 0.00 0.00 27.48 27.24 3nam h GLN 56 CO -0.09 0.53 0.75 1.19 -0.95 0.00 0.00 178.83 180.25 3nam n PHE 57 N -4.45 3.18 0.03 2.96 3.72 -0.48 -4.27 117.46 118.15 3nam n PHE 57 Ca 0.08 -2.92 0.00 0.00 -0.05 0.00 0.00 57.45 54.56 3nam n PHE 57 Cb 0.11 -1.34 -0.01 0.00 -0.94 0.00 0.00 39.48 37.30 3nam n PHE 57 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3nam n GLU 58 N -0.87 5.46 -1.64 -1.08 -0.58 -1.12 -4.74 120.64 116.08 3nam n GLU 58 Ca 0.61 -0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 57.00 3nam n GLU 58 Cb 0.65 -0.63 0.07 0.00 -0.57 0.00 0.00 31.44 30.96 3nam n GLU 58 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3nam s ASP 59 N -1.27 4.67 0.03 1.62 -1.08 -1.26 -4.91 116.67 114.47 3nam s ASP 59 Ca 0.00 2.23 -0.20 0.00 -0.52 0.00 0.00 52.55 54.06 3nam s ASP 59 Cb 0.01 -2.58 -0.16 0.00 -1.46 0.00 0.00 42.92 38.73 3nam s ASP 59 CO 0.04 -1.93 1.28 0.25 0.52 0.00 0.00 175.17 175.32 3nam h LEU 60 N 0.00 0.41 -1.27 -1.34 5.85 -1.95 -2.34 115.31 114.67 3nam h LEU 60 Ca -0.48 -0.55 -0.07 0.00 0.84 0.00 0.00 57.88 57.62 3nam h LEU 60 Cb 1.28 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 3nam h LEU 60 CO 0.52 0.89 -0.33 -0.07 -0.34 0.00 0.00 178.44 179.11 3nam h LEU 61 N -0.05 0.00 -0.03 2.25 3.38 -1.91 -0.29 115.31 118.66 3nam h LEU 61 Ca 0.01 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 3nam h LEU 61 Cb 0.82 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 3nam h LEU 61 CO 0.05 0.33 -0.96 1.62 0.09 0.00 0.00 178.44 179.58 3nam h VAL 62 N 0.00 1.66 0.01 1.22 3.04 -1.91 -2.97 116.25 117.30 3nam h VAL 62 Ca -0.00 -3.31 -0.00 0.00 -1.01 0.00 0.00 66.70 62.38 3nam h VAL 62 Cb 0.68 2.80 0.00 0.00 -2.01 0.00 0.00 31.29 32.76 3nam h VAL 62 CO 0.04 0.94 -0.00 0.03 -1.01 0.00 0.00 177.57 177.57 3nam h ARG 63 N 0.00 -0.01 -1.03 4.17 3.08 -1.09 -2.57 114.38 116.94 3nam h ARG 63 Ca -0.01 0.00 0.26 0.00 0.07 0.00 0.00 59.98 60.30 3nam h ARG 63 Cb 1.72 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 31.66 3nam h ARG 63 CO 0.12 0.64 0.64 0.82 -1.07 0.00 0.00 179.97 181.12 3nam h ILE 64 N -0.66 0.52 -0.18 2.04 2.04 -1.12 0.28 117.51 120.44 3nam h ILE 64 Ca -0.00 -0.17 -0.19 0.00 1.00 0.00 0.00 64.86 65.51 3nam h ILE 64 Cb 0.64 -0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.72 3nam h ILE 64 CO 0.00 0.09 -0.65 -0.07 0.00 0.00 0.00 178.15 177.52 3nam h LEU 65 N 0.48 0.75 -1.36 1.44 3.38 -1.50 -2.96 115.31 115.54 3nam h LEU 65 Ca 0.62 -0.44 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 3nam h LEU 65 Cb 1.39 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 3nam h LEU 65 CO -0.39 1.20 0.04 0.25 0.09 0.00 0.00 178.44 179.63 3nam h LEU 66 N 0.48 0.42 -0.06 1.67 5.85 -0.08 0.18 115.31 123.77 3nam h LEU 66 Ca -0.01 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 3nam h LEU 66 Cb 1.23 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.15 3nam h LEU 66 CO 0.13 0.46 -0.04 0.25 -0.34 0.00 0.00 178.44 178.90 3nam h LEU 67 N 0.45 0.14 -0.96 2.25 5.85 -1.25 -2.97 115.31 118.82 3nam h LEU 67 Ca 0.10 -0.44 0.01 0.00 0.84 0.00 0.00 57.88 58.39 3nam h LEU 67 Cb 0.24 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 3nam h LEU 67 CO 0.00 0.55 0.62 0.00 -0.34 0.00 0.00 178.44 179.27 3nam h ALA 68 N 0.59 1.21 0.00 1.25 0.00 -1.25 -0.62 119.26 120.44 3nam h ALA 68 Ca 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3nam h ALA 68 Cb 0.50 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 3nam h ALA 68 CO 0.01 0.62 -0.04 0.00 0.00 0.00 0.00 179.25 179.84 3nam h ALA 69 N 1.34 1.16 0.00 0.00 0.00 -0.66 0.72 119.26 121.82 3nam h ALA 69 Ca 0.35 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 3nam h ALA 69 Cb -0.13 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3nam h ALA 69 CO -0.07 0.05 -0.29 0.00 0.00 0.00 0.00 179.25 178.94 3nam h ILE 71 N -1.00 1.03 0.00 0.00 2.04 -0.99 -0.10 117.51 118.49 3nam h ILE 71 Ca -0.08 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.36 3nam h ILE 71 Cb 0.92 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 3nam h ILE 71 CO -0.05 0.19 -0.31 -1.28 0.00 0.00 0.00 178.15 176.71 3nam h SER 72 N 1.05 0.00 0.97 1.72 0.87 -0.97 -2.12 113.55 115.07 3nam h SER 72 Ca 0.42 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.78 3nam h SER 72 Cb 0.24 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.17 3nam h SER 72 CO -0.19 0.31 -0.97 0.15 -0.53 0.00 0.00 176.83 175.59 3nam h PHE 73 N 0.00 0.01 0.12 2.24 3.57 -0.61 -1.72 116.94 120.55 3nam h PHE 73 Ca -0.00 -0.00 -0.30 0.00 3.53 0.00 0.00 57.97 61.20 3nam h PHE 73 Cb 0.73 -0.00 0.03 0.00 2.79 0.00 0.00 35.95 39.50 3nam h PHE 73 CO 0.00 0.98 -1.24 0.28 -2.23 0.00 0.00 178.31 176.09 3nam h VAL 74 N 0.00 1.30 0.66 1.41 2.07 -0.95 -3.18 116.25 117.56 3nam h VAL 74 Ca -0.01 -2.51 -0.03 0.00 0.82 0.00 0.00 66.70 64.97 3nam h VAL 74 Cb 1.72 2.71 0.01 0.00 -1.52 0.00 0.00 31.29 34.21 3nam h VAL 74 CO 0.13 0.76 -0.32 -0.07 0.02 0.00 0.00 177.57 178.09 3nam h LEU 75 N 0.26 -0.75 -1.48 2.57 3.38 -1.43 -2.93 115.31 114.93 3nam h LEU 75 Ca -0.18 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3nam h LEU 75 Cb 1.92 0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.86 3nam h LEU 75 CO 0.23 -0.38 0.00 0.00 0.09 0.00 0.00 178.44 178.39 3nam n ALA 76 N -2.69 1.67 -2.00 1.53 0.00 -0.65 -4.06 120.51 114.32 3nam n ALA 76 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 3nam n ALA 76 Cb 0.35 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.80 3nam n ALA 76 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 3nam n TRP 77 N 0.57 0.00 0.00 0.00 -0.00 -1.11 -3.31 117.44 113.59 3nam n TRP 77 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 3nam n TRP 77 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.44 3nam n TRP 77 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 3nam n PHE 78 N 0.00 0.00 -1.54 5.87 7.35 -1.18 -4.34 117.46 123.62 3nam n PHE 78 Ca 0.00 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.36 3nam n PHE 78 Cb 0.00 0.00 -0.07 0.00 0.35 0.00 0.00 39.48 39.76 3nam n PHE 78 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 3nam n GLU 79 N 0.00 0.73 0.00 -4.13 4.71 -1.26 -3.87 120.64 116.81 3nam n GLU 79 Ca 0.00 -0.12 0.00 0.00 -0.01 0.00 0.00 57.16 57.03 3nam n GLU 79 Cb 0.00 -3.01 0.00 0.00 -1.01 0.00 0.00 31.44 27.42 3nam n GLU 79 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 3nam n GLU 80 N 8.73 0.00 -4.11 3.49 0.00 -1.26 -4.62 120.64 122.87 3nam n GLU 80 Ca 0.45 0.00 -0.20 0.00 0.00 0.00 0.00 57.16 57.41 3nam n GLU 80 Cb 0.41 0.00 -0.16 0.00 0.00 0.00 0.00 31.44 31.69 3nam n GLU 80 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 3nam s GLY 81 N 0.00 0.45 0.52 8.31 0.00 -1.25 -4.59 107.32 110.76 3nam s GLY 81 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.66 3nam s GLY 81 CO 0.00 0.52 0.00 -2.21 0.00 0.00 0.00 173.10 171.41 3nam n GLU 82 N 4.17 -3.94 -0.00 2.90 4.07 -1.26 -4.75 120.64 121.84 3nam n GLU 82 Ca -0.23 3.01 0.00 0.00 -0.06 0.00 0.00 57.16 59.88 3nam n GLU 82 Cb 0.51 -3.61 0.00 0.00 -0.06 0.00 0.00 31.44 28.27 3nam n GLU 82 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 3nam n GLU 83 N -1.91 0.00 -3.64 5.31 0.28 -1.26 -4.97 120.64 114.45 3nam n GLU 83 Ca 0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 57.16 56.94 3nam n GLU 83 Cb 0.27 -0.60 -0.07 0.00 1.43 0.00 0.00 31.44 32.48 3nam n GLU 83 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 3nam s THR 84 N -2.40 -0.05 -1.01 3.84 -4.23 -1.26 -5.02 115.64 105.51 3nam s THR 84 Ca 0.00 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 60.60 3nam s THR 84 Cb 0.00 -1.00 0.04 0.00 1.34 0.00 0.00 72.50 72.88 3nam s THR 84 CO 0.00 0.00 0.71 2.30 -0.54 0.00 0.00 174.62 177.09 3nam n ILE 85 N 4.35 0.00 0.50 2.99 -5.35 -1.26 -4.48 119.36 116.10 3nam n ILE 85 Ca -0.19 -0.46 0.12 0.00 -0.27 0.00 0.00 62.75 61.94 3nam n ILE 85 Cb 0.58 1.16 0.26 0.00 -1.74 0.00 0.00 39.64 39.90 3nam n ILE 85 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 3nam h THR 86 N 1.48 0.00 -2.20 7.28 2.02 -1.97 -3.46 112.91 116.06 3nam h THR 86 Ca 0.00 -0.61 -0.62 0.00 0.77 0.00 0.00 66.41 65.95 3nam h THR 86 Cb 0.35 1.44 0.11 0.00 -1.74 0.00 0.00 68.15 68.31 3nam h THR 86 CO 0.00 0.00 -0.04 0.00 0.37 0.00 0.00 175.52 175.85 3nam n ALA 87 N -1.88 -0.83 0.00 6.16 0.00 -1.26 -0.17 120.51 122.53 3nam n ALA 87 Ca 0.04 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.86 3nam n ALA 87 Cb 0.46 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 17.99 3nam n ALA 87 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3nam n PHE 88 N 0.06 0.00 -0.29 0.00 3.72 -1.21 -4.88 117.46 114.87 3nam n PHE 88 Ca 0.11 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.46 3nam n PHE 88 Cb 0.31 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.92 3nam n PHE 88 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3nam h VAL 89 N 0.00 1.26 0.08 -4.37 2.07 -0.91 0.65 116.25 115.03 3nam h VAL 89 Ca 0.00 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.67 3nam h VAL 89 Cb 0.00 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 3nam h VAL 89 CO 0.00 0.34 -0.04 -0.08 0.02 0.00 0.00 177.57 177.82 3nam h GLU 90 N 1.16 -0.10 -0.37 1.57 4.81 -1.90 -1.71 114.58 118.04 3nam h GLU 90 Ca 0.26 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.43 3nam h GLU 90 Cb 0.23 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 3nam h GLU 90 CO -0.02 0.17 -0.06 -1.35 -0.73 0.00 0.00 179.01 177.02 3nam h PRO 91 N -0.36 0.61 -0.35 0.92 0.11 -1.79 -2.86 132.00 128.28 3nam h PRO 91 Ca -0.01 -0.16 -0.05 0.00 0.11 0.00 0.00 66.00 65.89 3nam h PRO 91 Cb 0.31 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 3nam h PRO 91 CO 0.02 0.68 0.03 0.35 -0.21 0.00 0.00 178.00 178.87 3nam h PHE 92 N 0.57 0.63 -0.59 0.65 3.57 -0.81 -2.10 116.94 118.86 3nam h PHE 92 Ca 0.11 -0.10 -0.09 0.00 3.53 0.00 0.00 57.97 61.43 3nam h PHE 92 Cb 0.46 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 3nam h PHE 92 CO 0.02 0.67 0.03 0.28 -2.23 0.00 0.00 178.31 177.08 3nam h VAL 93 N 0.41 1.26 -0.38 1.41 2.07 -1.26 -1.95 116.25 117.82 3nam h VAL 93 Ca 0.10 -1.09 -0.08 0.00 0.82 0.00 0.00 66.70 66.45 3nam h VAL 93 Cb 0.39 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 3nam h VAL 93 CO 0.01 0.40 -0.10 0.40 0.02 0.00 0.00 177.57 178.30 3nam h ILE 94 N 0.91 1.24 -0.43 4.57 2.04 -1.48 -2.19 117.51 122.17 3nam h ILE 94 Ca 0.17 -1.07 -0.11 0.00 1.00 0.00 0.00 64.86 64.85 3nam h ILE 94 Cb 0.51 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 3nam h ILE 94 CO 0.02 0.36 -0.19 -0.07 0.00 0.00 0.00 178.15 178.28 3nam h LEU 95 N 0.60 0.84 0.06 1.44 3.38 -1.15 -2.36 115.31 118.11 3nam h LEU 95 Ca 0.11 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 3nam h LEU 95 Cb 0.52 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3nam h LEU 95 CO 0.03 1.01 -0.03 -0.07 0.09 0.00 0.00 178.44 179.47 3nam h LEU 96 N 0.73 -0.07 -1.72 1.67 3.38 -1.07 0.16 115.31 118.39 3nam h LEU 96 Ca 0.11 -0.09 0.15 0.00 0.09 0.00 0.00 57.88 58.14 3nam h LEU 96 Cb 0.71 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 3nam h LEU 96 CO 0.05 0.05 0.47 0.40 0.09 0.00 0.00 178.44 179.50 3nam h ILE 97 N -0.18 0.78 0.00 1.22 1.08 -1.32 0.34 117.51 119.43 3nam h ILE 97 Ca -0.01 -0.10 0.00 0.00 -0.39 0.00 0.00 64.86 64.37 3nam h ILE 97 Cb 0.15 0.47 0.00 0.00 -3.07 0.00 0.00 36.82 34.38 3nam h ILE 97 CO 0.01 0.05 -0.01 -0.07 -0.69 0.00 0.00 178.15 177.44 3nam h LEU 98 N 0.28 0.00 -0.76 1.44 3.38 -0.84 -2.33 115.31 116.48 3nam h LEU 98 Ca 0.33 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.43 3nam h LEU 98 Cb 0.91 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.57 3nam h LEU 98 CO -0.08 0.09 0.34 0.16 0.09 0.00 0.00 178.44 179.04 3nam h ILE 99 N -0.17 0.72 -0.46 1.22 3.07 -0.73 0.43 117.51 121.58 3nam h ILE 99 Ca 0.00 -0.18 -0.04 0.00 1.55 0.00 0.00 64.86 66.19 3nam h ILE 99 Cb 0.01 0.16 -0.02 0.00 -0.27 0.00 0.00 36.82 36.70 3nam h ILE 99 CO 0.00 0.09 0.13 0.00 -1.05 0.00 0.00 178.15 177.32 3nam h ALA 100 N 1.52 0.60 -0.78 0.16 0.00 -0.47 -2.48 119.26 117.81 3nam h ALA 100 Ca 0.40 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.15 3nam h ALA 100 Cb 0.56 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3nam h ALA 100 CO -0.36 0.27 0.52 -0.97 0.00 0.00 0.00 179.25 178.71 3nam h ASN 101 N 0.61 0.87 0.33 0.00 -1.24 -0.05 -1.83 115.58 114.26 3nam h ASN 101 Ca 0.15 -0.02 -0.04 0.00 0.71 0.00 0.00 56.30 57.10 3nam h ASN 101 Cb 0.29 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.12 3nam h ASN 101 CO -0.00 0.62 -0.19 0.00 -1.29 0.00 0.00 177.43 176.57 3nam h ALA 102 N 1.53 1.42 -0.40 1.57 0.00 0.11 -2.24 119.26 121.24 3nam h ALA 102 Ca 0.30 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3nam h ALA 102 Cb -0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3nam h ALA 102 CO -0.07 0.23 0.19 0.82 0.00 0.00 0.00 179.25 180.42 3nam h ILE 103 N 0.00 1.18 0.01 0.00 1.08 -0.93 -0.80 117.51 118.06 3nam h ILE 103 Ca -0.00 -0.51 0.02 0.00 -0.39 0.00 0.00 64.86 63.98 3nam h ILE 103 Cb 0.40 0.78 -0.06 0.00 -3.07 0.00 0.00 36.82 34.88 3nam h ILE 103 CO 0.02 0.19 -0.49 0.58 -0.69 0.00 0.00 178.15 177.76 3nam h VAL 104 N 0.51 0.06 -0.96 1.67 2.07 -1.37 0.10 116.25 118.32 3nam h VAL 104 Ca 0.14 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.84 3nam h VAL 104 Cb 0.13 0.06 -0.09 0.00 -1.52 0.00 0.00 31.29 29.87 3nam h VAL 104 CO -0.02 0.00 0.61 1.23 0.02 0.00 0.00 177.57 179.41 3nam h GLY 105 N -0.65 1.41 1.88 2.17 0.00 -1.29 0.17 103.07 106.77 3nam h GLY 105 Ca 0.02 -0.31 -0.20 0.00 0.00 0.00 0.00 47.33 46.85 3nam h GLY 105 CO -0.34 -0.00 -1.00 -0.24 0.00 0.00 0.00 176.54 174.96 3nam h VAL 106 N 0.67 1.49 0.04 4.60 3.04 -0.48 -2.93 116.25 122.68 3nam h VAL 106 Ca 0.52 -3.15 -0.07 0.00 -1.01 0.00 0.00 66.70 63.00 3nam h VAL 106 Cb 0.93 2.73 0.01 0.00 -2.01 0.00 0.00 31.29 32.95 3nam h VAL 106 CO -0.28 0.85 -0.28 -0.25 -1.01 0.00 0.00 177.57 176.59 3nam h TRP 107 N 0.00 0.20 -0.72 3.17 7.01 -0.23 -1.63 115.95 123.75 3nam h TRP 107 Ca -0.04 -0.14 0.16 0.00 2.11 0.00 0.00 58.89 60.98 3nam h TRP 107 Cb 1.73 -0.01 -0.11 0.00 -2.10 0.00 0.00 29.16 28.67 3nam h TRP 107 CO 0.00 1.08 0.10 0.37 -2.79 0.00 0.00 178.44 177.20 3nam h GLN 108 N -0.74 0.18 -0.07 2.65 4.15 -0.81 -1.76 115.11 118.72 3nam h GLN 108 Ca -0.05 -0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.31 3nam h GLN 108 Cb 1.19 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.84 3nam h GLN 108 CO 0.05 0.12 -0.16 1.49 -1.93 0.00 0.00 178.83 178.41 3nam h GLU 109 N 0.19 0.22 -0.23 1.69 4.22 -1.56 -3.04 114.58 116.07 3nam h GLU 109 Ca 0.40 -0.15 0.07 0.00 0.08 0.00 0.00 59.36 59.75 3nam h GLU 109 Cb 0.69 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 3nam h GLU 109 CO -0.56 0.75 0.22 -0.09 -2.18 0.00 0.00 179.01 177.15 3nam h ARG 110 N -0.28 0.00 -0.01 1.92 2.43 -0.63 0.20 114.38 118.01 3nam h ARG 110 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3nam h ARG 110 Cb 0.76 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 3nam h ARG 110 CO 0.03 0.00 -0.18 0.09 -1.51 0.00 0.00 179.97 178.41 3nam n ASN 111 N -4.00 1.05 -4.82 -3.80 3.02 -0.72 -4.90 115.26 101.10 3nam n ASN 111 Ca 0.03 -0.99 -0.32 0.00 -0.03 0.00 0.00 54.58 53.27 3nam n ASN 111 Cb 0.35 0.08 0.02 0.00 -0.61 0.00 0.00 39.78 39.63 3nam n ASN 111 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3nam s ALA 112 N -2.38 2.78 -0.01 5.41 0.00 0.69 -5.07 121.76 123.18 3nam s ALA 112 Ca 0.28 0.19 0.03 0.00 0.00 0.00 0.00 51.96 52.45 3nam s ALA 112 Cb 0.20 -3.18 -0.00 0.00 0.00 0.00 0.00 23.12 20.13 3nam s ALA 112 CO 0.47 -0.93 -0.09 -1.83 0.00 0.00 0.00 175.76 173.38 3nam s GLU 113 N -4.62 0.83 -0.07 0.00 -1.05 -1.26 -5.04 118.70 107.50 3nam s GLU 113 Ca 0.60 -0.32 -0.26 0.00 -0.15 0.00 0.00 54.97 54.84 3nam s GLU 113 Cb -0.14 -0.80 -0.03 0.00 -0.44 0.00 0.00 34.13 32.72 3nam s GLU 113 CO 0.46 0.16 0.82 1.21 0.95 0.00 0.00 175.26 178.86 3nam s ASN 114 N -0.05 7.10 0.25 0.83 3.84 -1.26 -4.96 114.94 120.69 3nam s ASN 114 Ca 0.01 1.33 -0.04 0.00 0.21 0.00 0.00 52.86 54.37 3nam s ASN 114 Cb -0.06 -2.47 0.30 0.00 -0.55 0.00 0.00 41.25 38.47 3nam s ASN 114 CO -0.00 -0.23 1.79 0.00 -2.79 0.00 0.00 177.10 175.87 3nam h ALA 115 N 6.90 1.12 0.00 1.71 0.00 -1.92 -2.38 119.26 124.69 3nam h ALA 115 Ca -0.38 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.31 3nam h ALA 115 Cb 1.19 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3nam h ALA 115 CO 0.77 0.59 0.00 0.82 0.00 0.00 0.00 179.25 181.43 3nam h ILE 116 N 0.91 0.00 0.00 0.00 2.04 -1.93 -1.74 117.51 116.78 3nam h ILE 116 Ca 0.20 -0.34 -0.05 0.00 1.00 0.00 0.00 64.86 65.66 3nam h ILE 116 Cb 0.32 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 3nam h ILE 116 CO -0.00 0.00 -0.68 -0.33 0.00 0.00 0.00 178.15 177.14 3nam h GLU 117 N 0.00 0.00 0.00 2.37 4.39 -1.84 -3.29 114.58 116.21 3nam h GLU 117 Ca 0.00 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 3nam h GLU 117 Cb 0.37 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 3nam h GLU 117 CO 0.00 0.16 -0.22 0.00 -1.16 0.00 0.00 179.01 177.80 3nam h ALA 118 N 1.78 1.12 -0.08 3.43 0.00 -1.15 -2.91 119.26 121.46 3nam h ALA 118 Ca -0.03 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 3nam h ALA 118 Cb 1.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3nam h ALA 118 CO 0.02 0.27 -0.24 -0.07 0.00 0.00 0.00 179.25 179.24 3nam h LEU 119 N 0.00 0.34 -0.98 0.00 3.38 -1.62 -3.16 115.31 113.26 3nam h LEU 119 Ca -0.00 -0.61 0.28 0.00 0.09 0.00 0.00 57.88 57.64 3nam h LEU 119 Cb 0.62 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 3nam h LEU 119 CO 0.03 0.89 1.07 0.29 0.09 0.00 0.00 178.44 180.82 3nam n LYS 120 N -4.50 0.01 0.08 1.13 4.76 -1.10 0.15 118.16 118.69 3nam n LYS 120 Ca -0.08 0.88 -0.07 0.00 -2.87 0.00 0.00 58.31 56.17 3nam n LYS 120 Cb 0.45 -2.18 0.05 0.00 -1.84 0.00 0.00 35.03 31.51 3nam n LYS 120 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 3nam h GLU 121 N 0.00 0.25 -1.30 1.97 4.22 -1.70 -3.20 114.58 114.83 3nam h GLU 121 Ca 0.47 -0.22 0.00 0.00 0.08 0.00 0.00 59.36 59.69 3nam h GLU 121 Cb 2.61 0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.91 3nam h GLU 121 CO -0.00 0.88 0.00 0.66 -2.18 0.00 0.00 179.01 178.37 3nam n TYR 122 N -3.78 0.00 -4.04 0.92 4.01 0.41 -4.61 117.16 110.07 3nam n TYR 122 Ca -0.03 -0.18 -0.32 0.00 -0.16 0.00 0.00 57.90 57.21 3nam n TYR 122 Cb 0.71 -0.14 -0.15 0.00 -0.31 0.00 0.00 39.34 39.44 3nam n TYR 122 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3nam s GLU 123 N 0.19 2.18 0.46 -0.72 2.02 -1.21 -3.95 118.70 117.67 3nam s GLU 123 Ca 0.00 -1.13 -0.24 0.00 0.02 0.00 0.00 54.97 53.62 3nam s GLU 123 Cb 0.00 -2.71 -0.09 0.00 0.10 0.00 0.00 34.13 31.43 3nam s GLU 123 CO 0.00 -0.51 1.23 -0.35 0.02 0.00 0.00 175.26 175.65 3nam n PRO 124 N 4.54 1.73 -0.24 0.39 -0.04 -1.26 -4.87 135.00 135.25 3nam n PRO 124 Ca -0.15 0.62 -0.07 0.00 -0.04 0.00 0.00 63.50 63.87 3nam n PRO 124 Cb 0.44 -2.36 0.04 0.00 -0.04 0.00 0.00 33.50 31.59 3nam n PRO 124 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3nam h GLU 125 N 1.76 1.02 -4.74 0.54 4.81 -1.95 -3.40 114.58 112.62 3nam h GLU 125 Ca -0.48 -0.20 -0.32 0.00 -0.13 0.00 0.00 59.36 58.23 3nam h GLU 125 Cb 1.31 -0.16 -0.15 0.00 0.63 0.00 0.00 28.75 30.38 3nam h GLU 125 CO 0.58 0.87 -0.60 -1.64 -0.73 0.00 0.00 179.01 177.49 3nam s MET 126 N -5.50 1.37 0.19 1.92 -1.94 -1.26 -1.95 119.30 112.13 3nam s MET 126 Ca -0.13 -1.75 -0.03 0.00 -1.71 0.00 0.00 55.69 52.08 3nam s MET 126 Cb 0.14 0.09 -0.03 0.00 2.01 0.00 0.00 34.83 37.04 3nam s MET 126 CO 0.82 -0.40 0.17 0.20 -0.01 0.00 0.00 175.02 175.79 3nam s GLY 127 N -3.25 1.18 -0.20 -0.03 0.00 0.09 -4.48 107.32 100.62 3nam s GLY 127 Ca 0.38 -1.50 -0.03 0.00 0.00 0.00 0.00 44.72 43.58 3nam s GLY 127 CO 0.15 -1.26 -0.08 0.54 0.00 0.00 0.00 173.10 172.45 3nam s LYS 128 N -4.11 3.32 0.20 2.90 1.02 -1.26 -2.45 119.74 119.36 3nam s LYS 128 Ca 0.33 -0.66 0.04 0.00 0.02 0.00 0.00 55.97 55.69 3nam s LYS 128 Cb 0.06 -2.90 -0.05 0.00 -0.52 0.00 0.00 37.83 34.42 3nam s LYS 128 CO 0.09 -0.15 -0.05 0.14 -0.92 0.00 0.00 175.35 174.46 3nam s VAL 129 N 1.32 1.15 -0.42 3.17 -7.23 -0.91 -0.69 120.40 116.80 3nam s VAL 129 Ca 0.04 -2.06 -0.04 0.00 -1.81 0.00 0.00 61.98 58.11 3nam s VAL 129 Cb -0.14 -2.16 0.11 0.00 0.56 0.00 0.00 36.38 34.75 3nam s VAL 129 CO -0.04 -0.48 0.22 -0.31 -0.31 0.00 0.00 175.10 174.18 3nam s TYR 130 N -3.34 3.57 0.41 2.82 2.02 0.58 -1.97 117.35 121.44 3nam s TYR 130 Ca 0.24 -2.35 -0.01 0.00 -0.37 0.00 0.00 57.07 54.58 3nam s TYR 130 Cb 0.04 -3.27 -0.02 0.00 -0.40 0.00 0.00 41.96 38.31 3nam s TYR 130 CO 0.06 -0.98 0.64 1.03 -1.57 0.00 0.00 175.55 174.73 3nam s ARG 131 N 1.17 3.37 -0.11 -0.62 1.81 -1.25 -3.72 118.95 119.60 3nam s ARG 131 Ca 0.08 -0.26 -0.01 0.00 -1.72 0.00 0.00 55.73 53.82 3nam s ARG 131 Cb -0.23 -2.57 0.02 0.00 -0.45 0.00 0.00 34.95 31.72 3nam s ARG 131 CO -0.04 -0.06 2.30 0.00 -0.68 0.00 0.00 175.30 176.83 3nam n ALA 132 N -1.98 4.80 -1.08 2.13 0.00 0.18 -3.47 120.51 121.10 3nam n ALA 132 Ca -0.02 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.53 3nam n ALA 132 Cb 0.56 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.65 3nam n ALA 132 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3nam n ASP 133 N 1.32 0.00 -3.69 0.00 2.03 -1.26 -4.75 116.55 110.20 3nam n ASP 133 Ca 0.17 -0.86 -0.13 0.00 0.52 0.00 0.00 54.79 54.50 3nam n ASP 133 Cb 0.59 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.90 3nam n ASP 133 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3nam s ARG 134 N 0.00 0.60 0.09 -0.67 0.52 -1.23 -5.03 118.95 113.24 3nam s ARG 134 Ca 0.00 0.77 0.03 0.00 -0.52 0.00 0.00 55.73 56.01 3nam s ARG 134 Cb 0.00 0.27 -0.24 0.00 0.52 0.00 0.00 34.95 35.50 3nam s ARG 134 CO 0.00 -0.08 1.18 -0.22 0.02 0.00 0.00 175.30 176.20 3nam h LYS 135 N 5.54 0.09 -7.18 3.54 3.64 -1.96 -3.41 116.57 116.84 3nam h LYS 135 Ca -0.29 -0.16 -0.52 0.00 -1.27 0.00 0.00 60.65 58.41 3nam h LYS 135 Cb 1.18 0.06 0.13 0.00 -0.41 0.00 0.00 32.23 33.19 3nam h LYS 135 CO 0.18 1.04 0.39 -1.12 -2.27 0.00 0.00 179.45 177.67 3nam s SER 136 N -6.82 4.66 0.17 4.20 0.01 -1.26 -4.98 113.70 109.69 3nam s SER 136 Ca -0.01 2.21 -0.28 0.00 1.31 0.00 0.00 55.95 59.18 3nam s SER 136 Cb 0.09 -2.57 -0.08 0.00 0.21 0.00 0.00 66.02 63.67 3nam s SER 136 CO 0.84 -1.94 0.86 0.54 0.41 0.00 0.00 173.24 173.95 3nam s VAL 137 N -2.09 4.31 0.22 3.43 0.11 -1.26 -4.79 120.40 120.33 3nam s VAL 137 Ca 0.72 1.89 0.06 0.00 -2.93 0.00 0.00 61.98 61.71 3nam s VAL 137 Cb -0.26 -4.23 -0.03 0.00 -1.53 0.00 0.00 36.38 30.33 3nam s VAL 137 CO 0.42 0.47 0.25 -1.10 -3.33 0.00 0.00 175.10 171.81 3nam s GLN 138 N -0.89 3.15 -0.63 1.54 -0.21 -0.83 -4.97 119.66 116.82 3nam s GLN 138 Ca 0.40 -0.87 0.05 0.00 0.02 0.00 0.00 55.36 54.95 3nam s GLN 138 Cb -0.24 -2.73 0.17 0.00 1.00 0.00 0.00 33.01 31.21 3nam s GLN 138 CO 0.29 0.44 0.44 0.50 -2.12 0.00 0.00 175.29 174.84 3nam s ARG 139 N -3.69 2.10 0.80 2.91 3.52 -1.26 -2.13 118.95 121.19 3nam s ARG 139 Ca 0.33 -3.03 -0.05 0.00 -0.13 0.00 0.00 55.73 52.85 3nam s ARG 139 Cb -0.09 -2.99 0.16 0.00 -1.56 0.00 0.00 34.95 30.47 3nam s ARG 139 CO 0.26 -1.29 1.10 0.96 -0.81 0.00 0.00 175.30 175.52 3nam s ILE 140 N -1.04 2.06 0.13 4.11 -4.36 -1.03 -4.83 121.20 116.23 3nam s ILE 140 Ca 0.26 -0.43 -0.30 0.00 -0.26 0.00 0.00 60.65 59.91 3nam s ILE 140 Cb -0.05 -2.62 -0.06 0.00 1.25 0.00 0.00 42.46 40.98 3nam s ILE 140 CO -0.16 0.00 0.97 -0.54 0.24 0.00 0.00 174.94 175.45 3nam s LYS 141 N -5.38 4.71 0.61 0.37 1.02 -1.26 -0.73 119.74 119.08 3nam s LYS 141 Ca 0.69 1.48 0.28 0.00 0.02 0.00 0.00 55.97 58.44 3nam s LYS 141 Cb -0.04 -3.36 1.39 0.00 -0.52 0.00 0.00 37.83 35.30 3nam s LYS 141 CO 0.47 0.23 1.80 0.00 -0.92 0.00 0.00 175.35 176.93 3nam h ALA 142 N 5.39 2.10 -0.00 5.17 0.00 -1.61 -0.12 119.26 130.19 3nam h ALA 142 Ca -0.43 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 3nam h ALA 142 Cb 1.21 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3nam h ALA 142 CO 0.71 -0.77 -0.17 -0.09 0.00 0.00 0.00 179.25 178.93 3nam h ARG 143 N 0.00 0.00 -0.01 0.00 2.43 -1.79 -2.85 114.38 112.16 3nam h ARG 143 Ca 0.20 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 3nam h ARG 143 Cb 1.32 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 3nam h ARG 143 CO -0.00 0.17 -0.47 -0.25 -1.51 0.00 0.00 179.97 177.90 3nam n ASP 144 N -4.34 1.34 -4.77 -3.80 8.00 -0.06 -1.03 116.55 111.89 3nam n ASP 144 Ca -0.02 -1.07 -0.41 0.00 0.71 0.00 0.00 54.79 54.00 3nam n ASP 144 Cb 0.23 0.40 -0.01 0.00 -0.02 0.00 0.00 41.12 41.72 3nam n ASP 144 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3nam s ILE 145 N -2.62 2.41 0.15 0.53 1.01 -1.08 -4.90 121.20 116.69 3nam s ILE 145 Ca 0.18 0.40 0.08 0.00 0.00 0.00 0.00 60.65 61.31 3nam s ILE 145 Cb 0.18 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.36 3nam s ILE 145 CO 0.61 0.09 -0.17 -0.69 0.00 0.00 0.00 174.94 174.78 3nam s VAL 146 N -1.15 1.67 0.30 2.92 1.01 -1.26 -4.10 120.40 119.79 3nam s VAL 146 Ca 0.52 -1.81 -0.30 0.00 0.00 0.00 0.00 61.98 60.39 3nam s VAL 146 Cb -0.42 -1.72 -0.12 0.00 0.00 0.00 0.00 36.38 34.12 3nam s VAL 146 CO 0.57 -0.31 1.54 -2.65 0.00 0.00 0.00 175.10 174.25 3nam n PRO 147 N 0.46 2.58 0.00 2.72 -0.02 -1.26 -2.53 135.00 136.94 3nam n PRO 147 Ca -0.15 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 3nam n PRO 147 Cb 0.57 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 3nam n PRO 147 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3nam n GLY 148 N 1.88 3.00 3.82 -1.23 0.00 0.12 -4.92 105.19 107.86 3nam n GLY 148 Ca 0.08 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 3nam n GLY 148 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3nam s ASP 149 N 0.70 6.06 -0.15 1.61 1.47 -1.05 -4.58 116.67 120.73 3nam s ASP 149 Ca 0.00 1.73 -0.29 0.00 1.18 0.00 0.00 52.55 55.16 3nam s ASP 149 Cb 0.00 -2.52 -0.01 0.00 -0.34 0.00 0.00 42.92 40.05 3nam s ASP 149 CO 0.00 -0.98 1.09 -0.63 0.68 0.00 0.00 175.17 175.33 3nam s ILE 150 N -2.53 4.59 0.09 2.11 -1.09 -1.26 -2.17 121.20 120.94 3nam s ILE 150 Ca 0.62 1.89 0.09 0.00 -2.23 0.00 0.00 60.65 61.02 3nam s ILE 150 Cb -0.14 -4.22 -0.04 0.00 -1.58 0.00 0.00 42.46 36.48 3nam s ILE 150 CO 0.36 -0.08 -0.21 -0.69 -1.23 0.00 0.00 174.94 173.09 3nam s VAL 151 N 2.66 2.61 -0.05 2.92 1.01 0.27 -0.30 120.40 129.52 3nam s VAL 151 Ca 0.49 -1.46 0.05 0.00 0.00 0.00 0.00 61.98 61.06 3nam s VAL 151 Cb -0.19 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.05 3nam s VAL 151 CO 0.14 0.20 -0.20 -0.70 0.00 0.00 0.00 175.10 174.54 3nam s GLU 152 N -1.82 2.02 0.04 2.72 2.12 0.13 0.00 118.70 123.91 3nam s GLU 152 Ca 0.15 -0.71 0.02 0.00 0.36 0.00 0.00 54.97 54.79 3nam s GLU 152 Cb -0.10 -1.75 -0.02 0.00 0.26 0.00 0.00 34.13 32.51 3nam s GLU 152 CO 0.07 0.30 -0.08 0.14 -0.54 0.00 0.00 175.26 175.15 3nam s VAL 153 N -0.06 0.53 0.29 3.70 -7.23 -0.86 -4.14 120.40 112.63 3nam s VAL 153 Ca -0.03 -1.00 0.04 0.00 -1.81 0.00 0.00 61.98 59.19 3nam s VAL 153 Cb -0.12 -0.58 -0.03 0.00 0.56 0.00 0.00 36.38 36.20 3nam s VAL 153 CO 0.02 -0.33 0.22 0.00 -0.31 0.00 0.00 175.10 174.70 3nam s ALA 154 N -1.25 1.69 0.26 1.32 0.00 -1.26 -1.87 121.76 120.64 3nam s ALA 154 Ca -0.09 -1.91 -0.29 0.00 0.00 0.00 0.00 51.96 49.68 3nam s ALA 154 Cb -0.09 1.40 -0.14 0.00 0.00 0.00 0.00 23.12 24.29 3nam s ALA 154 CO 0.00 -0.62 1.01 0.28 0.00 0.00 0.00 175.76 176.44 3nam n VAL 155 N -0.52 1.80 0.00 0.00 0.31 -0.18 -1.72 118.33 118.02 3nam n VAL 155 Ca 0.05 -0.45 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 3nam n VAL 155 Cb 0.64 -0.92 0.00 0.00 -0.91 0.00 0.00 33.84 32.65 3nam n VAL 155 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3nam n GLY 156 N 1.41 2.29 3.58 2.92 0.00 -0.81 -4.99 105.19 109.59 3nam n GLY 156 Ca 0.11 -0.48 -0.45 0.00 0.00 0.00 0.00 46.02 45.21 3nam n GLY 156 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3nam n ASP 157 N 1.97 1.22 -4.60 1.61 8.00 -0.70 -4.62 116.55 119.42 3nam n ASP 157 Ca 0.00 1.18 -0.37 0.00 0.71 0.00 0.00 54.79 56.31 3nam n ASP 157 Cb 0.00 -1.28 -0.10 0.00 -0.02 0.00 0.00 41.12 39.72 3nam n ASP 157 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3nam s LYS 158 N -1.52 3.96 -0.16 -1.24 2.20 -1.26 -2.34 119.74 119.38 3nam s LYS 158 Ca 0.59 -0.32 -0.38 0.00 -0.36 0.00 0.00 55.97 55.50 3nam s LYS 158 Cb -0.71 -3.51 -0.15 0.00 -1.51 0.00 0.00 37.83 31.95 3nam s LYS 158 CO 0.60 -0.03 1.71 0.28 -0.36 0.00 0.00 175.35 177.55 3nam n VAL 159 N 4.54 0.31 0.16 4.02 0.31 -0.57 -4.63 118.33 122.48 3nam n VAL 159 Ca -0.15 -0.06 0.04 0.00 -0.01 0.00 0.00 64.34 64.16 3nam n VAL 159 Cb 0.52 -1.34 0.14 0.00 -0.91 0.00 0.00 33.84 32.25 3nam n VAL 159 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3nam h PRO 160 N 7.25 0.00 -3.59 5.55 0.14 -1.90 -1.58 132.00 137.87 3nam h PRO 160 Ca -0.47 0.00 -0.14 0.00 0.14 0.00 0.00 66.00 65.53 3nam h PRO 160 Cb 1.31 0.00 -0.05 0.00 0.14 0.00 0.00 31.00 32.40 3nam h PRO 160 CO 0.93 0.45 0.02 0.00 0.14 0.00 0.00 178.00 179.54 3nam s ALA 161 N -3.18 -0.00 -0.41 -0.56 0.00 -1.26 -4.90 121.76 111.45 3nam s ALA 161 Ca 0.03 -1.11 -0.27 0.00 0.00 0.00 0.00 51.96 50.61 3nam s ALA 161 Cb 0.09 0.94 0.02 0.00 0.00 0.00 0.00 23.12 24.17 3nam s ALA 161 CO 0.72 -0.88 1.03 -0.51 0.00 0.00 0.00 175.76 176.11 3nam s ASP 162 N -3.14 6.69 -0.06 0.00 1.11 -1.14 -3.01 116.67 117.12 3nam s ASP 162 Ca 0.23 0.58 -0.00 0.00 0.18 0.00 0.00 52.55 53.53 3nam s ASP 162 Cb -0.03 -2.51 -0.03 0.00 1.07 0.00 0.00 42.92 41.42 3nam s ASP 162 CO 0.15 -1.02 -0.01 -0.63 1.18 0.00 0.00 175.17 174.84 3nam s ILE 163 N 3.87 4.15 -0.25 0.77 1.01 -0.83 -0.41 121.20 129.51 3nam s ILE 163 Ca 0.43 -0.38 -0.11 0.00 0.00 0.00 0.00 60.65 60.58 3nam s ILE 163 Cb -0.10 -2.76 -0.05 0.00 0.01 0.00 0.00 42.46 39.56 3nam s ILE 163 CO 0.23 0.55 0.20 -0.60 0.00 0.00 0.00 174.94 175.32 3nam s ARG 164 N -1.04 4.04 -0.17 2.79 6.06 0.08 -0.62 118.95 130.08 3nam s ARG 164 Ca 0.15 -0.23 -0.29 0.00 -2.50 0.00 0.00 55.73 52.86 3nam s ARG 164 Cb -0.11 -3.59 -0.01 0.00 0.06 0.00 0.00 34.95 31.30 3nam s ARG 164 CO 0.04 -0.05 1.16 0.42 -2.50 0.00 0.00 175.30 174.37 3nam s ILE 165 N 1.38 4.45 -0.11 4.11 1.01 -0.79 -1.24 121.20 130.01 3nam s ILE 165 Ca 0.09 1.75 -0.24 0.00 0.00 0.00 0.00 60.65 62.25 3nam s ILE 165 Cb -0.15 -4.13 -0.27 0.00 0.01 0.00 0.00 42.46 37.92 3nam s ILE 165 CO 0.07 -0.13 0.73 -0.07 0.00 0.00 0.00 174.94 175.54 3nam h LEU 166 N 9.38 0.20 -7.00 2.97 3.38 -1.57 -3.44 115.31 119.22 3nam h LEU 166 Ca -0.25 -0.92 0.04 0.00 0.09 0.00 0.00 57.88 56.85 3nam h LEU 166 Cb 1.10 -0.07 -0.24 0.00 0.09 0.00 0.00 40.66 41.54 3nam h LEU 166 CO 0.96 1.25 0.27 -0.94 0.09 0.00 0.00 178.44 180.07 3nam s SER 167 N -6.63 -0.64 -0.41 -0.43 1.04 -1.14 -4.97 113.70 100.52 3nam s SER 167 Ca -0.18 1.12 -0.25 0.00 0.48 0.00 0.00 55.95 57.12 3nam s SER 167 Cb 0.00 1.20 0.02 0.00 0.10 0.00 0.00 66.02 67.34 3nam s SER 167 CO 0.74 -0.19 0.88 -0.63 0.98 0.00 0.00 173.24 175.02 3nam s ILE 168 N 0.86 4.58 0.15 -1.02 1.01 -1.26 -1.51 121.20 124.00 3nam s ILE 168 Ca -0.04 0.86 -0.12 0.00 0.00 0.00 0.00 60.65 61.36 3nam s ILE 168 Cb -0.05 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 38.08 3nam s ILE 168 CO -0.10 -0.66 1.56 0.11 0.00 0.00 0.00 174.94 175.85 3nam h LYS 169 N 8.78 0.91 0.00 2.79 1.79 -1.70 -3.45 116.57 125.69 3nam h LYS 169 Ca -0.24 -0.35 -0.24 0.00 -2.18 0.00 0.00 60.65 57.64 3nam h LYS 169 Cb 1.08 -0.05 0.11 0.00 -1.58 0.00 0.00 32.23 31.79 3nam h LYS 169 CO 0.98 1.00 0.18 -1.13 -1.08 0.00 0.00 179.45 179.40 3nam n SER 170 N -4.23 -0.58 0.10 0.86 3.41 -0.56 -4.97 113.62 107.65 3nam n SER 170 Ca -0.00 -1.13 -0.14 0.00 -0.26 0.00 0.00 58.87 57.33 3nam n SER 170 Cb 0.39 -0.59 -0.13 0.00 -0.26 0.00 0.00 64.21 63.62 3nam n SER 170 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3nam h THR 171 N -1.74 1.54 -2.88 6.66 1.35 -1.90 -3.46 112.91 112.48 3nam h THR 171 Ca -0.25 -3.12 -0.13 0.00 -0.55 0.00 0.00 66.41 62.37 3nam h THR 171 Cb 0.70 2.92 -0.23 0.00 -1.73 0.00 0.00 68.15 69.81 3nam h THR 171 CO 0.17 0.91 -0.28 0.28 -0.25 0.00 0.00 175.52 176.35 3nam s THR 172 N -2.67 0.01 -0.20 6.82 -1.32 -1.26 -5.14 115.64 111.88 3nam s THR 172 Ca -0.03 -0.11 -0.01 0.00 -1.21 0.00 0.00 61.69 60.33 3nam s THR 172 Cb 0.08 -0.54 0.01 0.00 -1.51 0.00 0.00 72.50 70.53 3nam s THR 172 CO 0.87 -0.06 -0.13 -0.22 -2.21 0.00 0.00 174.62 172.87 3nam s LEU 173 N -0.16 2.49 -0.14 9.08 2.96 -1.26 -3.76 118.68 127.89 3nam s LEU 173 Ca -0.03 -0.57 -0.01 0.00 -0.22 0.00 0.00 54.13 53.30 3nam s LEU 173 Cb -0.03 -1.59 -0.02 0.00 0.50 0.00 0.00 46.19 45.05 3nam s LEU 173 CO 0.01 -0.02 -0.10 -0.13 -1.32 0.00 0.00 176.35 174.80 3nam s ARG 174 N 1.36 3.46 0.11 1.98 1.81 0.13 -2.07 118.95 125.74 3nam s ARG 174 Ca 0.05 -0.64 0.10 0.00 -1.72 0.00 0.00 55.73 53.52 3nam s ARG 174 Cb -0.14 -2.71 -0.04 0.00 -0.45 0.00 0.00 34.95 31.61 3nam s ARG 174 CO -0.09 0.21 -0.25 0.08 -0.68 0.00 0.00 175.30 174.57 3nam s VAL 175 N 0.37 2.08 -0.40 3.52 1.01 0.11 0.68 120.40 127.76 3nam s VAL 175 Ca -0.09 -1.62 -0.03 0.00 0.00 0.00 0.00 61.98 60.24 3nam s VAL 175 Cb -0.15 -1.84 0.11 0.00 0.00 0.00 0.00 36.38 34.49 3nam s VAL 175 CO 0.05 0.10 0.20 -0.62 0.00 0.00 0.00 175.10 174.83 3nam s ASP 176 N -1.85 5.25 -0.28 3.32 2.15 -0.54 0.50 116.67 125.20 3nam s ASP 176 Ca 0.12 -1.99 0.08 0.00 0.43 0.00 0.00 52.55 51.18 3nam s ASP 176 Cb -0.10 -1.83 0.45 0.00 -0.30 0.00 0.00 42.92 41.15 3nam s ASP 176 CO 0.05 -0.53 1.25 0.00 -0.17 0.00 0.00 175.17 175.77 3nam n GLN 177 N 4.60 2.89 -0.23 4.34 10.64 -1.26 -2.71 117.38 135.65 3nam n GLN 177 Ca -0.03 -3.83 -0.02 0.00 -1.83 0.00 0.00 57.00 51.30 3nam n GLN 177 Cb 0.41 -2.06 0.09 0.00 -0.86 0.00 0.00 30.24 27.82 3nam n GLN 177 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3nam h SER 178 N 1.76 0.59 -0.19 2.61 4.64 -1.89 -0.53 113.55 120.54 3nam h SER 178 Ca 0.27 0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.56 3nam h SER 178 Cb 1.36 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.34 3nam h SER 178 CO 0.56 0.39 -0.01 0.16 -0.87 0.00 0.00 176.83 177.06 3nam h ILE 179 N 0.72 1.18 -0.02 0.95 3.07 -1.87 1.68 117.51 123.23 3nam h ILE 179 Ca 0.29 -0.73 0.00 0.00 1.55 0.00 0.00 64.86 65.98 3nam h ILE 179 Cb 0.14 0.97 0.00 0.00 -0.27 0.00 0.00 36.82 37.66 3nam h ILE 179 CO -0.16 0.25 -0.37 -0.11 -1.05 0.00 0.00 178.15 176.70 3nam n LEU 180 N -4.30 2.07 0.00 0.16 7.94 -0.91 -1.29 117.00 120.67 3nam n LEU 180 Ca 0.01 -0.74 0.00 0.00 -1.11 0.00 0.00 56.01 54.17 3nam n LEU 180 Cb 0.23 -0.01 0.00 0.00 0.53 0.00 0.00 43.42 44.17 3nam n LEU 180 CO 0.38 0.38 0.00 0.35 -1.11 0.00 0.00 177.39 177.39 3nam n THR 181 N 0.13 0.00 -0.49 1.96 -2.24 -0.25 -4.76 114.28 108.63 3nam n THR 181 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 3nam n THR 181 Cb 0.48 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 3nam n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3nam n GLY 182 N 0.00 0.93 3.69 3.38 0.00 0.57 -5.00 105.19 108.77 3nam n GLY 182 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3nam n GLY 182 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3nam s GLU 183 N -0.42 4.27 -0.01 1.61 2.02 -1.25 -4.90 118.70 120.02 3nam s GLU 183 Ca 0.00 2.05 -0.26 0.00 0.02 0.00 0.00 54.97 56.79 3nam s GLU 183 Cb 0.00 -3.51 -0.20 0.00 0.10 0.00 0.00 34.13 30.52 3nam s GLU 183 CO 0.00 -0.58 1.31 0.66 0.02 0.00 0.00 175.26 176.67 3nam h SER 184 N 7.72 -0.00 -3.77 -0.19 4.64 -1.95 -3.21 113.55 116.79 3nam h SER 184 Ca -0.40 -0.44 -0.49 0.00 -0.47 0.00 0.00 61.79 59.99 3nam h SER 184 Cb 1.19 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.30 3nam h SER 184 CO 0.90 0.44 0.17 0.68 -0.87 0.00 0.00 176.83 178.15 3nam s VAL 185 N -4.44 4.81 0.10 0.95 -7.23 -1.26 -4.90 120.40 108.42 3nam s VAL 185 Ca -0.16 0.52 -0.31 0.00 -1.81 0.00 0.00 61.98 60.23 3nam s VAL 185 Cb 0.02 -3.80 -0.08 0.00 0.56 0.00 0.00 36.38 33.08 3nam s VAL 185 CO 0.67 -0.75 1.41 -0.94 -0.31 0.00 0.00 175.10 175.18 3nam s SER 186 N -3.68 6.82 0.38 4.85 1.04 -1.26 -4.78 113.70 117.07 3nam s SER 186 Ca 0.51 2.31 -0.01 0.00 0.48 0.00 0.00 55.95 59.23 3nam s SER 186 Cb -0.10 -2.58 -0.03 0.00 0.10 0.00 0.00 66.02 63.40 3nam s SER 186 CO 0.40 -0.67 0.61 0.54 0.98 0.00 0.00 173.24 175.10 3nam s VAL 187 N 1.36 5.02 -0.16 5.02 0.11 0.18 -4.77 120.40 127.16 3nam s VAL 187 Ca 0.65 -0.30 -0.13 0.00 -2.93 0.00 0.00 61.98 59.27 3nam s VAL 187 Cb -0.36 -3.85 -0.05 0.00 -1.53 0.00 0.00 36.38 30.59 3nam s VAL 187 CO 0.30 -0.63 0.26 -0.63 -3.33 0.00 0.00 175.10 171.07 3nam s ILE 188 N -2.43 5.33 0.17 7.04 1.01 -1.26 -0.71 121.20 130.34 3nam s ILE 188 Ca 0.42 0.47 0.03 0.00 0.00 0.00 0.00 60.65 61.57 3nam s ILE 188 Cb -0.10 -3.59 -0.03 0.00 0.01 0.00 0.00 42.46 38.75 3nam s ILE 188 CO 0.38 0.41 0.29 -0.54 0.00 0.00 0.00 174.94 175.49 3nam s LYS 189 N 0.34 3.40 0.34 2.79 -0.14 -0.88 -4.95 119.74 120.64 3nam s LYS 189 Ca 0.15 -0.66 0.05 0.00 -1.36 0.00 0.00 55.97 54.15 3nam s LYS 189 Cb -0.13 -2.92 -0.02 0.00 -1.68 0.00 0.00 37.83 33.08 3nam s LYS 189 CO 0.03 0.50 0.18 0.72 -0.76 0.00 0.00 175.35 176.01 3nam n HIS 190 N -0.73 -0.19 -0.02 3.18 8.25 -0.60 -4.68 115.22 120.44 3nam n HIS 190 Ca -0.07 -2.40 0.00 0.00 -0.26 0.00 0.00 57.72 54.99 3nam n HIS 190 Cb 0.55 0.09 -0.06 0.00 1.12 0.00 0.00 29.99 31.69 3nam n HIS 190 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 3nam n THR 191 N -0.73 0.22 -2.13 1.59 -1.04 -1.26 -4.13 114.28 106.80 3nam n THR 191 Ca -0.01 -0.23 -0.40 0.00 -2.04 0.00 0.00 64.05 61.37 3nam n THR 191 Cb 0.54 -0.19 -0.02 0.00 -1.82 0.00 0.00 70.33 68.85 3nam n THR 191 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 3nam s GLU 192 N -2.36 4.19 0.88 -2.82 -1.05 -1.26 -4.82 118.70 111.45 3nam s GLU 192 Ca -0.03 2.13 -0.10 0.00 -0.15 0.00 0.00 54.97 56.82 3nam s GLU 192 Cb 0.04 -2.91 0.12 0.00 -0.44 0.00 0.00 34.13 30.94 3nam s GLU 192 CO 0.30 -0.29 1.14 -1.25 0.95 0.00 0.00 175.26 176.11 3nam s PRO 193 N -2.00 1.31 -0.29 -4.83 0.04 -1.26 -4.70 135.00 123.27 3nam s PRO 193 Ca 0.53 1.47 -0.05 0.00 0.04 0.00 0.00 61.00 62.99 3nam s PRO 193 Cb -0.38 -1.77 0.02 0.00 0.04 0.00 0.00 34.50 32.41 3nam s PRO 193 CO 0.49 -2.41 0.04 0.08 0.04 0.00 0.00 177.00 175.25 3nam s VAL 194 N -2.69 3.67 0.23 -0.36 1.01 -0.85 -5.02 120.40 116.38 3nam s VAL 194 Ca 0.66 -0.81 -0.06 0.00 0.00 0.00 0.00 61.98 61.77 3nam s VAL 194 Cb -0.22 -2.90 0.20 0.00 0.00 0.00 0.00 36.38 33.46 3nam s VAL 194 CO 0.57 0.09 1.74 -0.65 0.00 0.00 0.00 175.10 176.85 3nam h PRO 195 N 8.17 0.46 -6.44 2.72 0.11 -1.85 -3.34 132.00 131.83 3nam h PRO 195 Ca -0.31 -0.03 -0.53 0.00 0.11 0.00 0.00 66.00 65.24 3nam h PRO 195 Cb 1.12 -0.10 0.03 0.00 0.11 0.00 0.00 31.00 32.15 3nam h PRO 195 CO 0.59 0.30 1.14 0.34 -0.21 0.00 0.00 178.00 180.16 3nam s ASP 196 N -5.38 6.46 0.12 -2.05 -1.08 -1.26 -4.89 116.67 108.59 3nam s ASP 196 Ca -0.13 2.67 0.26 0.00 -0.52 0.00 0.00 52.55 54.84 3nam s ASP 196 Cb 0.19 -2.55 0.74 0.00 -1.46 0.00 0.00 42.92 39.84 3nam s ASP 196 CO 0.76 -1.00 1.65 -2.65 0.52 0.00 0.00 175.17 174.45 3nam n PRO 197 N 6.36 0.19 -1.46 4.34 -0.02 -1.26 -3.78 135.00 139.37 3nam n PRO 197 Ca 0.18 0.12 -0.16 0.00 -2.02 0.00 0.00 63.50 61.62 3nam n PRO 197 Cb 0.40 -1.68 0.09 0.00 -0.02 0.00 0.00 33.50 32.29 3nam n PRO 197 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3nam n ARG 198 N -1.99 2.81 -2.49 -0.52 1.74 -1.26 -5.06 116.66 109.90 3nam n ARG 198 Ca 0.05 -3.73 -0.35 0.00 -0.77 0.00 0.00 57.85 53.05 3nam n ARG 198 Cb 0.41 -2.08 -0.03 0.00 -1.02 0.00 0.00 32.46 29.74 3nam n ARG 198 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3nam s ALA 199 N -3.50 2.90 0.58 7.54 0.00 -1.25 -5.04 121.76 122.99 3nam s ALA 199 Ca 0.49 0.68 -0.13 0.00 0.00 0.00 0.00 51.96 53.00 3nam s ALA 199 Cb 0.41 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 20.20 3nam s ALA 199 CO 0.01 -0.38 1.02 0.14 0.00 0.00 0.00 175.76 176.54 3nam s VAL 200 N -1.86 4.55 0.58 0.00 -7.23 -1.26 -4.93 120.40 110.25 3nam s VAL 200 Ca 0.66 0.99 0.33 0.00 -1.81 0.00 0.00 61.98 62.15 3nam s VAL 200 Cb -0.19 -3.76 0.37 0.00 0.56 0.00 0.00 36.38 33.36 3nam s VAL 200 CO 0.23 -0.92 2.26 0.78 -0.31 0.00 0.00 175.10 177.14 3nam h ASN 201 N 0.15 0.00 0.55 4.85 2.35 -1.96 -0.78 115.58 120.74 3nam h ASN 201 Ca -0.45 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.29 3nam h ASN 201 Cb 1.19 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.56 3nam h ASN 201 CO 0.61 0.01 -0.05 -0.61 -1.65 0.00 0.00 177.43 175.75 3nam h GLN 202 N 0.00 0.00 -0.15 0.81 4.15 -1.94 -2.87 115.11 115.11 3nam h GLN 202 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3nam h GLN 202 Cb 0.04 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.73 3nam h GLN 202 CO 0.00 0.05 0.00 -0.25 -1.93 0.00 0.00 178.83 176.70 3nam n ASP 203 N -3.26 2.66 -4.47 -0.69 8.00 -0.30 -4.69 116.55 113.78 3nam n ASP 203 Ca -0.01 -1.78 -0.44 0.00 0.71 0.00 0.00 54.79 53.27 3nam n ASP 203 Cb 0.23 -0.09 -0.00 0.00 -0.02 0.00 0.00 41.12 41.23 3nam n ASP 203 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3nam s LYS 204 N -1.29 4.00 0.41 -1.24 1.02 -1.08 -4.76 119.74 116.80 3nam s LYS 204 Ca 0.24 -2.39 0.29 0.00 0.02 0.00 0.00 55.97 54.12 3nam s LYS 204 Cb 0.15 -5.09 1.19 0.00 -0.52 0.00 0.00 37.83 33.57 3nam s LYS 204 CO 0.22 -1.82 1.86 0.87 -0.92 0.00 0.00 175.35 175.56 3nam h LYS 205 N 7.47 0.00 -0.53 1.68 1.79 -1.85 -3.06 116.57 122.08 3nam h LYS 205 Ca 0.30 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.77 3nam h LYS 205 Cb 0.90 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.55 3nam h LYS 205 CO 1.25 0.00 0.00 0.27 -1.08 0.00 0.00 179.45 179.89 3nam n ASN 206 N -2.68 5.36 -4.21 0.86 0.23 -1.26 -1.56 115.26 112.01 3nam n ASN 206 Ca 0.01 -2.91 -0.23 0.00 -0.53 0.00 0.00 54.58 50.92 3nam n ASN 206 Cb 0.27 -0.65 -0.14 0.00 -2.08 0.00 0.00 39.78 37.18 3nam n ASN 206 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 3nam s MET 207 N -2.71 1.21 -0.10 -3.83 -1.94 -1.16 -1.88 119.30 108.89 3nam s MET 207 Ca 0.52 -0.86 -0.01 0.00 -1.71 0.00 0.00 55.69 53.63 3nam s MET 207 Cb 0.40 -1.28 -0.03 0.00 2.01 0.00 0.00 34.83 35.92 3nam s MET 207 CO 0.15 0.32 -0.04 -0.51 -0.01 0.00 0.00 175.02 174.94 3nam s LEU 208 N -1.15 3.30 -0.19 -0.03 1.43 0.21 -4.98 118.68 117.28 3nam s LEU 208 Ca 0.05 -0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 53.04 3nam s LEU 208 Cb -0.08 -1.75 -0.05 0.00 0.03 0.00 0.00 46.19 44.34 3nam s LEU 208 CO 0.02 0.30 0.11 -0.36 0.23 0.00 0.00 176.35 176.65 3nam s PHE 209 N -0.42 3.38 0.01 0.29 0.08 -1.26 -1.97 117.98 118.08 3nam s PHE 209 Ca 0.07 0.28 -0.33 0.00 0.12 0.00 0.00 56.93 57.06 3nam s PHE 209 Cb -0.12 -2.12 -0.12 0.00 -0.57 0.00 0.00 43.02 40.09 3nam s PHE 209 CO 0.02 0.29 1.81 0.45 -0.10 0.00 0.00 175.22 177.69 3nam n SER 210 N 3.40 3.48 0.00 1.36 2.88 -1.16 -1.75 113.62 121.83 3nam n SER 210 Ca -0.16 1.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.37 3nam n SER 210 Cb 0.52 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 3nam n SER 210 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3nam n GLY 211 N 4.14 1.32 3.95 0.46 0.00 -0.59 -4.72 105.19 109.74 3nam n GLY 211 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 3nam n GLY 211 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3nam s THR 212 N -1.55 2.19 0.15 2.61 -4.23 -0.72 -4.81 115.64 109.29 3nam s THR 212 Ca 0.00 -0.30 0.07 0.00 -1.18 0.00 0.00 61.69 60.27 3nam s THR 212 Cb 0.00 -2.89 -0.04 0.00 1.34 0.00 0.00 72.50 70.91 3nam s THR 212 CO 0.00 0.00 0.01 0.20 -0.54 0.00 0.00 174.62 174.29 3nam s ASN 213 N -4.65 4.89 -0.37 3.99 0.01 -1.10 -1.51 114.94 116.20 3nam s ASN 213 Ca 0.65 -0.32 -0.19 0.00 -0.71 0.00 0.00 52.86 52.28 3nam s ASN 213 Cb -0.08 -1.09 0.00 0.00 0.41 0.00 0.00 41.25 40.49 3nam s ASN 213 CO 0.46 0.11 0.56 -0.63 -1.51 0.00 0.00 177.10 176.09 3nam s ILE 214 N -1.64 4.95 -0.06 0.60 1.01 -0.99 -1.47 121.20 123.61 3nam s ILE 214 Ca 0.27 0.33 -0.25 0.00 0.00 0.00 0.00 60.65 61.00 3nam s ILE 214 Cb -0.10 -4.04 -0.24 0.00 0.01 0.00 0.00 42.46 38.09 3nam s ILE 214 CO 0.19 -0.32 1.01 0.00 0.00 0.00 0.00 174.94 175.82 3nam h ALA 215 N 8.55 0.02 -3.06 9.38 0.00 -0.07 -2.16 119.26 131.92 3nam h ALA 215 Ca -0.27 -0.46 -0.16 0.00 0.00 0.00 0.00 54.91 54.02 3nam h ALA 215 Cb 1.11 0.01 -0.25 0.00 0.00 0.00 0.00 17.79 18.67 3nam h ALA 215 CO 0.81 0.06 -0.40 0.00 0.00 0.00 0.00 179.25 179.72 3nam s ALA 216 N -3.06 -0.67 0.00 0.00 0.00 -0.61 -4.71 121.76 112.71 3nam s ALA 216 Ca -0.16 0.75 0.00 0.00 0.00 0.00 0.00 51.96 52.54 3nam s ALA 216 Cb 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.69 3nam s ALA 216 CO 0.73 -0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.77 3nam n GLY 217 N 2.89 -3.48 3.20 0.00 0.00 -1.25 0.22 105.19 106.76 3nam n GLY 217 Ca -0.13 -2.13 -0.13 0.00 0.00 0.00 0.00 46.02 43.63 3nam n GLY 217 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3nam s LYS 218 N -0.85 0.49 0.13 1.61 2.20 -1.26 -1.01 119.74 121.04 3nam s LYS 218 Ca 0.00 0.09 -0.24 0.00 -0.36 0.00 0.00 55.97 55.45 3nam s LYS 218 Cb 0.00 0.22 0.07 0.00 -1.51 0.00 0.00 37.83 36.62 3nam s LYS 218 CO 0.00 -0.11 0.70 0.00 -0.36 0.00 0.00 175.35 175.59 3nam s ALA 219 N -0.60 -1.62 0.13 3.13 0.00 -0.78 -1.49 121.76 120.53 3nam s ALA 219 Ca -0.07 0.51 0.05 0.00 0.00 0.00 0.00 51.96 52.46 3nam s ALA 219 Cb -0.04 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 3nam s ALA 219 CO 0.02 -0.79 0.04 -1.17 0.00 0.00 0.00 175.76 173.85 3nam s LEU 220 N -2.71 3.54 -0.01 0.00 2.96 -0.57 -2.04 118.68 119.84 3nam s LEU 220 Ca 0.04 -0.20 -0.28 0.00 -0.22 0.00 0.00 54.13 53.46 3nam s LEU 220 Cb -0.02 -2.22 0.09 0.00 0.50 0.00 0.00 46.19 44.55 3nam s LEU 220 CO -0.09 0.13 0.81 -0.83 -1.32 0.00 0.00 176.35 175.05 3nam s GLY 221 N -2.65 -0.48 -0.11 7.98 0.00 0.10 -1.41 107.32 110.76 3nam s GLY 221 Ca 0.28 1.19 -0.12 0.00 0.00 0.00 0.00 44.72 46.07 3nam s GLY 221 CO 0.20 0.58 0.26 -1.50 0.00 0.00 0.00 173.10 172.64 3nam s ILE 222 N -2.42 5.31 -0.20 0.90 2.07 -0.37 0.96 121.20 127.45 3nam s ILE 222 Ca -0.01 0.49 -0.29 0.00 -1.41 0.00 0.00 60.65 59.43 3nam s ILE 222 Cb -0.01 -3.57 -0.02 0.00 0.13 0.00 0.00 42.46 39.00 3nam s ILE 222 CO -0.04 0.51 1.42 -0.69 -1.91 0.00 0.00 174.94 174.23 3nam s VAL 223 N -0.39 3.99 0.00 4.00 1.01 -0.92 -0.74 120.40 127.34 3nam s VAL 223 Ca 0.17 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.31 3nam s VAL 223 Cb -0.13 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.36 3nam s VAL 223 CO 0.06 -0.25 0.11 0.00 0.00 0.00 0.00 175.10 175.01 3nam n ALA 224 N 7.41 -0.05 -2.64 5.51 0.00 0.46 0.14 120.51 131.34 3nam n ALA 224 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.36 3nam n ALA 224 Cb 0.45 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.83 3nam n ALA 224 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3nam s THR 225 N -1.11 3.48 0.40 0.00 -4.23 -1.14 -3.46 115.64 109.58 3nam s THR 225 Ca 0.00 -1.79 0.05 0.00 -1.18 0.00 0.00 61.69 58.77 3nam s THR 225 Cb 0.00 -2.82 -0.06 0.00 1.34 0.00 0.00 72.50 70.96 3nam s THR 225 CO 0.00 -0.30 0.04 0.28 -0.54 0.00 0.00 174.62 174.10 3nam s THR 226 N -2.14 1.45 0.00 3.99 -1.32 -1.26 -2.88 115.64 113.48 3nam s THR 226 Ca 0.30 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.78 3nam s THR 226 Cb -0.07 -2.72 0.00 0.00 -1.51 0.00 0.00 72.50 68.20 3nam s THR 226 CO 0.19 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.21 3nam n GLY 227 N -0.93 0.71 0.00 6.08 0.00 -1.26 -0.86 105.19 108.93 3nam n GLY 227 Ca -0.07 0.21 0.09 0.00 0.00 0.00 0.00 46.02 46.25 3nam n GLY 227 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3nam n VAL 228 N 0.00 0.68 1.13 1.61 0.31 -1.24 -3.20 118.33 117.63 3nam n VAL 228 Ca 0.00 0.17 0.12 0.00 -0.01 0.00 0.00 64.34 64.62 3nam n VAL 228 Cb 0.00 -0.85 0.33 0.00 -0.91 0.00 0.00 33.84 32.41 3nam n VAL 228 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3nam n SER 229 N -1.47 2.22 -4.90 4.52 7.64 -0.04 -3.22 113.62 118.37 3nam n SER 229 Ca 0.05 -1.75 -0.28 0.00 1.01 0.00 0.00 58.87 57.90 3nam n SER 229 Cb 0.21 -0.06 0.01 0.00 -1.01 0.00 0.00 64.21 63.36 3nam n SER 229 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3nam s THR 230 N -1.88 4.36 0.64 0.44 -4.23 -1.19 -4.74 115.64 109.03 3nam s THR 230 Ca 0.34 0.26 0.34 0.00 -1.18 0.00 0.00 61.69 61.45 3nam s THR 230 Cb 0.20 -3.70 0.37 0.00 1.34 0.00 0.00 72.50 70.71 3nam s THR 230 CO 0.31 -0.75 2.12 -0.33 -0.54 0.00 0.00 174.62 175.43 3nam h GLU 231 N -0.06 0.00 0.04 3.99 4.39 -1.91 0.09 114.58 121.12 3nam h GLU 231 Ca -0.46 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 58.91 3nam h GLU 231 Cb 1.22 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.83 3nam h GLU 231 CO 0.61 0.00 -1.93 1.51 -1.16 0.00 0.00 179.01 178.04 3nam n ILE 232 N -3.27 1.63 0.18 3.13 3.06 -1.26 -3.70 119.36 119.13 3nam n ILE 232 Ca -0.01 -0.75 0.05 0.00 -2.50 0.00 0.00 62.75 59.54 3nam n ILE 232 Cb 0.27 -1.19 0.32 0.00 0.54 0.00 0.00 39.64 39.58 3nam n ILE 232 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 3nam h GLY 233 N 2.78 0.00 2.00 4.50 0.00 -1.32 -1.95 103.07 109.08 3nam h GLY 233 Ca -0.38 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.87 3nam h GLY 233 CO 0.06 0.00 -0.36 0.50 0.00 0.00 0.00 176.54 176.74 3nam h LYS 234 N 0.00 0.00 0.15 4.80 1.57 -1.01 -2.11 116.57 119.97 3nam h LYS 234 Ca -0.00 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.47 3nam h LYS 234 Cb 0.91 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.25 3nam h LYS 234 CO 0.05 0.36 -1.29 0.82 -0.57 0.00 0.00 179.45 178.83 3nam h ILE 235 N 0.00 1.31 -0.34 1.86 2.04 -1.51 -3.01 117.51 117.85 3nam h ILE 235 Ca -0.00 -2.57 -0.00 0.00 1.00 0.00 0.00 64.86 63.28 3nam h ILE 235 Cb 0.91 2.79 -0.02 0.00 -0.74 0.00 0.00 36.82 39.76 3nam h ILE 235 CO 0.05 0.78 0.21 -0.09 0.00 0.00 0.00 178.15 179.09 3nam h ARG 236 N 0.23 0.46 -0.06 2.37 2.43 -1.11 -2.13 114.38 116.56 3nam h ARG 236 Ca -0.20 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 58.82 3nam h ARG 236 Cb 1.97 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 31.41 3nam h ARG 236 CO 0.24 0.32 -0.53 -0.44 -1.51 0.00 0.00 179.97 178.05 3nam h ASP 237 N 0.47 0.18 0.24 -3.80 3.32 -1.31 -2.23 116.42 113.28 3nam h ASP 237 Ca 0.12 -0.09 -0.25 0.00 0.02 0.00 0.00 57.03 56.84 3nam h ASP 237 Cb -0.02 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.49 3nam h ASP 237 CO -0.02 0.68 -1.01 1.56 -1.72 0.00 0.00 179.24 178.72 3nam h GLN 238 N 0.13 0.51 0.00 3.56 4.20 -1.28 -1.37 115.11 120.85 3nam h GLN 238 Ca 0.00 -0.57 -0.04 0.00 0.06 0.00 0.00 58.65 58.11 3nam h GLN 238 Cb 0.98 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.92 3nam h GLN 238 CO 0.08 1.20 -0.18 0.52 -0.67 0.00 0.00 178.83 179.77 3nam h MET 239 N 0.28 0.00 0.03 1.46 2.86 -1.39 -2.36 114.93 115.81 3nam h MET 239 Ca -0.11 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.22 3nam h MET 239 Cb 1.66 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 33.28 3nam h MET 239 CO 0.18 0.18 -1.77 0.00 1.06 0.00 0.00 176.91 176.56 3nam n ALA 240 N -2.20 1.33 0.59 6.32 0.00 -0.84 -3.84 120.51 121.86 3nam n ALA 240 Ca 0.00 -0.71 0.12 0.00 0.00 0.00 0.00 53.44 52.86 3nam n ALA 240 Cb 0.42 -0.82 0.45 0.00 0.00 0.00 0.00 19.45 19.50 3nam n ALA 240 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3nam n ALA 241 N -2.67 2.03 -1.80 0.00 0.00 -0.53 -4.77 120.51 112.77 3nam n ALA 241 Ca -0.21 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.89 3nam n ALA 241 Cb 1.05 -1.42 -0.07 0.00 0.00 0.00 0.00 19.45 19.01 3nam n ALA 241 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3nam s THR 242 N -3.15 4.27 -0.09 0.00 -1.32 -0.90 -5.07 115.64 109.38 3nam s THR 242 Ca 0.09 1.58 0.02 0.00 -1.21 0.00 0.00 61.69 62.16 3nam s THR 242 Cb 0.12 -3.74 0.01 0.00 -1.51 0.00 0.00 72.50 67.39 3nam s THR 242 CO 0.49 -0.14 -0.14 -1.83 -2.21 0.00 0.00 174.62 170.78 3nam s GLU 243 N -2.77 2.06 -0.22 7.08 -1.05 -1.26 -4.99 118.70 117.55 3nam s GLU 243 Ca 0.58 -0.51 -0.23 0.00 -0.15 0.00 0.00 54.97 54.65 3nam s GLU 243 Cb -0.13 -1.74 -0.01 0.00 -0.44 0.00 0.00 34.13 31.81 3nam s GLU 243 CO 0.18 -0.03 0.76 -0.65 0.95 0.00 0.00 175.26 176.47 3nam s GLN 244 N 0.89 4.20 0.00 -4.83 -1.52 -1.26 -5.05 119.66 112.09 3nam s GLN 244 Ca -0.09 0.84 0.00 0.00 -1.95 0.00 0.00 55.36 54.16 3nam s GLN 244 Cb -0.15 -3.62 0.00 0.00 -0.22 0.00 0.00 33.01 29.02 3nam s GLN 244 CO 0.00 -0.42 0.00 -0.25 -0.25 0.00 0.00 175.29 174.38 3nam n ASP 245 N 5.65 0.00 -3.63 5.90 8.00 -1.26 -5.06 116.55 126.14 3nam n ASP 245 Ca 0.03 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.51 3nam n ASP 245 Cb 0.48 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.52 3nam n ASP 245 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 3nam s LYS 246 N 0.00 0.35 -0.02 -1.24 -2.85 -1.26 -5.12 119.74 109.59 3nam s LYS 246 Ca 0.00 0.61 -0.30 0.00 -1.00 0.00 0.00 55.97 55.29 3nam s LYS 246 Cb 0.00 0.09 -0.15 0.00 -2.06 0.00 0.00 37.83 35.71 3nam s LYS 246 CO 0.00 -0.08 0.81 -2.37 0.10 0.00 0.00 175.35 173.82 3nam n THR 247 N 3.73 0.00 -0.37 3.79 5.66 -1.26 -4.56 114.28 121.27 3nam n THR 247 Ca -0.18 0.00 0.33 0.00 -3.05 0.00 0.00 64.05 61.15 3nam n THR 247 Cb 0.57 -0.02 0.59 0.00 -1.55 0.00 0.00 70.33 69.93 3nam n THR 247 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 3nam h PRO 248 N 2.30 0.08 -0.76 1.09 0.13 -1.93 0.38 132.00 133.29 3nam h PRO 248 Ca -0.38 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.74 3nam h PRO 248 Cb 1.06 -0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.13 3nam h PRO 248 CO 0.49 0.05 0.42 1.25 -0.23 0.00 0.00 178.00 179.98 3nam h LEU 249 N 0.08 0.93 -1.61 1.56 5.85 -1.91 0.19 115.31 120.40 3nam h LEU 249 Ca 0.83 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 59.46 3nam h LEU 249 Cb 2.28 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 43.07 3nam h LEU 249 CO -0.63 0.75 -0.05 1.56 -0.34 0.00 0.00 178.44 179.72 3nam h GLN 250 N 1.05 0.00 0.15 1.25 4.20 -0.54 -1.51 115.11 119.71 3nam h GLN 250 Ca 0.27 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.75 3nam h GLN 250 Cb 0.02 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.82 3nam h GLN 250 CO -0.04 0.05 -1.03 1.96 -0.67 0.00 0.00 178.83 179.10 3nam h GLN 251 N 0.00 0.31 0.00 1.46 4.20 -0.44 -3.06 115.11 117.59 3nam h GLN 251 Ca -0.00 -0.54 0.00 0.00 0.06 0.00 0.00 58.65 58.17 3nam h GLN 251 Cb 0.48 0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.46 3nam h GLN 251 CO 0.01 1.26 0.00 1.63 -0.67 0.00 0.00 178.83 181.05 3nam n LYS 252 N -4.03 0.10 -0.00 1.46 5.02 0.37 -1.67 118.16 119.41 3nam n LYS 252 Ca -0.17 0.42 -0.10 0.00 -2.02 0.00 0.00 58.31 56.45 3nam n LYS 252 Cb 0.87 -1.73 -0.14 0.00 -0.02 0.00 0.00 35.03 34.01 3nam n LYS 252 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3nam h LEU 253 N 0.00 0.05 -0.18 -0.35 6.46 -1.28 -2.09 115.31 117.92 3nam h LEU 253 Ca 0.00 -0.10 -0.20 0.00 -0.12 0.00 0.00 57.88 57.46 3nam h LEU 253 Cb 0.22 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.11 3nam h LEU 253 CO 0.00 1.09 -0.93 0.44 -0.62 0.00 0.00 178.44 178.41 3nam h ASP 254 N 0.01 0.10 -0.14 1.25 3.32 -1.27 -2.69 116.42 117.01 3nam h ASP 254 Ca -0.26 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 56.65 3nam h ASP 254 Cb 1.98 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 41.50 3nam h ASP 254 CO 0.09 0.98 -0.11 -0.08 -1.72 0.00 0.00 179.24 178.40 3nam h GLU 255 N 0.03 0.32 -0.31 3.56 4.81 -1.38 -2.59 114.58 119.02 3nam h GLU 255 Ca -0.03 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 3nam h GLU 255 Cb 1.62 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.98 3nam h GLU 255 CO 0.13 0.69 0.09 0.35 -0.73 0.00 0.00 179.01 179.54 3nam h PHE 256 N -0.05 0.44 -0.12 0.92 3.57 -1.42 -2.48 116.94 117.81 3nam h PHE 256 Ca 0.03 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 3nam h PHE 256 Cb 0.61 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 3nam h PHE 256 CO 0.08 0.38 -0.04 0.78 -2.23 0.00 0.00 178.31 177.28 3nam h GLY 257 N 0.65 0.26 0.69 2.40 0.00 -1.40 0.17 103.07 105.84 3nam h GLY 257 Ca 0.11 -0.22 0.07 0.00 0.00 0.00 0.00 47.33 47.29 3nam h GLY 257 CO -0.01 0.20 0.65 0.83 0.00 0.00 0.00 176.54 178.21 3nam h GLU 258 N -0.09 1.12 0.18 4.80 4.39 -1.26 -2.18 114.58 121.53 3nam h GLU 258 Ca 0.03 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 3nam h GLU 258 Cb 0.48 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 3nam h GLU 258 CO 0.01 0.74 -0.09 1.96 -1.16 0.00 0.00 179.01 180.48 3nam h GLN 259 N 1.15 -0.23 0.00 2.33 1.08 -1.36 -2.75 115.11 115.33 3nam h GLN 259 Ca 0.45 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.66 3nam h GLN 259 Cb 0.22 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 3nam h GLN 259 CO -0.19 0.19 0.00 -0.11 -0.95 0.00 0.00 178.83 177.77 3nam n LEU 260 N -4.95 0.00 -0.11 1.46 7.94 0.60 -0.76 117.00 121.18 3nam n LEU 260 Ca -0.08 0.00 -0.19 0.00 -1.11 0.00 0.00 56.01 54.63 3nam n LEU 260 Cb 0.26 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.13 3nam n LEU 260 CO 0.27 0.00 -1.22 -0.24 -1.11 0.00 0.00 177.39 175.08 3nam n SER 261 N -0.81 2.00 -0.12 1.96 2.88 -0.84 -4.01 113.62 114.67 3nam n SER 261 Ca 0.00 0.07 -0.11 0.00 -1.33 0.00 0.00 58.87 57.51 3nam n SER 261 Cb 0.00 -0.49 -0.02 0.00 -0.75 0.00 0.00 64.21 62.95 3nam n SER 261 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3nam h LYS 262 N -0.38 0.64 -0.35 -1.46 1.57 -0.64 -2.82 116.57 113.13 3nam h LYS 262 Ca -0.52 -0.20 0.01 0.00 -1.87 0.00 0.00 60.65 58.07 3nam h LYS 262 Cb 1.62 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.85 3nam h LYS 262 CO -0.20 0.75 0.22 0.28 -0.57 0.00 0.00 179.45 179.93 3nam h VAL 263 N 0.46 1.08 -0.13 0.50 2.07 -1.39 -1.66 116.25 117.17 3nam h VAL 263 Ca 0.10 -0.16 0.04 0.00 0.82 0.00 0.00 66.70 67.51 3nam h VAL 263 Cb 0.46 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 30.76 3nam h VAL 263 CO 0.02 0.08 -0.19 0.40 0.02 0.00 0.00 177.57 177.91 3nam h ILE 264 N 0.46 0.52 0.00 4.57 2.04 -1.67 0.48 117.51 123.91 3nam h ILE 264 Ca 0.13 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.95 3nam h ILE 264 Cb -0.04 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3nam h ILE 264 CO -0.04 0.00 -0.21 0.77 0.00 0.00 0.00 178.15 178.68 3nam h SER 265 N -0.24 0.00 -0.05 1.72 4.64 -1.40 -2.56 113.55 115.66 3nam h SER 265 Ca 0.10 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 3nam h SER 265 Cb 0.38 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3nam h SER 265 CO -0.27 0.21 -0.02 -0.07 -0.87 0.00 0.00 176.83 175.81 3nam h LEU 266 N 0.00 0.10 -1.84 5.97 3.38 -0.28 -2.50 115.31 120.14 3nam h LEU 266 Ca -0.00 -0.41 0.30 0.00 0.09 0.00 0.00 57.88 57.86 3nam h LEU 266 Cb 0.40 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 3nam h LEU 266 CO 0.03 0.48 0.75 0.40 0.09 0.00 0.00 178.44 180.19 3nam h ILE 267 N -0.29 0.48 0.17 1.22 2.04 -0.55 0.40 117.51 120.98 3nam h ILE 267 Ca 0.01 -0.03 -0.27 0.00 1.00 0.00 0.00 64.86 65.56 3nam h ILE 267 Cb 0.44 0.37 0.03 0.00 -0.74 0.00 0.00 36.82 36.92 3nam h ILE 267 CO 0.01 0.02 -1.17 0.00 0.00 0.00 0.00 178.15 177.00 3nam h VAL 269 N 0.01 1.13 0.53 0.00 2.07 -0.31 0.47 116.25 120.16 3nam h VAL 269 Ca -0.20 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 3nam h VAL 269 Cb 1.90 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 32.31 3nam h VAL 269 CO 0.22 0.13 -0.30 0.00 0.02 0.00 0.00 177.57 177.64 3nam h ALA 270 N 1.09 -0.79 -0.99 1.67 0.00 -0.36 -1.33 119.26 118.56 3nam h ALA 270 Ca 0.14 -0.16 0.17 0.00 0.00 0.00 0.00 54.91 55.06 3nam h ALA 270 Cb 0.01 0.36 -0.09 0.00 0.00 0.00 0.00 17.79 18.07 3nam h ALA 270 CO -0.03 -0.95 0.61 0.28 0.00 0.00 0.00 179.25 179.17 3nam h VAL 271 N -0.79 0.76 -0.67 0.00 2.07 -0.84 0.50 116.25 117.29 3nam h VAL 271 Ca -0.07 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.13 3nam h VAL 271 Cb 0.63 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3nam h VAL 271 CO 0.08 0.14 0.19 -0.25 0.02 0.00 0.00 177.57 177.75 3nam h TRP 272 N 0.77 1.09 -0.23 1.57 7.01 -0.41 -2.68 115.95 123.07 3nam h TRP 272 Ca 0.54 -0.12 -0.17 0.00 2.11 0.00 0.00 58.89 61.25 3nam h TRP 272 Cb 0.84 -0.31 -0.00 0.00 -2.10 0.00 0.00 29.16 27.58 3nam h TRP 272 CO -0.00 0.89 -0.55 -0.07 -2.79 0.00 0.00 178.44 175.92 3nam h LEU 273 N 0.98 0.78 -2.18 0.65 3.38 0.07 -2.83 115.31 116.16 3nam h LEU 273 Ca 0.21 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 3nam h LEU 273 Cb 0.32 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 3nam h LEU 273 CO -0.00 1.17 -0.02 0.40 0.09 0.00 0.00 178.44 180.08 3nam h ILE 274 N 0.54 0.78 -1.35 1.22 1.08 -0.85 -1.78 117.51 117.15 3nam h ILE 274 Ca 0.01 -0.07 -0.64 0.00 -0.39 0.00 0.00 64.86 63.78 3nam h ILE 274 Cb 1.12 1.04 -0.37 0.00 -3.07 0.00 0.00 36.82 35.54 3nam h ILE 274 CO 0.11 0.02 -0.08 0.59 -0.69 0.00 0.00 178.15 178.10 3nam n ASN 275 N -4.18 5.91 0.11 1.72 3.02 -1.02 -4.69 115.26 116.13 3nam n ASN 275 Ca -0.03 -3.77 0.12 0.00 -0.03 0.00 0.00 54.58 50.87 3nam n ASN 275 Cb 0.10 -0.65 0.17 0.00 -0.61 0.00 0.00 39.78 38.79 3nam n ASN 275 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3nam h ILE 276 N 2.09 0.00 0.00 2.41 6.09 -1.23 -3.28 117.51 123.59 3nam h ILE 276 Ca 0.43 -0.72 -0.00 0.00 -1.37 0.00 0.00 64.86 63.19 3nam h ILE 276 Cb 0.86 1.45 -0.00 0.00 0.47 0.00 0.00 36.82 39.59 3nam h ILE 276 CO 1.08 0.00 -0.02 1.23 -3.07 0.00 0.00 178.15 177.37 3nam h GLY 277 N 4.28 0.00 1.20 8.18 0.00 -1.83 -1.63 103.07 113.26 3nam h GLY 277 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.36 3nam h GLY 277 CO 0.00 0.00 0.37 0.45 0.00 0.00 0.00 176.54 177.36 3nam h HIS 278 N 0.00 0.00 0.00 5.60 3.86 -1.96 1.17 115.15 123.82 3nam h HIS 278 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3nam h HIS 278 Cb 0.07 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.54 3nam h HIS 278 CO 0.00 0.00 0.00 1.19 0.86 0.00 0.00 177.93 179.98 3nam n PHE 279 N -3.12 0.00 -2.19 2.45 3.01 -0.61 -2.80 117.46 114.20 3nam n PHE 279 Ca 0.01 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.22 3nam n PHE 279 Cb 0.45 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.94 3nam n PHE 279 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3nam n ASN 280 N -0.89 4.74 -4.44 4.37 3.02 0.40 -5.05 115.26 117.41 3nam n ASN 280 Ca 0.17 -3.69 -0.22 0.00 -0.03 0.00 0.00 54.58 50.82 3nam n ASN 280 Cb 0.08 -0.38 -0.10 0.00 -0.61 0.00 0.00 39.78 38.76 3nam n ASN 280 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3nam s ASP 281 N -3.58 2.79 0.20 6.41 1.01 -1.12 -5.07 116.67 117.31 3nam s ASP 281 Ca 0.49 -1.22 -0.32 0.00 0.71 0.00 0.00 52.55 52.21 3nam s ASP 281 Cb 0.41 -0.17 -0.13 0.00 1.01 0.00 0.00 42.92 44.04 3nam s ASP 281 CO -0.03 -0.38 1.66 -2.65 0.21 0.00 0.00 175.17 173.98 3nam n PRO 282 N -0.62 2.56 0.16 8.23 -0.02 -1.26 -4.89 135.00 139.15 3nam n PRO 282 Ca -0.05 0.92 0.02 0.00 -2.02 0.00 0.00 63.50 62.37 3nam n PRO 282 Cb 0.64 -2.74 0.37 0.00 -0.02 0.00 0.00 33.50 31.76 3nam n PRO 282 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 3nam h VAL 283 N 3.70 1.22 -0.00 -1.45 -1.51 -1.99 -2.80 116.25 113.41 3nam h VAL 283 Ca -0.44 -1.03 0.00 0.00 -1.23 0.00 0.00 66.70 64.00 3nam h VAL 283 Cb 1.22 1.47 0.00 0.00 -2.13 0.00 0.00 31.29 31.85 3nam h VAL 283 CO 0.92 0.31 -0.57 1.41 -1.23 0.00 0.00 177.57 178.40 3nam n HIS 284 N -4.19 0.00 -0.03 5.19 8.25 -1.26 -4.71 115.22 118.47 3nam n HIS 284 Ca -0.02 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.44 3nam n HIS 284 Cb 0.34 -0.14 -0.01 0.00 1.12 0.00 0.00 29.99 31.31 3nam n HIS 284 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3nam n GLY 285 N 1.46 -0.62 0.00 -1.41 0.00 -1.06 -4.95 105.19 98.61 3nam n GLY 285 Ca 0.07 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3nam n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3nam n GLY 286 N -1.02 2.00 2.31 -0.02 0.00 -1.26 -4.99 105.19 102.20 3nam n GLY 286 Ca 0.00 -2.07 0.00 0.00 0.00 0.00 0.00 46.02 43.95 3nam n GLY 286 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3nam n SER 287 N 0.00 -0.42 -0.28 1.61 3.41 -1.26 -4.92 113.62 111.76 3nam n SER 287 Ca 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.67 3nam n SER 287 Cb 0.00 -0.07 0.17 0.00 -0.26 0.00 0.00 64.21 64.05 3nam n SER 287 CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 3nam h TRP 288 N 0.00 -0.10 0.00 7.33 5.08 -1.98 0.23 115.95 126.51 3nam h TRP 288 Ca 0.00 0.06 -0.12 0.00 1.08 0.00 0.00 58.89 59.91 3nam h TRP 288 Cb 0.00 0.17 -0.02 0.00 -3.00 0.00 0.00 29.16 26.31 3nam h TRP 288 CO 0.00 -0.28 -0.58 0.97 -1.28 0.00 0.00 178.44 177.26 3nam h ILE 289 N 0.08 1.29 -0.12 0.12 6.09 -2.01 -3.07 117.51 119.88 3nam h ILE 289 Ca 0.44 -2.08 -0.18 0.00 -1.37 0.00 0.00 64.86 61.67 3nam h ILE 289 Cb 0.79 2.16 -0.00 0.00 0.47 0.00 0.00 36.82 40.24 3nam h ILE 289 CO -0.73 0.57 -0.66 0.03 -3.07 0.00 0.00 178.15 174.29 3nam h ARG 290 N 0.00 0.49 -0.76 2.19 2.47 -1.06 -3.16 114.38 114.53 3nam h ARG 290 Ca -0.01 -0.36 -0.01 0.00 -1.26 0.00 0.00 59.98 58.35 3nam h ARG 290 Cb 1.12 0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 29.46 3nam h ARG 290 CO 0.08 0.98 0.45 0.78 0.56 0.00 0.00 179.97 182.82 3nam h GLY 291 N 1.14 1.12 1.92 0.04 0.00 -0.83 -1.93 103.07 104.54 3nam h GLY 291 Ca -0.02 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.77 3nam h GLY 291 CO 0.12 0.46 -0.25 0.00 0.00 0.00 0.00 176.54 176.87 3nam h ALA 292 N 1.24 1.48 0.00 3.60 0.00 -1.57 -2.09 119.26 121.92 3nam h ALA 292 Ca 0.27 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 3nam h ALA 292 Cb -0.02 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3nam h ALA 292 CO -0.05 0.38 -0.54 0.82 0.00 0.00 0.00 179.25 179.85 3nam h ILE 293 N 0.08 1.15 0.07 0.00 2.04 -1.38 -0.08 117.51 119.40 3nam h ILE 293 Ca 0.01 -2.04 -0.00 0.00 1.00 0.00 0.00 64.86 63.83 3nam h ILE 293 Cb 0.50 2.18 0.00 0.00 -0.74 0.00 0.00 36.82 38.76 3nam h ILE 293 CO 0.04 0.53 -0.04 0.22 0.00 0.00 0.00 178.15 178.90 3nam h TYR 294 N 0.00 -0.09 -0.48 1.37 3.20 -0.72 -0.89 116.97 119.35 3nam h TYR 294 Ca -0.01 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.73 3nam h TYR 294 Cb 1.14 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.43 3nam h TYR 294 CO 0.00 0.36 -0.20 1.88 -1.64 0.00 0.00 178.16 178.56 3nam h TYR 295 N -0.59 1.12 -0.52 -3.82 0.05 -1.38 -0.07 116.97 111.76 3nam h TYR 295 Ca -0.01 -0.26 -0.09 0.00 0.05 0.00 0.00 58.73 58.42 3nam h TYR 295 Cb 0.49 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.95 3nam h TYR 295 CO 0.08 1.08 -0.04 0.74 -1.05 0.00 0.00 178.16 178.98 3nam h PHE 296 N 0.85 0.98 0.00 4.88 0.04 -1.08 -1.79 116.94 120.83 3nam h PHE 296 Ca 0.11 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 60.71 3nam h PHE 296 Cb 0.77 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 38.66 3nam h PHE 296 CO 0.05 0.91 -0.03 -0.22 -0.60 0.00 0.00 178.31 178.42 3nam h LYS 297 N 0.83 0.00 0.00 1.51 3.64 -0.88 -2.69 116.57 118.97 3nam h LYS 297 Ca 0.15 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3nam h LYS 297 Cb 0.54 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 3nam h LYS 297 CO 0.03 0.03 -0.84 0.97 -2.27 0.00 0.00 179.45 177.37 3nam h ILE 298 N 0.00 0.00 -0.46 2.00 2.10 -0.82 -3.27 117.51 117.06 3nam h ILE 298 Ca -0.00 -0.96 -0.11 0.00 1.08 0.00 0.00 64.86 64.87 3nam h ILE 298 Cb 0.78 1.53 -0.02 0.00 -1.09 0.00 0.00 36.82 38.03 3nam h ILE 298 CO 0.00 0.00 -0.13 0.00 -1.08 0.00 0.00 178.15 176.94 3nam h ALA 299 N 2.04 0.89 -0.13 0.18 0.00 -0.98 0.11 119.26 121.37 3nam h ALA 299 Ca 0.00 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 3nam h ALA 299 Cb 0.98 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3nam h ALA 299 CO 0.00 0.63 -0.49 -0.39 0.00 0.00 0.00 179.25 179.00 3nam h VAL 300 N 0.77 1.33 -0.46 0.00 -1.51 -1.63 -2.26 116.25 112.50 3nam h VAL 300 Ca 0.12 -1.72 -0.12 0.00 -1.23 0.00 0.00 66.70 63.75 3nam h VAL 300 Cb 0.65 1.78 -0.01 0.00 -2.13 0.00 0.00 31.29 31.57 3nam h VAL 300 CO 0.05 0.52 -0.19 0.00 -1.23 0.00 0.00 177.57 176.72 3nam h ALA 301 N 1.20 0.64 -0.40 5.19 0.00 -1.53 -2.11 119.26 122.25 3nam h ALA 301 Ca 0.01 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.56 3nam h ALA 301 Cb 0.97 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 3nam h ALA 301 CO 0.08 0.60 0.26 1.25 0.00 0.00 0.00 179.25 181.44 3nam h LEU 302 N 0.78 0.44 -0.55 0.00 5.85 -0.54 -1.95 115.31 119.33 3nam h LEU 302 Ca 0.11 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.70 3nam h LEU 302 Cb 0.76 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 3nam h LEU 302 CO 0.06 0.32 -0.18 0.00 -0.34 0.00 0.00 178.44 178.30 3nam h ALA 303 N 1.16 0.75 -0.00 1.25 0.00 -1.32 -0.99 119.26 120.11 3nam h ALA 303 Ca 0.15 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3nam h ALA 303 Cb -0.04 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.58 3nam h ALA 303 CO -0.05 0.67 -0.08 1.33 0.00 0.00 0.00 179.25 181.12 3nam n VAL 304 N -4.12 0.00 -0.08 0.00 0.24 -0.80 -2.79 118.33 110.78 3nam n VAL 304 Ca 0.01 -0.03 -0.12 0.00 -2.04 0.00 0.00 64.34 62.16 3nam n VAL 304 Cb 0.44 -0.26 -0.15 0.00 -1.47 0.00 0.00 33.84 32.40 3nam n VAL 304 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3nam n ALA 305 N -1.14 1.44 0.09 2.33 0.00 -0.74 -4.48 120.51 118.01 3nam n ALA 305 Ca 0.14 -1.11 -0.18 0.00 0.00 0.00 0.00 53.44 52.29 3nam n ALA 305 Cb 0.27 -0.37 -0.11 0.00 0.00 0.00 0.00 19.45 19.24 3nam n ALA 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3nam h ALA 306 N 0.77 0.12 -2.67 0.00 0.00 -1.17 -3.42 119.26 112.90 3nam h ALA 306 Ca -0.48 -0.78 -0.54 0.00 0.00 0.00 0.00 54.91 53.11 3nam h ALA 306 Cb 2.12 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.93 3nam h ALA 306 CO 0.03 0.79 0.16 0.42 0.00 0.00 0.00 179.25 180.64 3nam s ILE 307 N -3.00 4.71 -0.92 0.00 1.01 -1.12 -4.87 121.20 117.01 3nam s ILE 307 Ca -0.07 1.63 -0.20 0.00 0.00 0.00 0.00 60.65 62.00 3nam s ILE 307 Cb 0.07 -4.11 0.10 0.00 0.01 0.00 0.00 42.46 38.53 3nam s ILE 307 CO 0.90 0.38 1.20 -2.16 0.00 0.00 0.00 174.94 175.26 3nam s PRO 308 N -0.15 3.54 0.36 2.79 0.04 -1.26 -4.89 135.00 135.43 3nam s PRO 308 Ca 0.38 -1.46 0.14 0.00 0.04 0.00 0.00 61.00 60.10 3nam s PRO 308 Cb -0.21 -4.94 0.68 0.00 0.04 0.00 0.00 34.50 30.07 3nam s PRO 308 CO 0.23 -1.90 1.78 0.93 0.04 0.00 0.00 177.00 178.08 3nam h GLU 309 N 9.20 0.00 0.00 4.56 3.07 -1.91 -3.20 114.58 126.29 3nam h GLU 309 Ca 0.11 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.93 3nam h GLU 309 Cb 1.03 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.93 3nam h GLU 309 CO 1.20 0.41 -0.43 0.78 -1.40 0.00 0.00 179.01 179.58 3nam h GLY 310 N 1.42 0.00 -0.39 -3.84 0.00 -1.84 -3.39 103.07 95.03 3nam h GLY 310 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.41 3nam h GLY 310 CO 0.05 0.00 -0.41 -2.00 0.00 0.00 0.00 176.54 174.18 3nam h LEU 311 N 0.00 -1.39 -1.37 3.11 5.85 -1.80 -0.90 115.31 118.81 3nam h LEU 311 Ca -0.02 0.23 0.29 0.00 0.84 0.00 0.00 57.88 59.22 3nam h LEU 311 Cb 1.16 0.63 -0.10 0.00 0.37 0.00 0.00 40.66 42.73 3nam h LEU 311 CO 0.02 -0.34 0.69 -0.65 -0.34 0.00 0.00 178.44 177.82 3nam h PRO 312 N -0.25 0.34 -0.06 5.25 0.11 -1.80 0.48 132.00 136.07 3nam h PRO 312 Ca 0.17 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.24 3nam h PRO 312 Cb 0.57 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.60 3nam h PRO 312 CO -0.64 0.23 -0.05 0.00 -0.21 0.00 0.00 178.00 177.33 3nam h ALA 313 N 1.62 0.09 -0.49 -0.75 0.00 -1.45 -2.62 119.26 115.66 3nam h ALA 313 Ca 0.62 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 3nam h ALA 313 Cb 1.63 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 3nam h ALA 313 CO -0.31 -0.13 0.12 0.28 0.00 0.00 0.00 179.25 179.21 3nam h VAL 314 N -0.27 1.21 -0.02 0.00 2.07 -0.51 -2.01 116.25 116.71 3nam h VAL 314 Ca 0.01 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 3nam h VAL 314 Cb 0.53 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3nam h VAL 314 CO 0.01 0.27 -0.08 0.40 0.02 0.00 0.00 177.57 178.19 3nam h ILE 315 N 0.71 1.49 0.00 4.57 2.04 -1.04 -2.72 117.51 122.56 3nam h ILE 315 Ca 0.16 -1.57 -0.01 0.00 1.00 0.00 0.00 64.86 64.44 3nam h ILE 315 Cb 0.26 2.48 -0.00 0.00 -0.74 0.00 0.00 36.82 38.82 3nam h ILE 315 CO -0.00 0.42 -0.03 0.71 0.00 0.00 0.00 178.15 179.25 3nam h THR 316 N -0.51 0.08 0.00 -0.27 1.35 -1.42 -1.06 112.91 111.08 3nam h THR 316 Ca -0.00 -0.63 -0.02 0.00 -0.55 0.00 0.00 66.41 65.21 3nam h THR 316 Cb 0.73 1.58 -0.00 0.00 -1.73 0.00 0.00 68.15 68.73 3nam h THR 316 CO 0.02 0.03 -0.75 0.71 -0.25 0.00 0.00 175.52 175.28 3nam h THR 317 N 0.00 0.06 0.10 6.82 1.35 -1.44 -1.93 112.91 117.88 3nam h THR 317 Ca -0.00 -1.11 -0.26 0.00 -0.55 0.00 0.00 66.41 64.48 3nam h THR 317 Cb 0.58 1.70 0.03 0.00 -1.73 0.00 0.00 68.15 68.72 3nam h THR 317 CO 0.00 0.04 -1.09 0.00 -0.25 0.00 0.00 175.52 174.22 3nam h LEU 319 N 0.16 -0.19 -1.70 0.00 3.38 -1.30 -2.17 115.31 113.49 3nam h LEU 319 Ca -0.16 -0.31 0.22 0.00 0.09 0.00 0.00 57.88 57.72 3nam h LEU 319 Cb 1.79 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 42.53 3nam h LEU 319 CO 0.21 0.25 0.60 0.00 0.09 0.00 0.00 178.44 179.59 3nam h ALA 320 N 0.03 2.44 0.27 1.53 0.00 -1.45 0.73 119.26 122.80 3nam h ALA 320 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3nam h ALA 320 Cb 0.49 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3nam h ALA 320 CO 0.04 -0.72 -0.13 -0.07 0.00 0.00 0.00 179.25 178.37 3nam h LEU 321 N 0.24 -0.30 -1.08 0.00 3.38 -1.39 -2.86 115.31 113.29 3nam h LEU 321 Ca 0.44 -0.23 0.09 0.00 0.09 0.00 0.00 57.88 58.28 3nam h LEU 321 Cb 1.36 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 42.11 3nam h LEU 321 CO -0.11 0.14 0.62 1.23 0.09 0.00 0.00 178.44 180.41 3nam h GLY 322 N -0.83 1.48 -0.12 0.83 0.00 -0.49 0.12 103.07 104.06 3nam h GLY 322 Ca -0.04 -0.42 0.03 0.00 0.00 0.00 0.00 47.33 46.90 3nam h GLY 322 CO 0.06 0.23 -0.53 -0.84 0.00 0.00 0.00 176.54 175.46 3nam h THR 323 N 1.01 0.00 -0.43 4.70 2.02 0.42 0.62 112.91 121.25 3nam h THR 323 Ca 0.45 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.69 3nam h THR 323 Cb 0.36 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 3nam h THR 323 CO -0.20 0.00 0.29 0.03 0.37 0.00 0.00 175.52 176.01 3nam h ARG 324 N -0.58 0.29 -0.14 6.66 3.08 -1.02 -0.23 114.38 122.44 3nam h ARG 324 Ca 0.03 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 59.94 3nam h ARG 324 Cb 0.67 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 3nam h ARG 324 CO -0.42 0.19 -0.45 -0.09 -1.07 0.00 0.00 179.97 178.13 3nam h ARG 325 N 0.30 0.33 0.14 0.04 2.43 0.11 -3.07 114.38 114.65 3nam h ARG 325 Ca 0.19 -0.17 -0.30 0.00 -0.81 0.00 0.00 59.98 58.89 3nam h ARG 325 Cb 0.38 0.01 0.03 0.00 -0.42 0.00 0.00 29.97 29.96 3nam h ARG 325 CO -0.04 0.72 -1.27 0.52 -1.51 0.00 0.00 179.97 178.39 3nam h MET 326 N 0.27 0.57 0.00 0.20 2.86 0.17 -3.24 114.93 115.76 3nam h MET 326 Ca 0.02 -0.79 0.00 0.00 -2.06 0.00 0.00 59.70 56.87 3nam h MET 326 Cb 0.90 0.27 0.00 0.00 0.06 0.00 0.00 31.60 32.83 3nam h MET 326 CO 0.07 1.36 0.08 0.00 1.06 0.00 0.00 176.91 179.48 3nam h ALA 327 N 0.33 1.06 0.00 6.32 0.00 -1.04 0.98 119.26 126.91 3nam h ALA 327 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3nam h ALA 327 Cb 1.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.73 3nam h ALA 327 CO 0.24 -0.06 -0.34 1.63 0.00 0.00 0.00 179.25 180.72 3nam n LYS 328 N -2.36 0.09 -1.48 0.00 5.02 -1.17 -3.57 118.16 114.69 3nam n LYS 328 Ca -0.02 0.04 -0.18 0.00 -2.02 0.00 0.00 58.31 56.14 3nam n LYS 328 Cb 0.12 -1.57 0.09 0.00 -0.02 0.00 0.00 35.03 33.65 3nam n LYS 328 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3nam n LYS 329 N -1.71 2.83 -3.14 1.97 5.02 0.34 -4.95 118.16 118.52 3nam n LYS 329 Ca 0.05 -3.72 -0.21 0.00 -2.02 0.00 0.00 58.31 52.42 3nam n LYS 329 Cb 0.37 -2.10 0.00 0.00 -0.02 0.00 0.00 35.03 33.28 3nam n LYS 329 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3nam n ASN 330 N -0.88 -4.08 -4.00 4.39 3.02 -1.18 -4.94 115.26 107.58 3nam n ASN 330 Ca 0.41 -0.26 -0.31 0.00 -0.03 0.00 0.00 54.58 54.39 3nam n ASN 330 Cb 0.91 -3.38 -0.15 0.00 -0.61 0.00 0.00 39.78 36.55 3nam n ASN 330 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3nam s ALA 331 N -2.90 2.85 -0.63 5.41 0.00 -1.11 -2.48 121.76 122.89 3nam s ALA 331 Ca 0.31 -2.52 -0.22 0.00 0.00 0.00 0.00 51.96 49.52 3nam s ALA 331 Cb -0.16 -1.96 0.07 0.00 0.00 0.00 0.00 23.12 21.07 3nam s ALA 331 CO 0.38 -1.70 0.92 0.42 0.00 0.00 0.00 175.76 175.78 3nam s ILE 332 N 0.89 4.40 -0.21 0.00 1.01 -0.79 -3.04 121.20 123.45 3nam s ILE 332 Ca 0.11 -0.32 -0.24 0.00 0.00 0.00 0.00 60.65 60.19 3nam s ILE 332 Cb -0.19 -4.63 -0.01 0.00 0.01 0.00 0.00 42.46 37.64 3nam s ILE 332 CO -0.09 -1.35 0.81 -0.69 0.00 0.00 0.00 174.94 173.63 3nam s VAL 333 N 3.87 4.87 0.00 2.92 1.01 -1.26 -0.75 120.40 131.06 3nam s VAL 333 Ca 0.22 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.75 3nam s VAL 333 Cb -0.17 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.11 3nam s VAL 333 CO 0.11 -0.02 0.00 0.54 0.00 0.00 0.00 175.10 175.73 3nam n ARG 334 N 5.66 0.00 -2.15 2.72 1.74 0.43 -4.83 116.66 120.22 3nam n ARG 334 Ca 0.04 0.26 -0.43 0.00 -0.77 0.00 0.00 57.85 56.95 3nam n ARG 334 Cb 0.48 -0.73 -0.02 0.00 -1.02 0.00 0.00 32.46 31.17 3nam n ARG 334 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3nam s SER 335 N -2.25 6.51 0.02 0.55 0.15 -1.18 -4.96 113.70 112.54 3nam s SER 335 Ca 0.00 1.70 -0.25 0.00 0.70 0.00 0.00 55.95 58.09 3nam s SER 335 Cb 0.00 -2.53 -0.17 0.00 -1.71 0.00 0.00 66.02 61.60 3nam s SER 335 CO 0.00 -1.14 1.33 -0.07 1.20 0.00 0.00 173.24 174.56 3nam h LEU 336 N 11.18 -0.25 -0.87 3.45 3.38 -1.92 -3.06 115.31 127.22 3nam h LEU 336 Ca -0.33 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.43 3nam h LEU 336 Cb 1.15 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3nam h LEU 336 CO 0.99 0.09 0.42 -0.65 0.09 0.00 0.00 178.44 179.38 3nam h PRO 337 N -0.60 0.00 -0.00 1.13 0.11 -2.01 0.54 132.00 131.17 3nam h PRO 337 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 3nam h PRO 337 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.55 3nam h PRO 337 CO 0.05 0.00 -0.23 0.45 -0.21 0.00 0.00 178.00 178.06 3nam n SER 338 N -2.18 0.48 0.24 -2.05 2.88 -1.15 -3.74 113.62 108.10 3nam n SER 338 Ca -0.01 -0.33 0.12 0.00 -1.33 0.00 0.00 58.87 57.32 3nam n SER 338 Cb 0.44 -0.02 0.58 0.00 -0.75 0.00 0.00 64.21 64.46 3nam n SER 338 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 3nam h VAL 339 N 0.40 0.50 0.16 2.46 2.07 -0.04 -3.07 116.25 118.73 3nam h VAL 339 Ca 0.00 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 3nam h VAL 339 Cb 0.45 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.82 3nam h VAL 339 CO 0.00 0.17 -0.08 -0.08 0.02 0.00 0.00 177.57 177.60 3nam h GLU 340 N 0.00 -0.21 -2.18 1.57 4.81 -1.77 -3.30 114.58 113.50 3nam h GLU 340 Ca -0.00 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 3nam h GLU 340 Cb 0.58 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 3nam h GLU 340 CO 0.02 0.20 0.04 0.25 -0.73 0.00 0.00 179.01 178.79 3nam n THR 341 N -4.91 1.00 0.00 0.32 -2.24 -1.16 -1.70 114.28 105.58 3nam n THR 341 Ca -0.07 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 3nam n THR 341 Cb 0.26 -1.38 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 3nam n THR 341 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3nam n LEU 342 N 2.11 0.37 0.27 3.22 7.94 -1.24 -4.65 117.00 125.01 3nam n LEU 342 Ca 0.06 0.00 0.17 0.00 -1.11 0.00 0.00 56.01 55.13 3nam n LEU 342 Cb 0.27 0.00 0.93 0.00 0.53 0.00 0.00 43.42 45.15 3nam n LEU 342 CO 0.06 -0.15 1.14 1.23 -1.11 0.00 0.00 177.39 178.57 3nam h GLY 343 N 0.00 0.00 0.09 -3.96 0.00 -1.44 -0.72 103.07 97.04 3nam h GLY 343 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3nam h GLY 343 CO 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 176.54 176.35 3nam n THR 345 N -0.46 0.38 -0.01 0.00 -2.24 -0.28 -4.61 114.28 107.06 3nam n THR 345 Ca 0.14 -0.10 0.03 0.00 -2.27 0.00 0.00 64.05 61.86 3nam n THR 345 Cb 0.35 -1.67 -0.08 0.00 -2.10 0.00 0.00 70.33 66.83 3nam n THR 345 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3nam n SER 346 N 3.03 2.71 -3.97 3.42 3.41 -0.48 -4.77 113.62 116.97 3nam n SER 346 Ca 0.14 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.56 3nam n SER 346 Cb 0.32 1.32 -0.15 0.00 -0.26 0.00 0.00 64.21 65.43 3nam n SER 346 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3nam s VAL 347 N -2.60 0.62 -0.26 -3.33 1.01 -1.11 0.84 120.40 115.57 3nam s VAL 347 Ca -0.04 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.67 3nam s VAL 347 Cb 0.06 -0.56 0.07 0.00 0.00 0.00 0.00 36.38 35.95 3nam s VAL 347 CO 0.41 0.20 0.00 -0.63 0.00 0.00 0.00 175.10 175.08 3nam s ILE 348 N 0.23 1.37 -0.40 2.22 1.01 0.63 -1.09 121.20 125.17 3nam s ILE 348 Ca -0.03 -1.32 -0.21 0.00 0.00 0.00 0.00 60.65 59.09 3nam s ILE 348 Cb -0.08 -1.79 0.01 0.00 0.01 0.00 0.00 42.46 40.62 3nam s ILE 348 CO 0.00 -0.29 0.67 0.00 0.00 0.00 0.00 174.94 175.32 3nam s SER 350 N 1.93 4.44 0.47 0.00 0.15 -0.54 -2.56 113.70 117.59 3nam s SER 350 Ca 0.25 -0.52 -0.19 0.00 0.70 0.00 0.00 55.95 56.19 3nam s SER 350 Cb -0.14 -0.82 -0.09 0.00 -1.71 0.00 0.00 66.02 63.25 3nam s SER 350 CO 0.18 0.09 0.96 -1.81 1.20 0.00 0.00 173.24 173.86 3nam s ASP 351 N -2.90 6.78 0.00 5.45 1.01 -1.26 -1.55 116.67 124.20 3nam s ASP 351 Ca 0.26 1.62 0.00 0.00 0.71 0.00 0.00 52.55 55.14 3nam s ASP 351 Cb -0.09 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.32 3nam s ASP 351 CO 0.16 -0.46 0.00 1.17 0.21 0.00 0.00 175.17 176.25 3nam n LYS 352 N -1.08 0.00 -0.01 8.23 4.81 -1.04 -3.71 118.16 125.37 3nam n LYS 352 Ca 0.07 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.50 3nam n LYS 352 Cb 0.54 -0.31 -0.00 0.00 0.02 0.00 0.00 35.03 35.28 3nam n LYS 352 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 3nam n THR 353 N -0.43 -0.01 0.02 3.15 -2.24 -1.26 -0.04 114.28 113.46 3nam n THR 353 Ca 0.00 0.17 -0.17 0.00 -2.27 0.00 0.00 64.05 61.77 3nam n THR 353 Cb 0.00 -0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 67.94 3nam n THR 353 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3nam h GLY 354 N 0.00 0.77 0.35 3.38 0.00 -1.85 -3.25 103.07 102.46 3nam h GLY 354 Ca 0.00 -1.19 -0.31 0.00 0.00 0.00 0.00 47.33 45.83 3nam h GLY 354 CO -0.01 1.06 -1.67 -1.30 0.00 0.00 0.00 176.54 174.61 3nam n THR 355 N -3.88 1.68 0.09 4.70 -2.24 -0.91 -4.55 114.28 109.18 3nam n THR 355 Ca -0.08 -0.38 -0.19 0.00 -2.27 0.00 0.00 64.05 61.13 3nam n THR 355 Cb 0.80 -1.88 -0.15 0.00 -2.10 0.00 0.00 70.33 67.01 3nam n THR 355 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3nam h LEU 356 N -0.41 0.54 0.00 3.22 3.38 -0.54 -2.79 115.31 118.71 3nam h LEU 356 Ca -0.39 -0.67 -0.59 0.00 0.09 0.00 0.00 57.88 56.33 3nam h LEU 356 Cb 1.71 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 42.23 3nam h LEU 356 CO -0.04 1.54 -0.30 0.35 0.09 0.00 0.00 178.44 180.07 3nam n THR 357 N -3.55 0.00 0.04 0.22 -2.24 -1.14 -2.31 114.28 105.30 3nam n THR 357 Ca -0.16 -2.20 -0.03 0.00 -2.27 0.00 0.00 64.05 59.40 3nam n THR 357 Cb 1.06 0.05 -0.08 0.00 -2.10 0.00 0.00 70.33 69.26 3nam n THR 357 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3nam h THR 358 N 0.76 0.80 -1.82 4.28 2.02 -0.56 -3.40 112.91 114.99 3nam h THR 358 Ca -0.36 -2.39 -0.28 0.00 0.77 0.00 0.00 66.41 64.16 3nam h THR 358 Cb 1.26 2.30 -0.03 0.00 -1.74 0.00 0.00 68.15 69.94 3nam h THR 358 CO 0.57 0.46 -0.34 -3.20 0.37 0.00 0.00 175.52 173.37 3nam n ASN 359 N -3.04 -4.32 -3.69 4.18 5.15 -1.23 -4.90 115.26 107.41 3nam n ASN 359 Ca -0.08 0.03 -0.27 0.00 -0.60 0.00 0.00 54.58 53.65 3nam n ASN 359 Cb 0.89 -3.43 -0.10 0.00 -0.53 0.00 0.00 39.78 36.60 3nam n ASN 359 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 3nam n GLN 360 N -2.36 2.01 -0.89 1.20 7.27 -1.26 -4.96 117.38 118.39 3nam n GLN 360 Ca -0.16 -4.48 -0.33 0.00 0.07 0.00 0.00 57.00 52.09 3nam n GLN 360 Cb 0.60 -2.23 0.12 0.00 2.41 0.00 0.00 30.24 31.15 3nam n GLN 360 CO 0.00 0.00 0.00 -1.33 0.07 0.00 0.00 177.06 175.80 3nam n MET 361 N 1.55 -0.16 -3.65 3.69 2.81 -1.26 -4.51 117.12 115.60 3nam n MET 361 Ca 0.24 0.01 -0.02 0.00 -1.81 0.00 0.00 57.70 56.12 3nam n MET 361 Cb 0.38 -2.05 -0.07 0.00 -0.71 0.00 0.00 33.22 30.78 3nam n MET 361 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3nam s SER 362 N -2.07 -0.25 0.00 7.83 1.04 -0.93 -4.78 113.70 114.54 3nam s SER 362 Ca 0.63 0.43 -0.30 0.00 0.48 0.00 0.00 55.95 57.18 3nam s SER 362 Cb -0.25 0.80 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 3nam s SER 362 CO 0.62 -0.07 1.15 -0.69 0.98 0.00 0.00 173.24 175.22 3nam s VAL 363 N 0.70 4.30 -0.14 5.02 1.01 -1.26 0.19 120.40 130.21 3nam s VAL 363 Ca -0.02 1.64 0.07 0.00 0.00 0.00 0.00 61.98 63.66 3nam s VAL 363 Cb -0.04 -4.05 -0.13 0.00 0.00 0.00 0.00 36.38 32.16 3nam s VAL 363 CO -0.12 0.08 -0.04 0.00 0.00 0.00 0.00 175.10 175.02 3nam s LYS 365 N -2.32 0.82 0.17 0.00 1.02 -0.85 -0.08 119.74 118.50 3nam s LYS 365 Ca -0.13 -1.02 -0.01 0.00 0.02 0.00 0.00 55.97 54.82 3nam s LYS 365 Cb 0.05 -0.70 -0.04 0.00 -0.52 0.00 0.00 37.83 36.61 3nam s LYS 365 CO 0.46 0.14 0.10 -1.64 -0.92 0.00 0.00 175.35 173.49 3nam s MET 366 N -2.12 1.08 -0.29 1.68 -1.94 -1.16 -0.20 119.30 116.35 3nam s MET 366 Ca 0.01 -1.55 -0.19 0.00 -1.71 0.00 0.00 55.69 52.25 3nam s MET 366 Cb -0.07 0.25 0.17 0.00 2.01 0.00 0.00 34.83 37.19 3nam s MET 366 CO 0.02 -0.33 1.13 -0.59 -0.01 0.00 0.00 175.02 175.23 3nam s PHE 367 N -4.11 -0.34 0.14 -0.03 -0.12 -1.05 -0.15 117.98 112.32 3nam s PHE 367 Ca 0.32 0.73 0.05 0.00 -0.05 0.00 0.00 56.93 57.98 3nam s PHE 367 Cb 0.07 0.28 -0.04 0.00 -0.63 0.00 0.00 43.02 42.71 3nam s PHE 367 CO 0.07 -0.17 -0.12 0.96 -0.05 0.00 0.00 175.22 175.92 3nam s ILE 368 N 0.88 1.25 0.26 -4.49 -4.36 -0.99 -2.02 121.20 111.74 3nam s ILE 368 Ca -0.04 -1.91 -0.30 0.00 -0.26 0.00 0.00 60.65 58.14 3nam s ILE 368 Cb -0.04 -1.70 -0.09 0.00 1.25 0.00 0.00 42.46 41.88 3nam s ILE 368 CO -0.12 -0.60 1.06 -0.63 0.24 0.00 0.00 174.94 174.89 3nam s ILE 369 N -2.79 3.64 -0.15 8.37 -1.09 -1.26 -0.20 121.20 127.71 3nam s ILE 369 Ca 0.13 1.64 0.04 0.00 -2.23 0.00 0.00 60.65 60.23 3nam s ILE 369 Cb -0.01 -4.04 -0.12 0.00 -1.58 0.00 0.00 42.46 36.71 3nam s ILE 369 CO 0.02 0.38 -0.10 -0.67 -1.23 0.00 0.00 174.94 173.34 3nam n ASP 370 N 1.34 2.54 -3.70 3.58 2.03 0.75 -4.31 116.55 118.77 3nam n ASP 370 Ca -0.01 -0.07 -0.14 0.00 0.52 0.00 0.00 54.79 55.10 3nam n ASP 370 Cb 0.45 -0.01 -0.09 0.00 -0.72 0.00 0.00 41.12 40.75 3nam n ASP 370 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3nam s LYS 371 N -2.32 0.60 -0.43 -0.67 2.20 -1.06 -4.89 119.74 113.17 3nam s LYS 371 Ca -0.18 0.56 0.03 0.00 -0.36 0.00 0.00 55.97 56.02 3nam s LYS 371 Cb 0.05 0.29 0.16 0.00 -1.51 0.00 0.00 37.83 36.82 3nam s LYS 371 CO 0.41 -0.09 0.33 0.08 -0.36 0.00 0.00 175.35 175.71 3nam s VAL 372 N 0.02 0.55 -0.64 4.02 1.01 -1.26 -1.59 120.40 122.51 3nam s VAL 372 Ca -0.02 -2.63 -0.10 0.00 0.00 0.00 0.00 61.98 59.23 3nam s VAL 372 Cb -0.03 -1.39 0.17 0.00 0.00 0.00 0.00 36.38 35.12 3nam s VAL 372 CO 0.02 -1.17 0.53 -0.62 0.00 0.00 0.00 175.10 173.86 3nam s ASP 373 N 0.11 6.00 1.74 3.32 -1.08 -0.77 -4.97 116.67 121.02 3nam s ASP 373 Ca 0.29 -2.41 0.00 0.00 -0.52 0.00 0.00 52.55 49.91 3nam s ASP 373 Cb -0.02 -2.06 0.00 0.00 -1.46 0.00 0.00 42.92 39.38 3nam s ASP 373 CO -0.16 -0.59 0.00 0.61 0.52 0.00 0.00 175.17 175.56 3nam n GLY 374 N 4.25 2.68 0.41 2.66 0.00 -1.26 -1.18 105.19 112.75 3nam n GLY 374 Ca 0.03 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.28 3nam n GLY 374 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3nam n ASP 375 N 10.19 1.51 -4.84 1.61 8.00 -1.26 -4.84 116.55 126.92 3nam n ASP 375 Ca 0.00 -1.24 -0.34 0.00 0.71 0.00 0.00 54.79 53.91 3nam n ASP 375 Cb 0.00 0.18 -0.06 0.00 -0.02 0.00 0.00 41.12 41.22 3nam n ASP 375 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3nam s PHE 376 N -2.36 3.54 -0.22 1.24 0.08 -0.33 -4.92 117.98 115.02 3nam s PHE 376 Ca 0.26 1.12 -0.19 0.00 0.12 0.00 0.00 56.93 58.23 3nam s PHE 376 Cb 0.19 -2.42 0.06 0.00 -0.57 0.00 0.00 43.02 40.28 3nam s PHE 376 CO 0.48 0.33 0.58 0.00 -0.10 0.00 0.00 175.22 176.50 3nam s SER 378 N 0.46 1.09 0.71 0.00 1.04 -0.62 -4.97 113.70 111.41 3nam s SER 378 Ca -0.01 -0.13 -0.01 0.00 0.48 0.00 0.00 55.95 56.28 3nam s SER 378 Cb -0.04 -0.47 0.12 0.00 0.10 0.00 0.00 66.02 65.73 3nam s SER 378 CO -0.01 -0.07 0.98 -0.76 0.98 0.00 0.00 173.24 174.35 3nam s LEU 379 N 1.08 2.99 -0.44 2.42 1.02 -1.26 -0.18 118.68 124.31 3nam s LEU 379 Ca -0.08 -0.30 0.03 0.00 0.02 0.00 0.00 54.13 53.79 3nam s LEU 379 Cb -0.14 -2.09 0.15 0.00 0.02 0.00 0.00 46.19 44.13 3nam s LEU 379 CO -0.01 -1.81 0.30 0.20 0.02 0.00 0.00 176.35 175.05 3nam s ASN 380 N -4.71 2.94 0.07 2.29 0.01 0.72 -4.56 114.94 111.71 3nam s ASN 380 Ca 0.65 -2.82 -0.27 0.00 -0.71 0.00 0.00 52.86 49.71 3nam s ASN 380 Cb -0.06 -0.77 -0.06 0.00 0.41 0.00 0.00 41.25 40.77 3nam s ASN 380 CO 0.44 -0.22 0.85 -1.61 -1.51 0.00 0.00 177.10 175.05 3nam s GLU 381 N 0.20 4.59 0.45 -0.60 2.02 -1.26 -2.33 118.70 121.76 3nam s GLU 381 Ca 0.23 1.24 0.05 0.00 0.02 0.00 0.00 54.97 56.51 3nam s GLU 381 Cb -0.13 -3.37 -0.05 0.00 0.10 0.00 0.00 34.13 30.68 3nam s GLU 381 CO -0.08 0.25 0.03 -0.06 0.02 0.00 0.00 175.26 175.41 3nam s PHE 382 N -0.02 2.29 0.01 1.61 0.40 0.79 -4.67 117.98 118.39 3nam s PHE 382 Ca 0.42 -0.76 0.03 0.00 -0.60 0.00 0.00 56.93 56.02 3nam s PHE 382 Cb -0.22 -1.74 -0.01 0.00 0.51 0.00 0.00 43.02 41.56 3nam s PHE 382 CO 0.26 0.34 -0.08 0.45 0.70 0.00 0.00 175.22 176.89 3nam s SER 383 N -3.79 0.94 0.22 1.36 0.15 -0.35 -2.97 113.70 109.26 3nam s SER 383 Ca 0.26 -0.24 0.09 0.00 0.70 0.00 0.00 55.95 56.76 3nam s SER 383 Cb 0.07 -0.07 -0.05 0.00 -1.71 0.00 0.00 66.02 64.25 3nam s SER 383 CO 0.13 0.03 -0.16 -0.63 1.20 0.00 0.00 173.24 173.81 3nam s ILE 384 N -0.45 1.96 0.12 6.45 1.09 0.89 -0.79 121.20 130.47 3nam s ILE 384 Ca 0.00 -2.25 0.08 0.00 -1.10 0.00 0.00 60.65 57.38 3nam s ILE 384 Cb -0.05 -2.11 -0.04 0.00 -1.06 0.00 0.00 42.46 39.21 3nam s ILE 384 CO 0.00 -0.52 -0.20 0.42 -0.10 0.00 0.00 174.94 174.54 3nam s THR 385 N -2.78 1.72 0.00 2.92 -4.23 -0.92 -4.73 115.64 107.61 3nam s THR 385 Ca 0.24 -1.65 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 3nam s THR 385 Cb -0.02 -1.63 0.00 0.00 1.34 0.00 0.00 72.50 72.19 3nam s THR 385 CO 0.09 -0.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 3nam n GLY 386 N 0.84 3.55 0.01 3.99 0.00 -1.26 -4.21 105.19 108.11 3nam n GLY 386 Ca -0.18 -1.36 0.04 0.00 0.00 0.00 0.00 46.02 44.53 3nam n GLY 386 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3nam n SER 387 N 0.00 2.13 -3.59 1.61 3.41 -1.26 -4.83 113.62 111.10 3nam n SER 387 Ca 0.00 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.36 3nam n SER 387 Cb 0.00 1.45 0.18 0.00 -0.26 0.00 0.00 64.21 65.58 3nam n SER 387 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3nam n THR 388 N -2.01 0.00 1.39 6.66 -1.04 -1.26 -4.71 114.28 113.30 3nam n THR 388 Ca -0.05 -0.79 0.14 0.00 -2.04 0.00 0.00 64.05 61.30 3nam n THR 388 Cb 0.41 -1.56 0.44 0.00 -1.82 0.00 0.00 70.33 67.80 3nam n THR 388 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3nam n TYR 389 N -3.63 0.00 -1.72 -1.42 4.01 -1.26 -4.91 117.16 108.24 3nam n TYR 389 Ca 0.14 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.46 3nam n TYR 389 Cb 0.49 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.47 3nam n TYR 389 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3nam s ALA 390 N -2.10 3.89 -0.32 -0.72 0.00 -1.26 -4.81 121.76 116.43 3nam s ALA 390 Ca 0.34 1.56 -0.04 0.00 0.00 0.00 0.00 51.96 53.81 3nam s ALA 390 Cb 0.21 -3.72 -0.12 0.00 0.00 0.00 0.00 23.12 19.48 3nam s ALA 390 CO 0.37 -1.03 2.26 -0.35 0.00 0.00 0.00 175.76 177.02 3nam n PRO 391 N 4.53 1.50 -3.81 0.00 -0.04 -1.26 -4.71 135.00 131.22 3nam n PRO 391 Ca 0.17 -0.89 -0.28 0.00 -0.04 0.00 0.00 63.50 62.46 3nam n PRO 391 Cb 0.36 -2.02 -0.16 0.00 -0.04 0.00 0.00 33.50 31.63 3nam n PRO 391 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3nam s GLU 392 N 2.35 0.97 0.00 0.54 2.02 -1.26 -4.79 118.70 118.53 3nam s GLU 392 Ca 0.40 -0.48 0.00 0.00 0.02 0.00 0.00 54.97 54.91 3nam s GLU 392 Cb 0.16 -2.05 0.00 0.00 0.10 0.00 0.00 34.13 32.34 3nam s GLU 392 CO -0.01 -0.55 0.00 0.41 0.02 0.00 0.00 175.26 175.12 3nam n GLY 393 N 4.96 1.54 3.34 -1.39 0.00 -1.26 -4.47 105.19 107.91 3nam n GLY 393 Ca -0.10 -0.97 -0.20 0.00 0.00 0.00 0.00 46.02 44.75 3nam n GLY 393 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3nam s GLU 394 N -2.00 1.30 -0.25 1.61 2.12 -1.26 -4.84 118.70 115.37 3nam s GLU 394 Ca 0.00 -1.49 -0.09 0.00 0.36 0.00 0.00 54.97 53.75 3nam s GLU 394 Cb 0.00 -1.23 -0.04 0.00 0.26 0.00 0.00 34.13 33.12 3nam s GLU 394 CO 0.00 0.23 0.13 0.08 -0.54 0.00 0.00 175.26 175.16 3nam s VAL 395 N -2.46 4.86 -0.20 3.70 1.01 -1.26 -2.15 120.40 123.89 3nam s VAL 395 Ca 0.19 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.17 3nam s VAL 395 Cb -0.04 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.07 3nam s VAL 395 CO 0.07 0.31 -0.12 -0.76 0.00 0.00 0.00 175.10 174.60 3nam s LEU 396 N 1.50 2.52 0.00 3.92 1.43 0.03 -0.99 118.68 127.10 3nam s LEU 396 Ca 0.06 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 3nam s LEU 396 Cb -0.15 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.46 3nam s LEU 396 CO 0.06 -0.00 0.19 1.17 0.23 0.00 0.00 176.35 178.00 3nam n LYS 397 N 4.66 0.00 -2.83 1.70 4.81 -0.43 -1.21 118.16 124.86 3nam n LYS 397 Ca -0.20 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 56.83 3nam n LYS 397 Cb 0.51 -0.63 0.01 0.00 0.02 0.00 0.00 35.03 34.94 3nam n LYS 397 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 3nam n ASN 398 N -0.37 6.82 0.00 3.14 2.85 -1.26 -4.34 115.26 122.10 3nam n ASN 398 Ca 0.00 -3.56 0.00 0.00 -0.11 0.00 0.00 54.58 50.91 3nam n ASN 398 Cb 0.00 -1.20 0.00 0.00 1.24 0.00 0.00 39.78 39.82 3nam n ASN 398 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3nam n ASP 399 N 0.60 0.00 -4.76 1.20 8.00 -1.26 -4.94 116.55 115.40 3nam n ASP 399 Ca 0.36 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.47 3nam n ASP 399 Cb 0.30 -0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.31 3nam n ASP 399 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3nam s LYS 400 N 0.00 4.37 0.77 -1.24 1.02 -1.26 -4.90 119.74 118.49 3nam s LYS 400 Ca 0.00 0.82 -0.16 0.00 0.02 0.00 0.00 55.97 56.65 3nam s LYS 400 Cb 0.00 -3.35 -0.05 0.00 -0.52 0.00 0.00 37.83 33.91 3nam s LYS 400 CO 0.00 0.34 0.29 -2.30 -0.92 0.00 0.00 175.35 172.76 3nam n PRO 401 N 2.77 0.14 -3.79 -1.68 -0.02 -1.26 -1.32 135.00 129.84 3nam n PRO 401 Ca -0.06 0.08 -0.10 0.00 -2.02 0.00 0.00 63.50 61.40 3nam n PRO 401 Cb 0.51 -1.65 -0.07 0.00 -0.02 0.00 0.00 33.50 32.27 3nam n PRO 401 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3nam s ILE 402 N -2.01 0.11 -0.35 4.25 1.01 -0.16 -4.64 121.20 119.41 3nam s ILE 402 Ca 0.60 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 60.30 3nam s ILE 402 Cb -0.32 -1.11 0.05 0.00 0.01 0.00 0.00 42.46 41.09 3nam s ILE 402 CO 0.63 -0.49 0.12 -0.13 0.00 0.00 0.00 174.94 175.07 3nam s ARG 403 N -3.19 2.57 0.59 2.79 0.52 -1.26 -4.56 118.95 116.40 3nam s ARG 403 Ca -0.00 -1.25 0.29 0.00 -0.52 0.00 0.00 55.73 54.25 3nam s ARG 403 Cb 0.02 -3.49 1.43 0.00 0.52 0.00 0.00 34.95 33.43 3nam s ARG 403 CO -0.07 -0.72 1.84 0.77 0.02 0.00 0.00 175.30 177.14 3nam h SER 404 N 8.22 0.00 -0.66 0.23 0.02 -1.86 -2.36 113.55 117.13 3nam h SER 404 Ca -0.22 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 60.77 3nam h SER 404 Cb 1.08 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.57 3nam h SER 404 CO 0.62 0.00 0.39 1.23 -1.14 0.00 0.00 176.83 177.93 3nam h GLY 405 N 0.00 0.96 1.03 -3.77 0.00 -1.79 -2.98 103.07 96.52 3nam h GLY 405 Ca 0.27 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3nam h GLY 405 CO -0.00 0.20 0.10 -1.06 0.00 0.00 0.00 176.54 175.78 3nam n GLN 406 N -4.75 0.00 -5.20 4.80 6.02 -0.89 -4.38 117.38 112.98 3nam n GLN 406 Ca 0.08 0.19 -0.32 0.00 -0.01 0.00 0.00 57.00 56.94 3nam n GLN 406 Cb 0.14 -1.60 -0.17 0.00 1.02 0.00 0.00 30.24 29.62 3nam n GLN 406 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3nam s PHE 407 N -2.24 2.57 0.09 1.08 0.08 -1.13 -5.01 117.98 113.43 3nam s PHE 407 Ca 0.00 -1.04 -0.02 0.00 0.12 0.00 0.00 56.93 55.98 3nam s PHE 407 Cb 0.00 -1.72 -0.23 0.00 -0.57 0.00 0.00 43.02 40.50 3nam s PHE 407 CO 0.00 -0.42 1.19 -0.44 -0.10 0.00 0.00 175.22 175.46 3nam h ASP 408 N 6.72 0.36 -1.00 1.36 3.32 -1.82 -3.06 116.42 122.30 3nam h ASP 408 Ca -0.19 -0.37 0.04 0.00 0.02 0.00 0.00 57.03 56.53 3nam h ASP 408 Cb 1.24 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 40.61 3nam h ASP 408 CO 0.47 1.27 0.65 1.23 -1.72 0.00 0.00 179.24 181.14 3nam h GLY 409 N 1.76 1.47 1.94 2.75 0.00 -1.93 -1.46 103.07 107.61 3nam h GLY 409 Ca -0.11 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 46.73 3nam h GLY 409 CO 0.18 0.41 0.00 1.04 0.00 0.00 0.00 176.54 178.17 3nam n LEU 410 N -4.46 0.00 0.13 3.11 4.77 -1.19 -2.27 117.00 117.09 3nam n LEU 410 Ca 0.14 0.47 -0.23 0.00 -0.03 0.00 0.00 56.01 56.36 3nam n LEU 410 Cb 0.11 -0.47 -0.15 0.00 -2.33 0.00 0.00 43.42 40.58 3nam n LEU 410 CO 0.34 -0.13 -0.23 0.58 -1.33 0.00 0.00 177.39 176.62 3nam h VAL 411 N 0.00 1.29 0.09 4.08 2.07 -1.16 -3.14 116.25 119.47 3nam h VAL 411 Ca 0.00 -2.76 -0.00 0.00 0.82 0.00 0.00 66.70 64.75 3nam h VAL 411 Cb 0.34 2.99 0.00 0.00 -1.52 0.00 0.00 31.29 33.10 3nam h VAL 411 CO 0.00 0.83 -0.04 -0.33 0.02 0.00 0.00 177.57 178.05 3nam h GLU 412 N 0.13 -0.11 -1.20 1.57 5.08 -1.48 -3.06 114.58 115.51 3nam h GLU 412 Ca -0.24 0.01 0.34 0.00 -1.00 0.00 0.00 59.36 58.47 3nam h GLU 412 Cb 2.12 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 31.34 3nam h GLU 412 CO 0.25 0.42 0.85 1.25 -1.00 0.00 0.00 179.01 180.78 3nam h LEU 413 N -0.84 0.07 -0.29 1.33 6.46 -1.60 0.97 115.31 121.41 3nam h LEU 413 Ca -0.01 0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 57.73 3nam h LEU 413 Cb 0.59 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.52 3nam h LEU 413 CO 0.02 0.01 -0.17 0.00 -0.62 0.00 0.00 178.44 177.68 3nam h ALA 414 N 1.43 0.91 0.06 1.25 0.00 -1.49 -2.93 119.26 118.49 3nam h ALA 414 Ca 0.59 -0.15 -0.24 0.00 0.00 0.00 0.00 54.91 55.11 3nam h ALA 414 Cb 2.22 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.97 3nam h ALA 414 CO -0.06 0.21 -1.26 1.79 0.00 0.00 0.00 179.25 179.93 3nam h THR 415 N 0.00 1.03 -0.94 0.00 1.35 0.10 -2.94 112.91 111.52 3nam h THR 415 Ca -0.00 -2.31 0.27 0.00 -0.55 0.00 0.00 66.41 63.81 3nam h THR 415 Cb 1.03 2.59 -0.04 0.00 -1.73 0.00 0.00 68.15 70.00 3nam h THR 415 CO 0.02 0.58 0.67 0.40 -0.25 0.00 0.00 175.52 176.94 3nam h ILE 416 N -0.59 0.54 0.04 6.82 2.04 -1.25 0.52 117.51 125.64 3nam h ILE 416 Ca -0.30 -0.02 -0.24 0.00 1.00 0.00 0.00 64.86 65.30 3nam h ILE 416 Cb 1.55 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 3nam h ILE 416 CO -0.04 0.01 -1.03 0.00 0.00 0.00 0.00 178.15 177.10 3nam n ALA 418 N -2.53 2.57 -0.09 0.00 0.00 0.29 -4.43 120.51 116.33 3nam n ALA 418 Ca -0.07 -0.26 -0.23 0.00 0.00 0.00 0.00 53.44 52.88 3nam n ALA 418 Cb 0.89 -1.07 -0.12 0.00 0.00 0.00 0.00 19.45 19.15 3nam n ALA 418 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3nam n LEU 419 N -2.61 2.18 -4.45 0.00 4.77 0.16 -4.52 117.00 112.53 3nam n LEU 419 Ca -0.00 0.30 -0.44 0.00 -0.03 0.00 0.00 56.01 55.84 3nam n LEU 419 Cb 0.55 -0.97 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 3nam n LEU 419 CO 0.41 0.55 1.55 0.00 -1.33 0.00 0.00 177.39 178.56 3nam s ASN 421 N 2.97 -0.10 0.00 0.00 3.84 -1.26 -4.72 114.94 115.67 3nam s ASN 421 Ca 0.45 0.10 0.28 0.00 0.21 0.00 0.00 52.86 53.89 3nam s ASN 421 Cb -0.01 1.10 1.00 0.00 -0.55 0.00 0.00 41.25 42.79 3nam s ASN 421 CO 0.02 -0.02 1.72 0.47 -2.79 0.00 0.00 177.10 176.49 3nam n ASP 422 N 4.97 0.87 -4.83 -4.21 8.00 -1.26 -4.92 116.55 115.17 3nam n ASP 422 Ca -0.08 -0.87 -0.24 0.00 0.71 0.00 0.00 54.79 54.31 3nam n ASP 422 Cb 0.55 0.04 -0.04 0.00 -0.02 0.00 0.00 41.12 41.64 3nam n ASP 422 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3nam s SER 423 N -2.40 5.63 0.13 -2.24 0.15 -1.26 -4.86 113.70 108.84 3nam s SER 423 Ca 0.29 -0.16 0.01 0.00 0.70 0.00 0.00 55.95 56.79 3nam s SER 423 Cb 0.20 -1.48 -0.00 0.00 -1.71 0.00 0.00 66.02 63.02 3nam s SER 423 CO 0.47 0.00 0.15 -1.54 1.20 0.00 0.00 173.24 173.52 3nam n SER 424 N -0.87 -0.39 -4.85 5.45 3.41 -1.26 -4.72 113.62 110.39 3nam n SER 424 Ca -0.08 -1.79 -0.22 0.00 -0.26 0.00 0.00 58.87 56.52 3nam n SER 424 Cb 0.56 0.80 -0.04 0.00 -0.26 0.00 0.00 64.21 65.28 3nam n SER 424 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3nam s LEU 425 N 0.00 3.32 -0.29 1.04 1.43 -1.26 -1.58 118.68 121.34 3nam s LEU 425 Ca 0.13 -0.82 -0.15 0.00 -1.03 0.00 0.00 54.13 52.26 3nam s LEU 425 Cb 0.00 -1.92 0.13 0.00 0.03 0.00 0.00 46.19 44.44 3nam s LEU 425 CO 0.10 -0.65 0.86 -0.62 0.23 0.00 0.00 176.35 176.27 3nam s ASP 426 N -4.09 -0.72 -0.19 2.29 2.15 -1.17 -4.82 116.67 110.11 3nam s ASP 426 Ca 0.47 1.10 -0.07 0.00 0.43 0.00 0.00 52.55 54.47 3nam s ASP 426 Cb -0.02 1.48 -0.04 0.00 -0.30 0.00 0.00 42.92 44.04 3nam s ASP 426 CO 0.27 -0.17 0.06 0.12 -0.17 0.00 0.00 175.17 175.28 3nam s PHE 427 N 1.82 3.19 0.26 -5.34 5.36 -1.26 0.25 117.98 122.26 3nam s PHE 427 Ca -0.08 -0.05 0.09 0.00 -0.96 0.00 0.00 56.93 55.93 3nam s PHE 427 Cb -0.05 -2.10 -0.04 0.00 -0.34 0.00 0.00 43.02 40.48 3nam s PHE 427 CO -0.17 0.04 0.04 0.54 -1.46 0.00 0.00 175.22 174.20 3nam s ASN 428 N 0.62 4.76 -0.10 6.13 6.03 -1.18 -4.73 114.94 126.47 3nam s ASN 428 Ca 0.03 -0.56 0.10 0.00 -1.03 0.00 0.00 52.86 51.40 3nam s ASN 428 Cb -0.13 -0.97 -0.24 0.00 -3.03 0.00 0.00 41.25 36.88 3nam s ASN 428 CO 0.02 -0.01 0.44 -0.62 -2.03 0.00 0.00 177.10 174.90 3nam n GLU 429 N -0.96 0.66 -0.21 3.55 4.71 -1.26 -2.73 120.64 124.41 3nam n GLU 429 Ca -0.07 0.22 -0.07 0.00 -0.01 0.00 0.00 57.16 57.23 3nam n GLU 429 Cb 0.59 -1.71 -0.02 0.00 -1.01 0.00 0.00 31.44 29.29 3nam n GLU 429 CO 0.00 0.00 0.00 1.15 0.09 0.00 0.00 177.13 178.37 3nam h THR 430 N 0.01 0.11 -0.07 2.62 2.02 -1.98 -2.99 112.91 112.64 3nam h THR 430 Ca -0.38 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.80 3nam h THR 430 Cb 2.06 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.58 3nam h THR 430 CO 0.06 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.24 3nam n LYS 431 N -5.42 0.82 -3.97 6.66 5.02 -1.26 -5.02 118.16 115.00 3nam n LYS 431 Ca 0.02 -1.19 -0.31 0.00 -2.02 0.00 0.00 58.31 54.81 3nam n LYS 431 Cb 0.35 -1.15 0.02 0.00 -0.02 0.00 0.00 35.03 34.23 3nam n LYS 431 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3nam n GLY 432 N 0.35 -0.48 3.32 0.72 0.00 -1.10 -4.98 105.19 103.00 3nam n GLY 432 Ca 0.05 0.18 -0.18 0.00 0.00 0.00 0.00 46.02 46.08 3nam n GLY 432 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3nam s VAL 433 N -3.31 1.60 -0.30 1.61 1.01 -1.25 -4.97 120.40 114.78 3nam s VAL 433 Ca 0.66 -2.13 -0.24 0.00 0.00 0.00 0.00 61.98 60.28 3nam s VAL 433 Cb -0.34 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.09 3nam s VAL 433 CO 0.85 -0.60 0.80 -0.31 0.00 0.00 0.00 175.10 175.84 3nam s TYR 434 N -2.93 3.20 -0.28 5.22 2.02 -1.26 -3.10 117.35 120.22 3nam s TYR 434 Ca 0.20 0.83 -0.08 0.00 -0.37 0.00 0.00 57.07 57.65 3nam s TYR 434 Cb -0.01 -3.23 -0.01 0.00 -0.40 0.00 0.00 41.96 38.32 3nam s TYR 434 CO 0.05 -0.57 0.09 -1.21 -1.57 0.00 0.00 175.55 172.35 3nam s GLU 435 N 2.97 3.41 -0.13 -0.62 2.02 0.14 -4.64 118.70 121.85 3nam s GLU 435 Ca 0.33 -0.65 -0.39 0.00 0.02 0.00 0.00 54.97 54.28 3nam s GLU 435 Cb -0.14 -3.40 -0.16 0.00 0.10 0.00 0.00 34.13 30.52 3nam s GLU 435 CO 0.12 -0.32 1.54 1.17 0.02 0.00 0.00 175.26 177.80 3nam n LYS 436 N 4.92 1.06 0.00 1.61 4.81 -1.26 -3.03 118.16 126.27 3nam n LYS 436 Ca -0.15 0.38 0.00 0.00 -0.87 0.00 0.00 58.31 57.67 3nam n LYS 436 Cb 0.50 -2.04 0.00 0.00 0.02 0.00 0.00 35.03 33.51 3nam n LYS 436 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 3nam n VAL 437 N 3.59 0.00 0.00 3.15 0.31 -0.61 -4.95 118.33 119.81 3nam n VAL 437 Ca 0.23 0.37 0.00 0.00 -0.01 0.00 0.00 64.34 64.93 3nam n VAL 437 Cb 0.14 -1.25 0.00 0.00 -0.91 0.00 0.00 33.84 31.83 3nam n VAL 437 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3nam n GLY 438 N 1.93 -0.85 3.85 2.92 0.00 -1.24 -4.93 105.19 106.87 3nam n GLY 438 Ca 0.00 -0.57 -0.31 0.00 0.00 0.00 0.00 46.02 45.14 3nam n GLY 438 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3nam s GLU 439 N 0.00 3.27 0.15 1.61 2.12 -1.26 -4.87 118.70 119.72 3nam s GLU 439 Ca 0.00 0.85 -0.12 0.00 0.36 0.00 0.00 54.97 56.06 3nam s GLU 439 Cb 0.00 -2.04 -0.01 0.00 0.26 0.00 0.00 34.13 32.35 3nam s GLU 439 CO 0.00 -0.83 1.54 0.00 -0.54 0.00 0.00 175.26 175.43 3nam h ALA 440 N -0.52 0.63 -0.00 6.30 0.00 -1.94 0.31 119.26 124.04 3nam h ALA 440 Ca -0.44 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.11 3nam h ALA 440 Cb 1.20 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3nam h ALA 440 CO 0.59 0.58 -0.34 0.25 0.00 0.00 0.00 179.25 180.33 3nam n THR 441 N -4.20 0.00 -0.10 0.00 -2.24 -1.26 -2.82 114.28 103.66 3nam n THR 441 Ca -0.00 -0.07 -0.24 0.00 -2.27 0.00 0.00 64.05 61.47 3nam n THR 441 Cb 0.42 0.29 -0.12 0.00 -2.10 0.00 0.00 70.33 68.83 3nam n THR 441 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3nam n GLU 442 N -1.03 0.63 0.29 -0.78 1.02 -1.16 -3.94 120.64 115.66 3nam n GLU 442 Ca 0.09 0.34 0.14 0.00 -0.02 0.00 0.00 57.16 57.71 3nam n GLU 442 Cb 0.34 -1.62 0.85 0.00 -0.02 0.00 0.00 31.44 30.99 3nam n GLU 442 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3nam h THR 443 N -0.60 0.63 0.00 2.62 1.03 -0.49 0.28 112.91 116.38 3nam h THR 443 Ca -0.51 -0.03 -0.03 0.00 -0.01 0.00 0.00 66.41 65.83 3nam h THR 443 Cb 1.66 1.02 -0.00 0.00 -1.07 0.00 0.00 68.15 69.75 3nam h THR 443 CO -0.19 0.01 -0.14 0.00 -0.01 0.00 0.00 175.52 175.19 3nam h ALA 444 N 1.99 1.04 0.19 0.00 0.00 -1.67 -2.18 119.26 118.63 3nam h ALA 444 Ca -0.00 -0.12 -0.32 0.00 0.00 0.00 0.00 54.91 54.46 3nam h ALA 444 Cb 0.01 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.80 3nam h ALA 444 CO 0.00 0.17 -1.51 -0.07 0.00 0.00 0.00 179.25 177.85 3nam h LEU 445 N 0.00 0.62 -0.88 0.00 3.38 -0.56 -2.40 115.31 115.47 3nam h LEU 445 Ca -0.00 -0.75 -0.10 0.00 0.09 0.00 0.00 57.88 57.12 3nam h LEU 445 Cb 0.63 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3nam h LEU 445 CO 0.02 1.60 -0.23 0.71 0.09 0.00 0.00 178.44 180.63 3nam h THR 446 N 0.11 1.26 -0.30 0.22 1.35 -1.35 -2.21 112.91 112.00 3nam h THR 446 Ca -0.25 -1.26 -0.07 0.00 -0.55 0.00 0.00 66.41 64.27 3nam h THR 446 Cb 2.09 1.28 -0.02 0.00 -1.73 0.00 0.00 68.15 69.77 3nam h THR 446 CO 0.22 0.41 -0.13 0.74 -0.25 0.00 0.00 175.52 176.51 3nam h THR 447 N 0.51 1.23 -0.46 6.82 2.02 -1.43 -2.45 112.91 119.15 3nam h THR 447 Ca 0.08 -1.03 -0.03 0.00 0.77 0.00 0.00 66.41 66.20 3nam h THR 447 Cb 0.67 1.15 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 3nam h THR 447 CO 0.05 0.34 0.18 0.25 0.37 0.00 0.00 175.52 176.70 3nam h LEU 448 N 0.47 0.65 -0.21 2.58 5.85 -0.92 -2.92 115.31 120.80 3nam h LEU 448 Ca 0.09 -0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.68 3nam h LEU 448 Cb 0.50 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 3nam h LEU 448 CO 0.03 0.65 -0.09 0.58 -0.34 0.00 0.00 178.44 179.27 3nam h VAL 449 N 0.61 0.70 -0.14 1.05 2.07 -0.97 -1.97 116.25 117.60 3nam h VAL 449 Ca 0.15 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.71 3nam h VAL 449 Cb 0.21 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 3nam h VAL 449 CO -0.01 0.00 0.11 -0.33 0.02 0.00 0.00 177.57 177.36 3nam h GLU 450 N -0.06 0.00 -0.00 1.57 4.39 -1.30 -1.87 114.58 117.31 3nam h GLU 450 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 3nam h GLU 450 Cb 0.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 3nam h GLU 450 CO -0.25 0.00 -0.11 1.63 -1.16 0.00 0.00 179.01 179.12 3nam n LYS 451 N -4.31 0.68 -2.59 2.33 5.02 -0.75 -4.05 118.16 114.49 3nam n LYS 451 Ca 0.00 -0.22 -0.03 0.00 -2.02 0.00 0.00 58.31 56.04 3nam n LYS 451 Cb 0.23 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.79 3nam n LYS 451 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3nam n MET 452 N -0.96 1.87 -1.41 1.97 0.00 -0.71 -4.44 117.12 113.43 3nam n MET 452 Ca 0.14 -3.49 -0.22 0.00 0.00 0.00 0.00 57.70 54.14 3nam n MET 452 Cb 0.28 -1.59 -0.21 0.00 0.00 0.00 0.00 33.22 31.70 3nam n MET 452 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 3nam n ASN 453 N -0.54 -1.27 0.10 3.17 6.94 -1.17 -4.63 115.26 117.85 3nam n ASN 453 Ca 0.12 -0.47 0.18 0.00 -0.02 0.00 0.00 54.58 54.40 3nam n ASN 453 Cb 0.85 -0.53 0.73 0.00 -2.36 0.00 0.00 39.78 38.47 3nam n ASN 453 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 3nam h VAL 454 N 6.66 0.64 -0.01 3.53 2.07 -1.88 0.20 116.25 127.47 3nam h VAL 454 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 3nam h VAL 454 Cb 1.08 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3nam h VAL 454 CO 1.52 0.00 -0.19 0.49 0.02 0.00 0.00 177.57 179.41 3nam n PHE 455 N -4.15 0.00 -1.64 1.57 3.72 -1.26 -3.66 117.46 112.03 3nam n PHE 455 Ca 0.06 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.27 3nam n PHE 455 Cb 0.47 -0.10 -0.07 0.00 -0.94 0.00 0.00 39.48 38.84 3nam n PHE 455 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3nam n ASN 456 N -0.49 -4.92 -4.66 4.37 3.02 0.69 -4.88 115.26 108.39 3nam n ASN 456 Ca 0.14 0.41 -0.45 0.00 -0.03 0.00 0.00 54.58 54.64 3nam n ASN 456 Cb 0.35 -4.37 -0.03 0.00 -0.61 0.00 0.00 39.78 35.12 3nam n ASN 456 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3nam n THR 457 N -2.41 0.96 -1.69 3.41 -2.24 -1.26 -4.87 114.28 106.18 3nam n THR 457 Ca -0.19 -0.24 -0.43 0.00 -2.27 0.00 0.00 64.05 60.92 3nam n THR 457 Cb 0.61 -1.40 -0.02 0.00 -2.10 0.00 0.00 70.33 67.42 3nam n THR 457 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3nam n GLU 458 N 1.97 2.16 0.00 -0.78 -0.58 -1.26 -4.89 120.64 117.26 3nam n GLU 458 Ca 0.12 0.76 0.00 0.00 -0.42 0.00 0.00 57.16 57.62 3nam n GLU 458 Cb 0.31 -2.40 0.00 0.00 -0.57 0.00 0.00 31.44 28.78 3nam n GLU 458 CO 0.00 0.00 0.00 1.55 -0.48 0.00 0.00 177.13 178.20 3nam n VAL 459 N 1.22 0.00 0.18 2.62 3.14 -1.26 -4.85 118.33 119.38 3nam n VAL 459 Ca 0.08 0.00 0.11 0.00 -2.96 0.00 0.00 64.34 61.57 3nam n VAL 459 Cb 0.34 0.00 0.60 0.00 -1.06 0.00 0.00 33.84 33.72 3nam n VAL 459 CO 0.00 0.00 0.00 -2.11 -6.46 0.00 0.00 176.83 168.26 3nam n ARG 460 N -0.23 0.15 -0.82 1.45 1.85 -1.26 -1.87 116.66 115.92 3nam n ARG 460 Ca 0.00 0.63 -0.17 0.00 -1.00 0.00 0.00 57.85 57.32 3nam n ARG 460 Cb 0.00 -1.97 0.09 0.00 -1.05 0.00 0.00 32.46 29.53 3nam n ARG 460 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3nam n ASN 461 N -2.27 4.48 -4.15 2.89 3.02 -1.26 -4.90 115.26 113.06 3nam n ASN 461 Ca -0.01 -3.06 -0.10 0.00 -0.03 0.00 0.00 54.58 51.38 3nam n ASN 461 Cb 0.04 -0.81 -0.10 0.00 -0.61 0.00 0.00 39.78 38.31 3nam n ASN 461 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3nam s LEU 462 N -2.09 2.34 0.00 3.41 1.43 -0.78 -5.17 118.68 117.82 3nam s LEU 462 Ca 0.36 -1.06 -0.09 0.00 -1.03 0.00 0.00 54.13 52.31 3nam s LEU 462 Cb 0.30 0.07 0.13 0.00 0.03 0.00 0.00 46.19 46.72 3nam s LEU 462 CO 0.04 -0.56 0.47 -1.54 0.23 0.00 0.00 176.35 174.99 3nam n SER 463 N -0.03 -1.51 -0.05 2.29 3.41 -1.26 -4.84 113.62 111.63 3nam n SER 463 Ca -0.11 -0.77 -0.10 0.00 -0.26 0.00 0.00 58.87 57.63 3nam n SER 463 Cb 0.62 -0.43 -0.15 0.00 -0.26 0.00 0.00 64.21 63.99 3nam n SER 463 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3nam n LYS 464 N -2.96 0.66 -0.17 4.33 5.02 -1.26 -2.39 118.16 121.39 3nam n LYS 464 Ca 0.06 0.20 -0.08 0.00 -2.02 0.00 0.00 58.31 56.47 3nam n LYS 464 Cb 0.25 -1.70 0.01 0.00 -0.02 0.00 0.00 35.03 33.57 3nam n LYS 464 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 3nam h VAL 465 N 0.00 1.21 -0.01 -0.18 -1.51 -1.95 -3.19 116.25 110.62 3nam h VAL 465 Ca -0.38 -0.65 -0.03 0.00 -1.23 0.00 0.00 66.70 64.41 3nam h VAL 465 Cb 2.08 0.74 0.00 0.00 -2.13 0.00 0.00 31.29 31.99 3nam h VAL 465 CO 0.06 0.24 -0.09 -0.08 -1.23 0.00 0.00 177.57 176.47 3nam h GLU 466 N 0.63 0.09 -1.32 5.19 4.22 -1.94 -3.24 114.58 118.21 3nam h GLU 466 Ca 0.16 -0.08 0.38 0.00 0.08 0.00 0.00 59.36 59.91 3nam h GLU 466 Cb 0.20 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.41 3nam h GLU 466 CO -0.01 0.76 1.19 -2.13 -2.18 0.00 0.00 179.01 176.64 3nam n ARG 467 N -4.66 0.01 0.05 1.92 3.00 -1.01 -1.98 116.66 113.99 3nam n ARG 467 Ca -0.09 0.95 -0.14 0.00 -0.00 0.00 0.00 57.85 58.57 3nam n ARG 467 Cb 0.39 -2.28 -0.09 0.00 0.00 0.00 0.00 32.46 30.48 3nam n ARG 467 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3nam h ALA 468 N 0.66 -0.90 -1.22 5.13 0.00 -1.58 -3.20 119.26 118.15 3nam h ALA 468 Ca 0.63 -0.08 -0.64 0.00 0.00 0.00 0.00 54.91 54.82 3nam h ALA 468 Cb 3.01 0.90 -0.37 0.00 0.00 0.00 0.00 17.79 21.33 3nam h ALA 468 CO -0.01 -1.05 -0.12 0.09 0.00 0.00 0.00 179.25 178.17 3nam n ASN 469 N -5.11 5.76 0.01 0.00 3.02 -0.84 -4.83 115.26 113.28 3nam n ASN 469 Ca -0.07 -3.76 -0.01 0.00 -0.03 0.00 0.00 54.58 50.71 3nam n ASN 469 Cb 0.35 -0.65 -0.00 0.00 -0.61 0.00 0.00 39.78 38.86 3nam n ASN 469 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3nam h ALA 470 N 2.59 -0.14 0.00 5.41 0.00 -1.63 -3.15 119.26 122.33 3nam h ALA 470 Ca 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3nam h ALA 470 Cb 0.75 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3nam h ALA 470 CO 1.06 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 180.17 3nam h ASN 472 N 0.00 0.45 0.76 0.00 2.35 -1.91 -3.25 115.58 113.98 3nam h ASN 472 Ca 0.00 -0.79 0.00 0.00 -0.55 0.00 0.00 56.30 54.96 3nam h ASN 472 Cb 0.31 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.54 3nam h ASN 472 CO 0.00 1.19 0.00 -1.54 -1.65 0.00 0.00 177.43 175.43 3nam n SER 473 N -4.27 0.47 0.09 5.81 3.41 -1.15 -1.61 113.62 116.36 3nam n SER 473 Ca -0.11 0.60 -0.12 0.00 -0.26 0.00 0.00 58.87 58.98 3nam n SER 473 Cb 0.65 -0.71 -0.09 0.00 -0.26 0.00 0.00 64.21 63.81 3nam n SER 473 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 3nam h VAL 474 N 0.00 1.51 0.00 -3.33 -1.51 -1.60 -2.70 116.25 108.62 3nam h VAL 474 Ca 0.00 -2.89 -0.04 0.00 -1.23 0.00 0.00 66.70 62.54 3nam h VAL 474 Cb 0.38 2.72 -0.01 0.00 -2.13 0.00 0.00 31.29 32.25 3nam h VAL 474 CO 0.00 0.84 -0.22 0.40 -1.23 0.00 0.00 177.57 177.36 3nam h ILE 475 N 0.10 0.35 0.00 7.19 2.04 -1.47 -2.99 117.51 122.73 3nam h ILE 475 Ca -0.09 -1.50 0.00 0.00 1.00 0.00 0.00 64.86 64.28 3nam h ILE 475 Cb 1.76 2.17 0.00 0.00 -0.74 0.00 0.00 36.82 40.01 3nam h ILE 475 CO 0.17 0.20 0.00 0.03 0.00 0.00 0.00 178.15 178.55 3nam h ARG 476 N 0.00 0.00 -0.01 2.37 3.08 -1.18 -3.05 114.38 115.59 3nam h ARG 476 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3nam h ARG 476 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 3nam h ARG 476 CO 0.03 0.00 -0.45 1.04 -1.07 0.00 0.00 179.97 179.52 3nam n GLN 477 N -3.01 1.14 -0.04 0.04 6.02 -1.03 -4.12 117.38 116.39 3nam n GLN 477 Ca 0.03 -0.91 -0.09 0.00 -0.01 0.00 0.00 57.00 56.01 3nam n GLN 477 Cb 0.42 -1.48 -0.14 0.00 1.02 0.00 0.00 30.24 30.05 3nam n GLN 477 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 3nam n LEU 478 N -0.13 0.82 -4.25 1.08 0.00 -1.16 -4.80 117.00 108.57 3nam n LEU 478 Ca 0.10 0.33 -0.26 0.00 0.00 0.00 0.00 56.01 56.17 3nam n LEU 478 Cb 0.45 0.16 -0.15 0.00 0.00 0.00 0.00 43.42 43.88 3nam n LEU 478 CO 0.28 0.43 -0.53 -0.04 0.00 0.00 0.00 177.39 177.54 3nam s MET 479 N -2.58 1.50 -0.32 1.96 -1.94 -1.19 -3.44 119.30 113.28 3nam s MET 479 Ca -0.07 -0.89 -0.12 0.00 -1.71 0.00 0.00 55.69 52.91 3nam s MET 479 Cb 0.08 -1.57 -0.02 0.00 2.01 0.00 0.00 34.83 35.33 3nam s MET 479 CO 0.82 0.41 0.20 0.21 -0.01 0.00 0.00 175.02 176.65 3nam s LYS 480 N -0.97 3.49 -0.55 2.03 2.20 0.17 -4.75 119.74 121.36 3nam s LYS 480 Ca 0.08 -0.63 -0.28 0.00 -0.36 0.00 0.00 55.97 54.78 3nam s LYS 480 Cb -0.09 -3.71 0.00 0.00 -1.51 0.00 0.00 37.83 32.53 3nam s LYS 480 CO 0.01 -0.40 1.55 0.21 -0.36 0.00 0.00 175.35 176.36 3nam s LYS 481 N 1.69 3.16 0.00 4.03 2.20 -1.26 -1.47 119.74 128.08 3nam s LYS 481 Ca 0.06 0.58 0.00 0.00 -0.36 0.00 0.00 55.97 56.24 3nam s LYS 481 Cb -0.17 -4.19 0.00 0.00 -1.51 0.00 0.00 37.83 31.96 3nam s LYS 481 CO 0.09 -2.11 0.31 0.39 -0.36 0.00 0.00 175.35 173.67 3nam n GLU 482 N 8.78 0.00 -2.02 4.03 -0.58 0.27 -4.98 120.64 126.14 3nam n GLU 482 Ca 0.15 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.89 3nam n GLU 482 Cb 0.49 -0.79 -0.00 0.00 -0.57 0.00 0.00 31.44 30.57 3nam n GLU 482 CO 0.00 0.00 0.00 1.97 -0.48 0.00 0.00 177.13 178.62 3nam n PHE 483 N -0.44 -0.00 -3.71 -0.32 1.16 -1.19 -4.97 117.46 107.99 3nam n PHE 483 Ca 0.00 -0.02 -0.12 0.00 -1.87 0.00 0.00 57.45 55.44 3nam n PHE 483 Cb 0.00 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 37.77 3nam n PHE 483 CO 0.00 0.00 0.00 -0.08 -1.87 0.00 0.00 176.76 174.81 3nam s THR 484 N -1.70 -0.01 -0.58 1.97 -1.32 -1.26 -1.21 115.64 111.52 3nam s THR 484 Ca 0.00 0.04 -0.21 0.00 -1.21 0.00 0.00 61.69 60.32 3nam s THR 484 Cb 0.00 -0.63 0.08 0.00 -1.51 0.00 0.00 72.50 70.44 3nam s THR 484 CO 0.00 0.02 0.78 -0.76 -2.21 0.00 0.00 174.62 172.45 3nam s LEU 485 N 0.77 4.87 0.90 9.08 1.43 -0.53 -4.96 118.68 130.24 3nam s LEU 485 Ca -0.04 -1.07 -0.11 0.00 -1.03 0.00 0.00 54.13 51.88 3nam s LEU 485 Cb -0.05 -2.43 0.11 0.00 0.03 0.00 0.00 46.19 43.85 3nam s LEU 485 CO -0.06 -1.16 1.01 -1.84 0.23 0.00 0.00 176.35 174.54 3nam n GLU 486 N 6.79 -0.29 -2.15 1.70 0.00 -1.26 -1.78 120.64 123.64 3nam n GLU 486 Ca -0.06 -0.02 -0.39 0.00 0.00 0.00 0.00 57.16 56.69 3nam n GLU 486 Cb 0.44 -2.28 -0.01 0.00 0.00 0.00 0.00 31.44 29.59 3nam n GLU 486 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.13 177.25 3nam s PHE 487 N -2.48 2.94 -0.15 -1.84 5.36 -1.26 -4.71 117.98 115.85 3nam s PHE 487 Ca 0.66 1.47 -0.12 0.00 -0.96 0.00 0.00 56.93 57.98 3nam s PHE 487 Cb -0.24 -3.57 0.04 0.00 -0.34 0.00 0.00 43.02 38.91 3nam s PHE 487 CO 0.58 -1.77 0.38 -1.54 -1.46 0.00 0.00 175.22 171.42 3nam s SER 488 N -0.85 -0.41 0.17 6.13 1.04 -1.25 -5.01 113.70 113.52 3nam s SER 488 Ca 0.56 0.77 0.16 0.00 0.48 0.00 0.00 55.95 57.92 3nam s SER 488 Cb -0.36 0.76 0.75 0.00 0.10 0.00 0.00 66.02 67.28 3nam s SER 488 CO 0.46 -0.14 1.50 0.54 0.98 0.00 0.00 173.24 176.57 3nam n ARG 489 N 3.11 0.10 0.41 4.02 1.74 -1.26 -1.03 116.66 123.75 3nam n ARG 489 Ca -0.15 0.46 -0.16 0.00 -0.77 0.00 0.00 57.85 57.23 3nam n ARG 489 Cb 0.57 -1.74 -0.08 0.00 -1.02 0.00 0.00 32.46 30.19 3nam n ARG 489 CO 0.00 0.00 0.00 0.38 -1.52 0.00 0.00 177.63 176.49 3nam h ASP 490 N 0.00 -0.90 0.46 0.55 2.03 -1.97 -3.30 116.42 113.28 3nam h ASP 490 Ca 0.00 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 56.33 3nam h ASP 490 Cb 0.17 0.23 0.00 0.00 -0.83 0.00 0.00 39.33 38.90 3nam h ASP 490 CO 0.00 -0.57 -0.64 -2.11 -1.03 0.00 0.00 179.24 174.89 3nam n ARG 491 N -5.26 0.06 -3.67 4.15 1.85 -1.18 -4.99 116.66 107.62 3nam n ARG 491 Ca -0.13 0.01 -0.21 0.00 -1.00 0.00 0.00 57.85 56.51 3nam n ARG 491 Cb 0.42 -1.53 0.04 0.00 -1.05 0.00 0.00 32.46 30.35 3nam n ARG 491 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 3nam n LYS 492 N -1.61 -5.31 -3.73 2.89 4.76 -0.20 -4.77 118.16 110.19 3nam n LYS 492 Ca 0.05 0.66 -0.02 0.00 -2.87 0.00 0.00 58.31 56.13 3nam n LYS 492 Cb 0.35 -5.33 -0.01 0.00 -1.84 0.00 0.00 35.03 28.21 3nam n LYS 492 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3nam s SER 493 N -4.26 -0.12 0.21 4.39 1.04 -1.25 -1.93 113.70 111.77 3nam s SER 493 Ca 0.06 -0.34 -0.06 0.00 0.48 0.00 0.00 55.95 56.09 3nam s SER 493 Cb -0.03 0.38 -0.02 0.00 0.10 0.00 0.00 66.02 66.45 3nam s SER 493 CO 0.80 -0.71 0.27 0.00 0.98 0.00 0.00 173.24 174.58 3nam s MET 494 N -2.90 1.30 0.36 4.02 0.23 -1.02 -3.80 119.30 117.48 3nam s MET 494 Ca 0.14 -1.42 -0.07 0.00 -1.03 0.00 0.00 55.69 53.31 3nam s MET 494 Cb 0.01 0.35 0.03 0.00 -1.53 0.00 0.00 34.83 33.69 3nam s MET 494 CO 0.01 -0.48 0.59 -1.13 -2.03 0.00 0.00 175.02 171.98 3nam n SER 495 N -0.29 -1.69 -3.74 -1.18 3.41 -0.73 -1.92 113.62 107.48 3nam n SER 495 Ca -0.01 -2.69 -0.13 0.00 -0.26 0.00 0.00 58.87 55.77 3nam n SER 495 Cb 0.64 2.97 -0.09 0.00 -0.26 0.00 0.00 64.21 67.47 3nam n SER 495 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3nam s VAL 496 N -2.52 0.02 -0.23 -3.33 -7.23 -1.02 -1.46 120.40 104.64 3nam s VAL 496 Ca 0.22 -0.15 -0.12 0.00 -1.81 0.00 0.00 61.98 60.13 3nam s VAL 496 Cb -0.03 -0.59 -0.05 0.00 0.56 0.00 0.00 36.38 36.28 3nam s VAL 496 CO 0.16 -0.08 0.22 -0.47 -0.31 0.00 0.00 175.10 174.62 3nam s TYR 497 N -0.34 3.34 -0.06 2.82 5.04 -0.35 -1.84 117.35 125.95 3nam s TYR 497 Ca -0.05 0.33 0.00 0.00 -2.44 0.00 0.00 57.07 54.92 3nam s TYR 497 Cb -0.03 -2.33 0.02 0.00 0.35 0.00 0.00 41.96 39.97 3nam s TYR 497 CO 0.02 0.06 -0.05 0.00 -1.34 0.00 0.00 175.55 174.25 3nam s SER 499 N 1.30 5.78 1.12 0.00 1.04 -0.54 -0.26 113.70 122.13 3nam s SER 499 Ca -0.05 -0.27 -0.09 0.00 0.48 0.00 0.00 55.95 56.02 3nam s SER 499 Cb -0.14 -1.18 0.13 0.00 0.10 0.00 0.00 66.02 64.94 3nam s SER 499 CO -0.02 -0.39 0.45 -2.65 0.98 0.00 0.00 173.24 171.61 3nam n PRO 500 N -1.55 -2.06 -3.72 4.02 -0.02 -1.26 0.43 135.00 130.84 3nam n PRO 500 Ca -0.01 -0.72 -0.29 0.00 -2.02 0.00 0.00 63.50 60.45 3nam n PRO 500 Cb 0.59 -0.70 -0.15 0.00 -0.02 0.00 0.00 33.50 33.21 3nam n PRO 500 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3nam s ALA 501 N -2.89 1.38 0.00 3.55 0.00 -1.22 -4.02 121.76 118.55 3nam s ALA 501 Ca 0.30 -1.46 0.00 0.00 0.00 0.00 0.00 51.96 50.80 3nam s ALA 501 Cb -0.03 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.56 3nam s ALA 501 CO 0.23 -1.58 0.00 1.63 0.00 0.00 0.00 175.76 176.04 3nam n LYS 502 N 4.91 0.00 0.00 0.00 5.02 -1.26 -4.24 118.16 122.60 3nam n LYS 502 Ca -0.04 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.38 3nam n LYS 502 Cb 0.43 0.00 0.40 0.00 -0.02 0.00 0.00 35.03 35.84 3nam n LYS 502 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3nam n SER 503 N 0.90 0.79 0.00 4.39 3.41 -1.26 -3.57 113.62 118.28 3nam n SER 503 Ca 0.00 -0.67 0.08 0.00 -0.26 0.00 0.00 58.87 58.02 3nam n SER 503 Cb 0.00 0.10 0.36 0.00 -0.26 0.00 0.00 64.21 64.41 3nam n SER 503 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3nam n SER 504 N -0.89 0.00 -0.77 4.04 7.64 -1.26 -2.81 113.62 119.57 3nam n SER 504 Ca 0.11 0.46 0.01 0.00 1.01 0.00 0.00 58.87 60.46 3nam n SER 504 Cb 0.33 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 3nam n SER 504 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3nam n ARG 505 N -1.48 0.00 0.20 1.43 5.12 -1.24 -4.95 116.66 115.74 3nam n ARG 505 Ca 0.04 -1.19 -0.16 0.00 -1.93 0.00 0.00 57.85 54.62 3nam n ARG 505 Cb 0.19 -0.32 -0.08 0.00 -1.16 0.00 0.00 32.46 31.10 3nam n ARG 505 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3nam h ALA 506 N 0.25 -0.82 -0.53 7.54 0.00 -1.57 -3.41 119.26 120.72 3nam h ALA 506 Ca -0.07 -0.12 -0.41 0.00 0.00 0.00 0.00 54.91 54.31 3nam h ALA 506 Cb 1.50 0.60 0.03 0.00 0.00 0.00 0.00 17.79 19.92 3nam h ALA 506 CO 0.02 -1.00 -0.02 0.00 0.00 0.00 0.00 179.25 178.24 3nam n ALA 507 N -2.73 -2.14 -3.40 0.00 0.00 -1.26 -0.70 120.51 110.27 3nam n ALA 507 Ca -0.09 0.30 -0.16 0.00 0.00 0.00 0.00 53.44 53.49 3nam n ALA 507 Cb 0.39 -0.92 -0.05 0.00 0.00 0.00 0.00 19.45 18.87 3nam n ALA 507 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3nam n VAL 508 N 0.66 -0.47 0.00 0.00 0.24 -1.26 -4.84 118.33 112.66 3nam n VAL 508 Ca 0.10 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 3nam n VAL 508 Cb 0.06 -0.49 0.00 0.00 -1.47 0.00 0.00 33.84 31.94 3nam n VAL 508 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3nam n GLY 509 N -1.73 -1.23 3.64 7.63 0.00 0.12 -4.59 105.19 109.03 3nam n GLY 509 Ca -0.15 0.21 -0.58 0.00 0.00 0.00 0.00 46.02 45.50 3nam n GLY 509 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3nam n ASN 510 N -0.28 2.14 -4.21 1.61 3.02 -1.26 -4.44 115.26 111.84 3nam n ASN 510 Ca 0.00 0.96 -0.15 0.00 -0.03 0.00 0.00 54.58 55.36 3nam n ASN 510 Cb 0.00 -1.12 -0.11 0.00 -0.61 0.00 0.00 39.78 37.95 3nam n ASN 510 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3nam s LYS 511 N 4.11 0.95 -0.21 3.52 -0.14 0.64 -4.46 119.74 124.15 3nam s LYS 511 Ca 1.02 -1.29 0.01 0.00 -1.36 0.00 0.00 55.97 54.35 3nam s LYS 511 Cb -1.11 -0.61 0.05 0.00 -1.68 0.00 0.00 37.83 34.48 3nam s LYS 511 CO 0.65 0.09 -0.08 1.41 -0.76 0.00 0.00 175.35 176.66 3nam s MET 512 N -3.16 1.79 -0.40 1.68 1.75 -1.09 -0.31 119.30 119.55 3nam s MET 512 Ca 0.10 -0.87 -0.15 0.00 -1.25 0.00 0.00 55.69 53.52 3nam s MET 512 Cb -0.01 -2.45 0.02 0.00 2.84 0.00 0.00 34.83 35.23 3nam s MET 512 CO 0.01 -0.50 0.30 -0.06 -0.65 0.00 0.00 175.02 174.11 3nam s PHE 513 N 1.42 3.24 -0.07 4.11 0.08 -0.77 0.52 117.98 126.50 3nam s PHE 513 Ca -0.03 -0.53 0.02 0.00 0.12 0.00 0.00 56.93 56.51 3nam s PHE 513 Cb -0.17 -2.59 -0.02 0.00 -0.57 0.00 0.00 43.02 39.67 3nam s PHE 513 CO -0.07 -0.57 -0.13 0.54 -0.10 0.00 0.00 175.22 174.89 3nam s VAL 514 N 1.70 3.15 -0.05 -0.44 0.11 -0.60 -2.43 120.40 121.84 3nam s VAL 514 Ca 0.05 -0.67 0.01 0.00 -2.93 0.00 0.00 61.98 58.44 3nam s VAL 514 Cb -0.19 -2.26 0.02 0.00 -1.53 0.00 0.00 36.38 32.42 3nam s VAL 514 CO 0.10 0.58 -0.07 -1.59 -3.33 0.00 0.00 175.10 170.79 3nam s LYS 515 N -0.48 1.14 0.00 1.54 -2.85 -0.81 -0.24 119.74 118.05 3nam s LYS 515 Ca 0.06 -0.21 0.00 0.00 -1.00 0.00 0.00 55.97 54.82 3nam s LYS 515 Cb -0.12 -1.06 0.00 0.00 -2.06 0.00 0.00 37.83 34.59 3nam s LYS 515 CO 0.02 -0.06 0.00 0.41 0.10 0.00 0.00 175.35 175.82 3nam n GLY 516 N 4.02 1.90 3.76 0.59 0.00 -0.65 -2.44 105.19 112.37 3nam n GLY 516 Ca -0.23 -0.89 -0.38 0.00 0.00 0.00 0.00 46.02 44.51 3nam n GLY 516 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3nam s ALA 517 N -1.00 2.98 0.09 4.61 0.00 -0.81 -0.61 121.76 127.02 3nam s ALA 517 Ca 0.00 1.25 -0.27 0.00 0.00 0.00 0.00 51.96 52.94 3nam s ALA 517 Cb 0.00 -3.52 -0.14 0.00 0.00 0.00 0.00 23.12 19.46 3nam s ALA 517 CO 0.00 -1.11 1.67 -1.35 0.00 0.00 0.00 175.76 174.98 3nam h PRO 518 N 1.91 -0.42 -0.24 0.00 0.11 -1.91 -2.05 132.00 129.40 3nam h PRO 518 Ca -0.50 0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.69 3nam h PRO 518 Cb 1.27 0.10 -0.06 0.00 0.11 0.00 0.00 31.00 32.43 3nam h PRO 518 CO 0.59 -0.28 -0.12 1.49 -0.21 0.00 0.00 178.00 179.47 3nam h GLU 519 N -0.44 -0.09 0.00 1.05 4.81 -1.97 0.31 114.58 118.25 3nam h GLU 519 Ca -0.02 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3nam h GLU 519 Cb 0.38 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.78 3nam h GLU 519 CO 0.01 -0.06 0.00 0.41 -0.73 0.00 0.00 179.01 178.64 3nam n GLY 520 N -1.29 -3.34 0.33 1.92 0.00 -1.14 -2.65 105.19 99.03 3nam n GLY 520 Ca -0.01 0.45 0.10 0.00 0.00 0.00 0.00 46.02 46.56 3nam n GLY 520 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3nam h VAL 521 N 0.00 0.94 0.00 1.61 -1.51 -1.39 -2.41 116.25 113.49 3nam h VAL 521 Ca 0.00 -0.10 -0.02 0.00 -1.23 0.00 0.00 66.70 65.35 3nam h VAL 521 Cb 0.00 0.62 -0.00 0.00 -2.13 0.00 0.00 31.29 29.78 3nam h VAL 521 CO 0.00 0.05 -0.08 0.40 -1.23 0.00 0.00 177.57 176.72 3nam h ILE 522 N 0.29 0.30 0.00 7.19 2.04 -0.89 -1.69 117.51 124.75 3nam h ILE 522 Ca 0.18 -0.52 -0.11 0.00 1.00 0.00 0.00 64.86 65.41 3nam h ILE 522 Cb 0.35 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 3nam h ILE 522 CO -0.04 0.08 -0.54 0.44 0.00 0.00 0.00 178.15 178.09 3nam h ASP 523 N 0.00 0.00 -0.39 1.72 3.32 -1.19 -2.98 116.42 116.90 3nam h ASP 523 Ca -0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 3nam h ASP 523 Cb 0.39 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 3nam h ASP 523 CO 0.01 0.54 0.07 0.54 -1.72 0.00 0.00 179.24 178.68 3nam n ARG 524 N -3.71 3.09 -3.80 3.56 1.74 -0.64 -4.85 116.66 112.05 3nam n ARG 524 Ca -0.01 -1.89 -0.36 0.00 -0.77 0.00 0.00 57.85 54.82 3nam n ARG 524 Cb 0.58 -1.92 -0.13 0.00 -1.02 0.00 0.00 32.46 29.97 3nam n ARG 524 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3nam n ASN 526 N 4.85 0.68 -4.04 0.00 5.03 0.37 -4.71 115.26 117.44 3nam n ASN 526 Ca -0.16 -0.45 -0.09 0.00 0.87 0.00 0.00 54.58 54.75 3nam n ASN 526 Cb 0.49 0.79 -0.09 0.00 -1.02 0.00 0.00 39.78 39.95 3nam n ASN 526 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 3nam s TYR 527 N -3.11 0.56 0.16 3.10 2.02 -0.70 -1.51 117.35 117.87 3nam s TYR 527 Ca 0.06 -0.97 0.09 0.00 -0.37 0.00 0.00 57.07 55.88 3nam s TYR 527 Cb 0.16 -0.28 -0.04 0.00 -0.40 0.00 0.00 41.96 41.39 3nam s TYR 527 CO 0.80 -0.55 -0.20 0.14 -1.57 0.00 0.00 175.55 174.17 3nam s VAL 528 N -3.97 1.96 -0.27 0.71 -7.23 0.31 -0.53 120.40 111.38 3nam s VAL 528 Ca 0.16 -1.89 -0.03 0.00 -1.81 0.00 0.00 61.98 58.40 3nam s VAL 528 Cb 0.06 -1.88 0.02 0.00 0.56 0.00 0.00 36.38 35.14 3nam s VAL 528 CO -0.03 -0.21 -0.01 -0.60 -0.31 0.00 0.00 175.10 173.94 3nam s ARG 529 N -2.61 2.86 -1.02 4.82 3.52 -0.82 -1.45 118.95 124.25 3nam s ARG 529 Ca 0.16 -0.98 -0.08 0.00 -0.13 0.00 0.00 55.73 54.70 3nam s ARG 529 Cb -0.07 -3.13 0.26 0.00 -1.56 0.00 0.00 34.95 30.44 3nam s ARG 529 CO 0.07 -0.44 0.99 0.14 -0.81 0.00 0.00 175.30 175.25 3nam s VAL 530 N 1.37 5.56 0.00 7.11 -7.23 -1.21 -4.44 120.40 121.57 3nam s VAL 530 Ca 0.00 -3.41 0.00 0.00 -1.81 0.00 0.00 61.98 56.77 3nam s VAL 530 Cb -0.17 -4.37 0.00 0.00 0.56 0.00 0.00 36.38 32.40 3nam s VAL 530 CO -0.02 -1.14 0.00 0.61 -0.31 0.00 0.00 175.10 174.24 3nam n GLY 531 N 2.78 0.77 0.00 2.32 0.00 -1.26 -3.42 105.19 106.38 3nam n GLY 531 Ca 0.22 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.61 3nam n GLY 531 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3nam n THR 532 N 0.00 0.00 -2.35 2.61 -2.24 -1.26 -3.49 114.28 107.55 3nam n THR 532 Ca 0.00 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3nam n THR 532 Cb 0.00 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 3nam n THR 532 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3nam n THR 533 N -0.45 0.00 -3.57 4.28 -2.24 -1.22 -5.15 114.28 105.93 3nam n THR 533 Ca 0.00 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.62 3nam n THR 533 Cb 0.00 -1.24 -0.06 0.00 -2.10 0.00 0.00 70.33 66.93 3nam n THR 533 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3nam s ARG 534 N -1.44 1.00 0.16 -0.78 3.52 -1.26 -3.32 118.95 116.83 3nam s ARG 534 Ca 0.00 -0.00 -0.03 0.00 -0.13 0.00 0.00 55.73 55.56 3nam s ARG 534 Cb 0.00 0.46 -0.03 0.00 -1.56 0.00 0.00 34.95 33.82 3nam s ARG 534 CO 0.00 -0.33 0.14 0.08 -0.81 0.00 0.00 175.30 174.38 3nam s VAL 535 N -1.72 0.07 0.07 7.11 1.01 -0.53 -4.94 120.40 121.46 3nam s VAL 535 Ca -0.09 -1.80 -0.22 0.00 0.00 0.00 0.00 61.98 59.87 3nam s VAL 535 Cb -0.01 -2.11 -0.06 0.00 0.00 0.00 0.00 36.38 34.20 3nam s VAL 535 CO 0.04 -0.31 0.66 -2.84 0.00 0.00 0.00 175.10 172.66 3nam s PRO 536 N -4.05 4.38 0.14 2.72 0.02 -1.26 -0.53 135.00 136.41 3nam s PRO 536 Ca 0.26 0.90 -0.34 0.00 0.02 0.00 0.00 61.00 61.84 3nam s PRO 536 Cb 0.06 -3.29 -0.13 0.00 0.02 0.00 0.00 34.50 31.16 3nam s PRO 536 CO 0.04 0.49 1.64 -0.12 -0.33 0.00 0.00 177.00 178.72 3nam n MET 537 N 2.13 2.26 -4.28 5.54 1.56 -0.57 -4.70 117.12 119.05 3nam n MET 537 Ca -0.07 0.82 -0.19 0.00 -0.27 0.00 0.00 57.70 57.98 3nam n MET 537 Cb 0.50 -2.61 -0.11 0.00 2.15 0.00 0.00 33.22 33.15 3nam n MET 537 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 3nam s THR 538 N 1.33 1.53 0.07 1.12 -4.23 -1.26 -4.90 115.64 109.31 3nam s THR 538 Ca 0.80 -1.80 -0.14 0.00 -1.18 0.00 0.00 61.69 59.36 3nam s THR 538 Cb -0.65 -1.66 -0.03 0.00 1.34 0.00 0.00 72.50 71.49 3nam s THR 538 CO 0.38 -0.38 1.10 0.61 -0.54 0.00 0.00 174.62 175.80 3nam n GLY 539 N 0.43 -2.43 0.22 3.99 0.00 -1.26 -1.72 105.19 104.42 3nam n GLY 539 Ca -0.14 0.78 0.00 0.00 0.00 0.00 0.00 46.02 46.65 3nam n GLY 539 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3nam h PRO 540 N 0.00 0.22 -0.50 1.61 0.13 -1.93 -1.90 132.00 129.63 3nam h PRO 540 Ca 0.07 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.16 3nam h PRO 540 Cb 0.19 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.24 3nam h PRO 540 CO -0.43 0.15 0.21 0.28 -0.23 0.00 0.00 178.00 177.98 3nam h VAL 541 N 0.23 1.18 -0.33 1.56 2.07 -1.66 -2.33 116.25 116.97 3nam h VAL 541 Ca 0.30 -0.57 -0.15 0.00 0.82 0.00 0.00 66.70 67.11 3nam h VAL 541 Cb 0.45 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 3nam h VAL 541 CO -0.40 0.22 -0.38 0.50 0.02 0.00 0.00 177.57 177.53 3nam h LYS 542 N 0.72 0.84 0.00 1.57 3.64 -0.58 -2.66 116.57 120.10 3nam h LYS 542 Ca 0.17 -0.46 -0.09 0.00 -1.27 0.00 0.00 60.65 59.00 3nam h LYS 542 Cb 0.13 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3nam h LYS 542 CO -0.02 1.10 -0.43 0.93 -2.27 0.00 0.00 179.45 178.76 3nam h GLU 543 N 0.63 0.00 0.00 1.90 4.39 -1.22 -1.72 114.58 118.56 3nam h GLU 543 Ca 0.05 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.68 3nam h GLU 543 Cb 0.97 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.61 3nam h GLU 543 CO 0.09 0.43 -0.31 -0.22 -1.16 0.00 0.00 179.01 177.85 3nam h LYS 544 N 0.00 0.00 0.12 2.33 1.63 -1.34 -2.64 116.57 116.67 3nam h LYS 544 Ca -0.00 0.00 -0.25 0.00 -0.85 0.00 0.00 60.65 59.55 3nam h LYS 544 Cb 0.83 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.46 3nam h LYS 544 CO 0.06 0.31 -1.23 0.82 -3.45 0.00 0.00 179.45 175.95 3nam h ILE 545 N 0.00 1.18 -0.01 2.00 2.04 -1.10 -3.31 117.51 118.30 3nam h ILE 545 Ca -0.00 -2.44 -0.07 0.00 1.00 0.00 0.00 64.86 63.34 3nam h ILE 545 Cb 0.87 2.86 -0.01 0.00 -0.74 0.00 0.00 36.82 39.80 3nam h ILE 545 CO 0.04 0.70 -0.33 -0.07 0.00 0.00 0.00 178.15 178.50 3nam h LEU 546 N -0.32 0.02 0.13 1.44 3.38 -1.34 -2.59 115.31 116.02 3nam h LEU 546 Ca -0.26 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 3nam h LEU 546 Cb 1.73 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.48 3nam h LEU 546 CO 0.09 0.34 -0.06 0.77 0.09 0.00 0.00 178.44 179.67 3nam h SER 547 N 0.01 -0.14 -0.30 -0.43 4.64 -1.63 -1.47 113.55 114.23 3nam h SER 547 Ca -0.00 -0.31 0.06 0.00 -0.47 0.00 0.00 61.79 61.07 3nam h SER 547 Cb 0.58 0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 3nam h SER 547 CO 0.04 0.25 0.21 0.58 -0.87 0.00 0.00 176.83 177.04 3nam h VAL 548 N -0.56 0.93 -0.07 0.95 2.07 -1.63 0.29 116.25 118.22 3nam h VAL 548 Ca -0.02 -0.05 -0.13 0.00 0.82 0.00 0.00 66.70 67.32 3nam h VAL 548 Cb 0.44 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 3nam h VAL 548 CO 0.03 0.03 -0.53 0.40 0.02 0.00 0.00 177.57 177.51 3nam h ILE 549 N 0.15 1.37 -0.03 4.57 1.08 -1.21 -2.25 117.51 121.18 3nam h ILE 549 Ca 0.13 -1.82 -0.08 0.00 -0.39 0.00 0.00 64.86 62.70 3nam h ILE 549 Cb 0.35 1.91 0.01 0.00 -3.07 0.00 0.00 36.82 36.01 3nam h ILE 549 CO -0.02 0.54 -0.30 0.50 -0.69 0.00 0.00 178.15 178.18 3nam h LYS 550 N 0.15 0.26 -0.15 2.37 3.64 0.56 -2.65 116.57 120.75 3nam h LYS 550 Ca 0.00 -0.24 0.03 0.00 -1.27 0.00 0.00 60.65 59.17 3nam h LYS 550 Cb 0.99 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.84 3nam h LYS 550 CO 0.08 0.91 -0.02 0.93 -2.27 0.00 0.00 179.45 179.08 3nam h GLU 551 N -0.31 0.02 -0.84 1.90 5.08 -1.03 0.30 114.58 119.70 3nam h GLU 551 Ca -0.03 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 3nam h GLU 551 Cb 0.99 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.19 3nam h GLU 551 CO 0.06 0.02 0.54 -1.49 -1.00 0.00 0.00 179.01 177.14 3nam h TRP 552 N 0.02 1.02 -0.00 4.33 4.06 -1.49 1.12 115.95 125.01 3nam h TRP 552 Ca 0.07 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.05 3nam h TRP 552 Cb 0.10 -0.34 0.00 0.00 -1.00 0.00 0.00 29.16 27.92 3nam h TRP 552 CO -0.17 0.59 -0.68 0.41 -3.56 0.00 0.00 178.44 175.03 3nam n GLY 553 N -1.33 -1.05 0.00 1.49 0.00 -1.00 -0.71 105.19 102.60 3nam n GLY 553 Ca 0.10 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3nam n GLY 553 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3nam n THR 554 N -1.37 0.03 -1.46 2.61 -1.04 0.10 -4.24 114.28 108.92 3nam n THR 554 Ca 0.06 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.05 61.73 3nam n THR 554 Cb 0.34 0.11 0.16 0.00 -1.82 0.00 0.00 70.33 69.12 3nam n THR 554 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 3nam s GLY 555 N -2.46 1.59 0.03 3.41 0.00 0.38 -4.77 107.32 105.52 3nam s GLY 555 Ca -0.01 -0.63 0.01 0.00 0.00 0.00 0.00 44.72 44.10 3nam s GLY 555 CO 0.08 0.01 0.73 0.54 0.00 0.00 0.00 173.10 174.45 3nam n ARG 556 N -3.97 0.01 0.03 2.90 1.74 -1.26 0.38 116.66 116.49 3nam n ARG 556 Ca 0.08 0.22 -0.20 0.00 -0.77 0.00 0.00 57.85 57.19 3nam n ARG 556 Cb 0.59 -1.85 -0.11 0.00 -1.02 0.00 0.00 32.46 30.07 3nam n ARG 556 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3nam h ASP 557 N 0.00 0.76 -6.35 0.55 3.32 -1.83 -3.48 116.42 109.40 3nam h ASP 557 Ca 0.00 -0.77 -0.46 0.00 0.02 0.00 0.00 57.03 55.82 3nam h ASP 557 Cb 0.66 -0.23 0.03 0.00 0.22 0.00 0.00 39.33 40.01 3nam h ASP 557 CO 0.00 1.43 -0.92 0.35 -1.72 0.00 0.00 179.24 178.38 3nam n THR 558 N -3.99 -4.66 -3.63 0.35 -2.24 0.16 -4.95 114.28 95.33 3nam n THR 558 Ca -0.11 -0.76 -0.37 0.00 -2.27 0.00 0.00 64.05 60.54 3nam n THR 558 Cb 0.82 -3.63 -0.06 0.00 -2.10 0.00 0.00 70.33 65.37 3nam n THR 558 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3nam s LEU 559 N -6.71 4.43 -0.26 3.22 1.43 0.11 -4.81 118.68 116.09 3nam s LEU 559 Ca 0.29 0.78 -0.21 0.00 -1.03 0.00 0.00 54.13 53.96 3nam s LEU 559 Cb -0.11 -2.53 -0.02 0.00 0.03 0.00 0.00 46.19 43.57 3nam s LEU 559 CO 0.87 0.32 0.65 -0.60 0.23 0.00 0.00 176.35 177.82 3nam s ARG 560 N -1.25 4.08 -0.08 1.70 3.52 0.16 -3.78 118.95 123.29 3nam s ARG 560 Ca 0.23 0.53 -0.15 0.00 -0.13 0.00 0.00 55.73 56.22 3nam s ARG 560 Cb -0.15 -3.66 -0.05 0.00 -1.56 0.00 0.00 34.95 29.53 3nam s ARG 560 CO 0.12 -0.45 0.38 0.00 -0.81 0.00 0.00 175.30 174.54 3nam s LEU 562 N -0.26 2.49 -0.17 0.00 1.43 -0.34 -4.41 118.68 117.43 3nam s LEU 562 Ca 0.22 -0.36 -0.05 0.00 -1.03 0.00 0.00 54.13 52.91 3nam s LEU 562 Cb -0.15 -1.51 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 3nam s LEU 562 CO 0.10 0.24 -0.01 0.00 0.23 0.00 0.00 176.35 176.91 3nam s ALA 563 N -0.09 3.12 -0.08 4.21 0.00 0.22 -0.70 121.76 128.44 3nam s ALA 563 Ca -0.03 -0.81 -0.00 0.00 0.00 0.00 0.00 51.96 51.11 3nam s ALA 563 Cb -0.14 -1.68 -0.03 0.00 0.00 0.00 0.00 23.12 21.27 3nam s ALA 563 CO 0.04 0.18 -0.05 -0.51 0.00 0.00 0.00 175.76 175.42 3nam s LEU 564 N 0.40 3.28 0.30 0.00 1.43 0.57 -1.64 118.68 123.02 3nam s LEU 564 Ca -0.02 0.01 -0.04 0.00 -1.03 0.00 0.00 54.13 53.05 3nam s LEU 564 Cb -0.14 -1.73 -0.01 0.00 0.03 0.00 0.00 46.19 44.34 3nam s LEU 564 CO 0.02 0.35 0.41 0.00 0.23 0.00 0.00 176.35 177.36 3nam s ALA 565 N -0.72 0.66 0.01 4.21 0.00 0.67 -1.12 121.76 125.47 3nam s ALA 565 Ca 0.11 -1.43 -0.02 0.00 0.00 0.00 0.00 51.96 50.62 3nam s ALA 565 Cb -0.11 1.19 -0.01 0.00 0.00 0.00 0.00 23.12 24.19 3nam s ALA 565 CO 0.02 -0.77 0.03 0.95 0.00 0.00 0.00 175.76 175.99 3nam s THR 566 N -3.49 0.08 -0.53 0.00 -4.23 -1.01 -1.55 115.64 104.91 3nam s THR 566 Ca 0.31 -0.68 -0.12 0.00 -1.18 0.00 0.00 61.69 60.02 3nam s THR 566 Cb 0.01 -0.27 0.13 0.00 1.34 0.00 0.00 72.50 73.71 3nam s THR 566 CO 0.17 -0.37 0.44 -0.60 -0.54 0.00 0.00 174.62 173.72 3nam s ARG 567 N -1.15 2.76 0.12 3.99 3.52 0.18 -1.58 118.95 126.79 3nam s ARG 567 Ca -0.13 -1.83 -0.31 0.00 -0.13 0.00 0.00 55.73 53.34 3nam s ARG 567 Cb -0.07 -4.10 -0.11 0.00 -1.56 0.00 0.00 34.95 29.10 3nam s ARG 567 CO -0.00 -1.25 1.51 -0.44 -0.81 0.00 0.00 175.30 174.31 3nam h ASP 568 N 8.52 -1.68 -3.73 -2.12 3.32 -1.85 -2.89 116.42 115.99 3nam h ASP 568 Ca -0.21 0.21 -0.70 0.00 0.02 0.00 0.00 57.03 56.34 3nam h ASP 568 Cb 1.08 0.67 -0.34 0.00 0.22 0.00 0.00 39.33 40.96 3nam h ASP 568 CO 0.92 -0.41 -0.44 0.42 -1.72 0.00 0.00 179.24 178.01 3nam s THR 569 N -5.49 3.64 0.95 0.35 -4.23 -1.26 -4.61 115.64 104.99 3nam s THR 569 Ca -0.14 -2.39 -0.13 0.00 -1.18 0.00 0.00 61.69 57.85 3nam s THR 569 Cb 0.07 -3.43 0.16 0.00 1.34 0.00 0.00 72.50 70.65 3nam s THR 569 CO 0.57 -0.79 1.14 -2.16 -0.54 0.00 0.00 174.62 172.84 3nam s PRO 570 N 0.66 0.83 0.81 3.99 0.04 -1.24 -5.03 135.00 135.06 3nam s PRO 570 Ca 0.12 0.26 -0.11 0.00 0.04 0.00 0.00 61.00 61.30 3nam s PRO 570 Cb -0.22 -1.81 0.07 0.00 0.04 0.00 0.00 34.50 32.59 3nam s PRO 570 CO -0.04 -2.40 1.09 -2.14 0.04 0.00 0.00 177.00 173.55 3nam s PRO 571 N -5.27 2.01 0.35 0.56 0.02 -1.26 -4.94 135.00 126.46 3nam s PRO 571 Ca 0.65 0.93 -0.29 0.00 0.02 0.00 0.00 61.00 62.31 3nam s PRO 571 Cb -0.14 -1.89 -0.11 0.00 0.02 0.00 0.00 34.50 32.38 3nam s PRO 571 CO 0.54 -1.75 1.48 0.15 -0.33 0.00 0.00 177.00 177.09 3nam s LYS 572 N -4.98 4.16 0.20 5.54 1.02 -1.26 -4.88 119.74 119.54 3nam s LYS 572 Ca 0.61 2.51 -0.12 0.00 0.02 0.00 0.00 55.97 58.99 3nam s LYS 572 Cb -0.16 -3.00 0.25 0.00 -0.52 0.00 0.00 37.83 34.40 3nam s LYS 572 CO 0.56 -0.50 1.67 -0.09 -0.92 0.00 0.00 175.35 176.07 3nam h ARG 573 N 3.52 0.11 0.00 1.68 2.43 -1.98 -0.13 114.38 120.02 3nam h ARG 573 Ca -0.50 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.67 3nam h ARG 573 Cb 1.23 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.76 3nam h ARG 573 CO 0.68 0.07 -0.01 1.05 -1.51 0.00 0.00 179.97 180.25 3nam h GLU 574 N 0.12 0.00 -0.35 0.20 9.09 -2.04 -1.74 114.58 119.86 3nam h GLU 574 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.70 3nam h GLU 574 Cb 0.46 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.56 3nam h GLU 574 CO -0.49 0.01 0.00 0.39 0.05 0.00 0.00 179.01 178.97 3nam n GLU 575 N -3.53 1.52 -4.95 1.06 -0.58 -0.06 -4.84 120.64 109.27 3nam n GLU 575 Ca -0.03 -0.64 -0.33 0.00 -0.42 0.00 0.00 57.16 55.75 3nam n GLU 575 Cb 0.10 -1.27 -0.15 0.00 -0.57 0.00 0.00 31.44 29.55 3nam n GLU 575 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 3nam s MET 576 N -1.68 3.06 -0.83 3.49 -1.94 -0.65 -4.93 119.30 115.82 3nam s MET 576 Ca 0.12 -0.75 -0.16 0.00 -1.71 0.00 0.00 55.69 53.18 3nam s MET 576 Cb 0.07 -2.46 0.17 0.00 2.01 0.00 0.00 34.83 34.62 3nam s MET 576 CO 0.07 0.30 0.88 0.08 -0.01 0.00 0.00 175.02 176.34 3nam s VAL 577 N 0.10 5.18 -0.26 -6.03 1.01 -1.26 -4.91 120.40 114.22 3nam s VAL 577 Ca -0.08 -1.94 0.00 0.00 0.00 0.00 0.00 61.98 59.96 3nam s VAL 577 Cb -0.15 -4.58 0.00 0.00 0.00 0.00 0.00 36.38 31.65 3nam s VAL 577 CO 0.05 -1.21 0.56 0.18 0.00 0.00 0.00 175.10 174.68 3nam n LEU 578 N 5.23 1.59 -2.76 3.92 4.77 -1.26 -3.73 117.00 124.77 3nam n LEU 578 Ca 0.14 -0.80 -0.01 0.00 -0.03 0.00 0.00 56.01 55.31 3nam n LEU 578 Cb 0.47 -0.32 0.09 0.00 -2.33 0.00 0.00 43.42 41.32 3nam n LEU 578 CO 0.43 0.28 0.29 -0.90 -1.33 0.00 0.00 177.39 176.16 3nam n ASP 579 N 0.55 0.13 -2.84 -1.43 5.68 -1.26 -5.00 116.55 112.38 3nam n ASP 579 Ca 0.00 -2.14 -0.03 0.00 -0.50 0.00 0.00 54.79 52.12 3nam n ASP 579 Cb 0.28 0.08 0.01 0.00 -1.14 0.00 0.00 41.12 40.34 3nam n ASP 579 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 3nam s ASP 580 N -2.53 -1.28 0.39 -1.12 -4.77 -1.24 -4.70 116.67 101.42 3nam s ASP 580 Ca 0.19 -1.31 0.04 0.00 -3.30 0.00 0.00 52.55 48.17 3nam s ASP 580 Cb 0.38 1.66 0.24 0.00 -1.09 0.00 0.00 42.92 44.12 3nam s ASP 580 CO -0.08 -0.07 0.97 0.77 0.70 0.00 0.00 175.17 177.46 3nam h SER 581 N 5.32 0.00 -0.37 2.11 4.64 -1.94 -0.01 113.55 123.30 3nam h SER 581 Ca 0.05 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3nam h SER 581 Cb 1.14 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.21 3nam h SER 581 CO 0.01 0.00 0.22 0.77 -0.87 0.00 0.00 176.83 176.96 3nam h SER 582 N 0.00 0.44 0.99 4.97 4.64 -1.97 -2.08 113.55 120.55 3nam h SER 582 Ca 0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3nam h SER 582 Cb 1.33 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3nam h SER 582 CO 0.00 0.37 0.00 0.54 -0.87 0.00 0.00 176.83 176.87 3nam n ARG 583 N -4.79 0.15 0.19 4.77 1.74 -0.02 -3.89 116.66 114.80 3nam n ARG 583 Ca -0.00 0.24 0.18 0.00 -0.77 0.00 0.00 57.85 57.50 3nam n ARG 583 Cb 0.06 -1.72 0.81 0.00 -1.02 0.00 0.00 32.46 30.59 3nam n ARG 583 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 3nam h PHE 584 N 0.00 0.00 0.00 -1.55 0.04 -1.46 -0.67 116.94 113.30 3nam h PHE 584 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3nam h PHE 584 Cb 0.50 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.65 3nam h PHE 584 CO 0.00 0.00 -0.04 1.98 -0.60 0.00 0.00 178.31 179.65 3nam h MET 585 N 0.00 0.00 0.12 1.51 4.05 -1.74 -3.08 114.93 115.80 3nam h MET 585 Ca 0.10 0.00 -0.29 0.00 -0.28 0.00 0.00 59.70 59.23 3nam h MET 585 Cb 0.58 0.00 0.02 0.00 -0.80 0.00 0.00 31.60 31.41 3nam h MET 585 CO -0.00 0.00 -1.24 1.49 0.23 0.00 0.00 176.91 177.39 3nam h GLU 586 N 0.00 0.55 0.00 0.39 4.57 -1.39 -3.27 114.58 115.44 3nam h GLU 586 Ca 0.00 -0.76 -0.06 0.00 -1.18 0.00 0.00 59.36 57.36 3nam h GLU 586 Cb 0.79 0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 29.63 3nam h GLU 586 CO 0.00 1.34 -0.29 1.88 -1.18 0.00 0.00 179.01 180.76 3nam h TYR 587 N 0.23 0.00 -1.62 0.92 0.05 -1.53 -3.22 116.97 111.81 3nam h TYR 587 Ca -0.18 0.00 -0.70 0.00 0.05 0.00 0.00 58.73 57.90 3nam h TYR 587 Cb 1.92 0.00 -0.21 0.00 1.01 0.00 0.00 36.73 39.45 3nam h TYR 587 CO 0.10 0.29 1.18 0.39 -1.05 0.00 0.00 178.16 179.07 3nam n GLU 588 N -3.44 3.73 -4.42 4.88 1.02 -1.17 -4.86 120.64 116.38 3nam n GLU 588 Ca 0.00 -3.47 -0.21 0.00 -0.02 0.00 0.00 57.16 53.46 3nam n GLU 588 Cb 0.47 -2.37 -0.10 0.00 -0.02 0.00 0.00 31.44 29.42 3nam n GLU 588 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3nam s THR 589 N -3.25 0.78 -1.10 2.62 -4.23 -1.22 -4.84 115.64 104.40 3nam s THR 589 Ca 0.51 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.95 3nam s THR 589 Cb 0.31 -2.60 -0.05 0.00 1.34 0.00 0.00 72.50 71.50 3nam s THR 589 CO -0.22 0.00 0.90 -0.67 -0.54 0.00 0.00 174.62 174.08 3nam n ASP 590 N -0.83 -5.46 -5.00 3.99 2.03 -1.13 -4.93 116.55 105.23 3nam n ASP 590 Ca -0.02 -0.75 -0.18 0.00 0.52 0.00 0.00 54.79 54.35 3nam n ASP 590 Cb 0.66 -4.84 0.01 0.00 -0.72 0.00 0.00 41.12 36.23 3nam n ASP 590 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3nam s LEU 591 N -5.78 3.68 -0.18 -2.67 1.43 -0.20 -4.61 118.68 110.34 3nam s LEU 591 Ca 0.37 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 3nam s LEU 591 Cb -0.07 -2.73 0.04 0.00 0.03 0.00 0.00 46.19 43.46 3nam s LEU 591 CO 0.76 -0.74 -0.12 0.42 0.23 0.00 0.00 176.35 176.90 3nam s THR 592 N -2.37 1.67 0.31 5.49 -4.23 -0.61 -0.48 115.64 115.41 3nam s THR 592 Ca 0.53 -0.91 -0.29 0.00 -1.18 0.00 0.00 61.69 59.83 3nam s THR 592 Cb -0.10 -1.67 -0.12 0.00 1.34 0.00 0.00 72.50 71.94 3nam s THR 592 CO 0.33 0.28 1.40 0.33 -0.54 0.00 0.00 174.62 176.42 3nam n PHE 593 N 4.70 2.43 -0.03 3.99 7.35 0.31 -2.39 117.46 133.82 3nam n PHE 593 Ca -0.16 0.45 -0.04 0.00 -0.76 0.00 0.00 57.45 56.94 3nam n PHE 593 Cb 0.48 -2.48 -0.05 0.00 0.35 0.00 0.00 39.48 37.79 3nam n PHE 593 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3nam n VAL 594 N 1.14 0.45 0.00 -2.13 0.31 -0.28 -1.94 118.33 115.88 3nam n VAL 594 Ca 0.07 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 3nam n VAL 594 Cb 0.35 -0.81 0.00 0.00 -0.91 0.00 0.00 33.84 32.47 3nam n VAL 594 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3nam n GLY 595 N 2.80 1.99 3.36 2.92 0.00 -1.03 -4.44 105.19 110.80 3nam n GLY 595 Ca -0.12 -1.05 -0.24 0.00 0.00 0.00 0.00 46.02 44.60 3nam n GLY 595 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3nam s VAL 596 N -2.00 2.04 -0.15 1.61 -7.23 -0.86 -0.32 120.40 113.49 3nam s VAL 596 Ca 0.00 -1.90 0.01 0.00 -1.81 0.00 0.00 61.98 58.28 3nam s VAL 596 Cb 0.00 -1.92 0.02 0.00 0.56 0.00 0.00 36.38 35.04 3nam s VAL 596 CO 0.00 -0.18 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.76 3nam s VAL 597 N -1.72 1.73 -0.26 1.32 1.01 0.12 -2.54 120.40 120.06 3nam s VAL 597 Ca 0.16 -0.74 -0.07 0.00 0.00 0.00 0.00 61.98 61.33 3nam s VAL 597 Cb -0.07 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.70 3nam s VAL 597 CO 0.07 0.49 0.06 -0.83 0.00 0.00 0.00 175.10 174.89 3nam s GLY 598 N 1.32 1.75 0.35 4.51 0.00 0.72 -1.20 107.32 114.77 3nam s GLY 598 Ca 0.02 -1.20 0.09 0.00 0.00 0.00 0.00 44.72 43.63 3nam s GLY 598 CO -0.09 0.54 0.05 -3.16 0.00 0.00 0.00 173.10 170.44 3nam s MET 599 N 1.57 2.13 -0.02 2.90 0.23 -0.75 -0.96 119.30 124.40 3nam s MET 599 Ca 0.06 -1.76 0.04 0.00 -1.03 0.00 0.00 55.69 53.00 3nam s MET 599 Cb -0.15 -1.95 -0.01 0.00 -1.53 0.00 0.00 34.83 31.19 3nam s MET 599 CO 0.02 0.09 -0.12 -1.17 -2.03 0.00 0.00 175.02 171.81 3nam s LEU 600 N -3.76 1.96 -0.57 0.18 2.96 0.13 -0.67 118.68 118.92 3nam s LEU 600 Ca 0.36 -0.23 -0.07 0.00 -0.22 0.00 0.00 54.13 53.97 3nam s LEU 600 Cb 0.01 -0.66 0.15 0.00 0.50 0.00 0.00 46.19 46.19 3nam s LEU 600 CO 0.20 0.14 0.43 -0.62 -1.32 0.00 0.00 176.35 175.18 3nam s ASP 601 N -0.16 5.68 0.21 3.68 -1.08 -1.26 -2.18 116.67 121.55 3nam s ASP 601 Ca 0.02 -2.36 -0.32 0.00 -0.52 0.00 0.00 52.55 49.38 3nam s ASP 601 Cb -0.06 -1.97 -0.12 0.00 -1.46 0.00 0.00 42.92 39.31 3nam s ASP 601 CO -0.00 -0.55 1.69 -2.16 0.52 0.00 0.00 175.17 174.66 3nam s PRO 602 N 0.68 4.14 0.13 4.34 0.04 -1.26 -4.66 135.00 138.41 3nam s PRO 602 Ca 0.12 2.56 -0.30 0.00 0.04 0.00 0.00 61.00 63.42 3nam s PRO 602 Cb -0.21 -3.08 -0.06 0.00 0.04 0.00 0.00 34.50 31.18 3nam s PRO 602 CO -0.03 -0.72 1.04 -1.25 0.04 0.00 0.00 177.00 176.08 3nam s PRO 603 N 1.04 4.63 0.09 0.56 0.04 -1.26 -0.01 135.00 140.08 3nam s PRO 603 Ca 0.73 1.59 -0.36 0.00 0.04 0.00 0.00 61.00 63.00 3nam s PRO 603 Cb -0.49 -3.34 -0.18 0.00 0.04 0.00 0.00 34.50 30.54 3nam s PRO 603 CO 0.33 0.10 1.14 0.54 0.04 0.00 0.00 177.00 179.15 3nam n ARG 604 N 2.77 0.68 0.14 4.56 1.74 -0.98 -4.80 116.66 120.78 3nam n ARG 604 Ca 0.03 0.24 -0.14 0.00 -0.77 0.00 0.00 57.85 57.22 3nam n ARG 604 Cb 0.48 -1.75 -0.06 0.00 -1.02 0.00 0.00 32.46 30.11 3nam n ARG 604 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 3nam h LYS 605 N 3.44 -0.52 0.00 5.56 2.10 -1.92 -2.25 116.57 122.98 3nam h LYS 605 Ca -0.46 0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.23 3nam h LYS 605 Cb 1.38 0.12 0.00 0.00 -0.90 0.00 0.00 32.23 32.83 3nam h LYS 605 CO 0.70 -0.35 0.00 0.39 -2.00 0.00 0.00 179.45 178.19 3nam n GLU 606 N -5.40 0.00 -0.01 0.07 4.71 -1.26 -1.99 120.64 116.76 3nam n GLU 606 Ca -0.07 0.44 -0.10 0.00 -0.01 0.00 0.00 57.16 57.42 3nam n GLU 606 Cb 0.31 -1.50 0.04 0.00 -1.01 0.00 0.00 31.44 29.28 3nam n GLU 606 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 3nam h VAL 607 N 0.00 1.31 0.00 2.62 2.07 -1.75 -2.34 116.25 118.16 3nam h VAL 607 Ca 0.00 -1.79 -0.03 0.00 0.82 0.00 0.00 66.70 65.70 3nam h VAL 607 Cb 0.01 1.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 3nam h VAL 607 CO 0.00 0.56 -0.13 0.24 0.02 0.00 0.00 177.57 178.26 3nam h MET 608 N 0.46 0.00 0.15 1.57 2.86 -1.53 -1.66 114.93 116.78 3nam h MET 608 Ca 0.01 0.00 -0.33 0.00 -2.06 0.00 0.00 59.70 57.31 3nam h MET 608 Cb 1.11 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.77 3nam h MET 608 CO 0.11 0.13 -1.69 0.78 1.06 0.00 0.00 176.91 177.30 3nam h GLY 609 N 0.77 0.36 1.01 8.32 0.00 -1.68 -3.31 103.07 108.54 3nam h GLY 609 Ca -0.00 -0.93 0.00 0.00 0.00 0.00 0.00 47.33 46.41 3nam h GLY 609 CO 0.02 0.81 0.55 1.76 0.00 0.00 0.00 176.54 179.68 3nam h SER 610 N 0.09 1.00 -0.82 0.19 0.02 -0.96 -0.96 113.55 112.10 3nam h SER 610 Ca -0.31 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.59 3nam h SER 610 Cb 2.06 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 64.31 3nam h SER 610 CO 0.16 0.74 0.46 0.40 -1.14 0.00 0.00 176.83 177.45 3nam h ILE 611 N 1.17 1.24 -0.64 3.27 1.08 -1.47 -2.68 117.51 119.48 3nam h ILE 611 Ca 0.31 -0.58 -0.02 0.00 -0.39 0.00 0.00 64.86 64.18 3nam h ILE 611 Cb -0.11 0.12 -0.03 0.00 -3.07 0.00 0.00 36.82 33.74 3nam h ILE 611 CO -0.06 0.26 0.33 -0.61 -0.69 0.00 0.00 178.15 177.38 3nam h GLN 612 N 1.14 0.90 -0.58 2.37 5.75 -1.28 -2.52 115.11 120.88 3nam h GLN 612 Ca 0.29 -0.12 0.02 0.00 -0.15 0.00 0.00 58.65 58.69 3nam h GLN 612 Cb 0.01 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.36 3nam h GLN 612 CO -0.05 0.70 0.39 -0.07 -2.65 0.00 0.00 178.83 177.15 3nam h LEU 613 N 0.87 0.64 -0.97 -2.39 3.38 -1.14 -1.21 115.31 114.49 3nam h LEU 613 Ca 0.22 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.07 3nam h LEU 613 Cb 0.07 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3nam h LEU 613 CO -0.03 0.46 -0.44 0.00 0.09 0.00 0.00 178.44 178.52 3nam h ARG 615 N 0.13 0.52 -0.49 0.00 2.43 -0.84 0.13 114.38 116.26 3nam h ARG 615 Ca 0.01 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 58.95 3nam h ARG 615 Cb 0.83 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 3nam h ARG 615 CO 0.06 0.54 -0.17 -0.44 -1.51 0.00 0.00 179.97 178.46 3nam h ASP 616 N 0.39 1.00 0.29 -3.80 3.32 -0.95 -2.44 116.42 114.23 3nam h ASP 616 Ca 0.11 -0.38 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3nam h ASP 616 Cb 0.24 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.51 3nam h ASP 616 CO -0.00 1.15 0.00 0.00 -1.72 0.00 0.00 179.24 178.67 3nam n ALA 617 N -2.50 2.25 -1.45 3.45 0.00 0.96 -4.13 120.51 119.08 3nam n ALA 617 Ca 0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 53.44 53.25 3nam n ALA 617 Cb 0.43 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.48 3nam n ALA 617 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3nam n GLY 618 N 0.61 0.70 3.77 0.00 0.00 -0.47 -3.39 105.19 106.41 3nam n GLY 618 Ca 0.13 -0.70 -0.36 0.00 0.00 0.00 0.00 46.02 45.09 3nam n GLY 618 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3nam s ILE 619 N -2.28 5.38 -0.05 -0.61 1.01 0.33 -4.61 121.20 120.37 3nam s ILE 619 Ca 0.00 0.33 -0.22 0.00 0.00 0.00 0.00 60.65 60.76 3nam s ILE 619 Cb 0.00 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 3nam s ILE 619 CO 0.00 0.48 0.65 -0.60 0.00 0.00 0.00 174.94 175.47 3nam s ARG 620 N -0.06 4.40 -0.20 2.79 3.52 0.25 -4.35 118.95 125.30 3nam s ARG 620 Ca 0.13 0.81 -0.03 0.00 -0.13 0.00 0.00 55.73 56.50 3nam s ARG 620 Cb -0.12 -3.41 -0.01 0.00 -1.56 0.00 0.00 34.95 29.84 3nam s ARG 620 CO 0.02 0.18 -0.05 0.08 -0.81 0.00 0.00 175.30 174.72 3nam s VAL 621 N 0.44 3.48 -0.19 7.11 1.01 -1.26 -0.27 120.40 130.72 3nam s VAL 621 Ca 0.35 -0.47 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 3nam s VAL 621 Cb -0.18 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 3nam s VAL 621 CO 0.17 0.45 0.00 -0.63 0.00 0.00 0.00 175.10 175.09 3nam s ILE 622 N 1.11 4.08 -0.16 2.22 1.01 -0.25 -4.77 121.20 124.43 3nam s ILE 622 Ca 0.01 -0.28 -0.16 0.00 0.00 0.00 0.00 60.65 60.23 3nam s ILE 622 Cb -0.15 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 3nam s ILE 622 CO -0.00 0.44 0.40 -0.32 0.00 0.00 0.00 174.94 175.46 3nam s MET 623 N 0.81 4.25 -0.29 2.79 -2.45 -1.02 -1.47 119.30 121.92 3nam s MET 623 Ca 0.01 0.26 0.01 0.00 -1.25 0.00 0.00 55.69 54.71 3nam s MET 623 Cb -0.14 -3.47 0.06 0.00 1.25 0.00 0.00 34.83 32.52 3nam s MET 623 CO 0.02 0.10 -0.04 0.42 1.05 0.00 0.00 175.02 176.57 3nam s ILE 624 N 0.87 2.61 0.00 10.11 1.01 -0.60 -0.35 121.20 134.84 3nam s ILE 624 Ca 0.21 -1.55 0.00 0.00 0.00 0.00 0.00 60.65 59.31 3nam s ILE 624 Cb -0.14 -2.54 0.00 0.00 0.01 0.00 0.00 42.46 39.79 3nam s ILE 624 CO 0.08 -0.10 0.00 1.07 0.00 0.00 0.00 174.94 175.98 3nam n THR 625 N 4.52 0.00 0.00 2.92 5.66 -0.99 -2.50 114.28 123.89 3nam n THR 625 Ca -0.13 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.87 3nam n THR 625 Cb 0.43 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.21 3nam n THR 625 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3nam n GLY 626 N 3.93 0.00 3.47 1.09 0.00 -1.18 -4.04 105.19 108.46 3nam n GLY 626 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 3nam n GLY 626 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3nam n ASP 627 N -1.01 -1.06 -4.40 1.61 8.00 -1.26 -4.57 116.55 113.86 3nam n ASP 627 Ca 0.00 0.72 -0.31 0.00 0.71 0.00 0.00 54.79 55.91 3nam n ASP 627 Cb 0.04 -1.18 0.19 0.00 -0.02 0.00 0.00 41.12 40.16 3nam n ASP 627 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3nam n ASN 628 N 0.41 -1.85 0.25 -2.24 0.23 -1.26 -4.35 115.26 106.45 3nam n ASN 628 Ca 0.11 -0.01 0.12 0.00 -0.53 0.00 0.00 54.58 54.27 3nam n ASN 628 Cb 0.48 -1.15 0.61 0.00 -2.08 0.00 0.00 39.78 37.64 3nam n ASN 628 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 3nam h LYS 629 N -2.18 0.00 -0.52 -3.83 3.64 -1.93 -2.22 116.57 109.52 3nam h LYS 629 Ca -0.54 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 58.78 3nam h LYS 629 Cb 1.33 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.13 3nam h LYS 629 CO 0.42 0.17 0.08 0.78 -2.27 0.00 0.00 179.45 178.63 3nam h GLY 630 N 1.40 0.94 0.44 5.01 0.00 -1.96 -2.44 103.07 106.46 3nam h GLY 630 Ca -0.00 -0.63 -0.07 0.00 0.00 0.00 0.00 47.33 46.63 3nam h GLY 630 CO 0.02 0.58 -1.67 -1.30 0.00 0.00 0.00 176.54 174.18 3nam n THR 631 N -4.38 0.53 -0.01 4.70 -2.24 -1.23 -3.26 114.28 108.40 3nam n THR 631 Ca 0.02 -0.59 -0.10 0.00 -2.27 0.00 0.00 64.05 61.11 3nam n THR 631 Cb 0.26 -0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 3nam n THR 631 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3nam h ALA 632 N 1.79 0.10 -0.21 6.98 0.00 -1.41 0.32 119.26 126.84 3nam h ALA 632 Ca -0.09 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.86 3nam h ALA 632 Cb 1.24 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 3nam h ALA 632 CO 0.01 -0.44 0.08 0.82 0.00 0.00 0.00 179.25 179.71 3nam h ILE 633 N 0.06 0.96 -0.99 0.00 2.04 -1.56 -2.54 117.51 115.47 3nam h ILE 633 Ca 0.05 -0.06 0.15 0.00 1.00 0.00 0.00 64.86 66.00 3nam h ILE 633 Cb 0.05 0.76 -0.09 0.00 -0.74 0.00 0.00 36.82 36.80 3nam h ILE 633 CO -0.07 0.03 0.62 0.00 0.00 0.00 0.00 178.15 178.73 3nam h ALA 634 N 1.13 1.63 -0.20 1.87 0.00 -1.42 -0.20 119.26 122.07 3nam h ALA 634 Ca 0.09 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 3nam h ALA 634 Cb 0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3nam h ALA 634 CO -0.09 0.07 -0.26 0.82 0.00 0.00 0.00 179.25 179.80 3nam h ILE 635 N 0.86 1.26 -0.47 0.00 2.04 -0.53 -1.53 117.51 119.14 3nam h ILE 635 Ca 0.52 -1.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 3nam h ILE 635 Cb 0.69 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 3nam h ILE 635 CO -0.30 0.38 0.09 0.00 0.00 0.00 0.00 178.15 178.33 3nam h ARG 637 N 0.65 0.33 -0.12 0.00 3.08 -0.94 0.27 114.38 117.64 3nam h ARG 637 Ca 0.15 -0.11 -0.16 0.00 0.07 0.00 0.00 59.98 59.93 3nam h ARG 637 Cb 0.37 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 3nam h ARG 637 CO 0.01 0.54 -0.61 -0.09 -1.07 0.00 0.00 179.97 178.75 3nam h ARG 638 N 0.30 0.43 0.00 0.04 2.43 -0.98 -3.29 114.38 113.30 3nam h ARG 638 Ca 0.05 -0.30 -0.16 0.00 -0.81 0.00 0.00 59.98 58.76 3nam h ARG 638 Cb 0.57 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 3nam h ARG 638 CO 0.04 0.91 -1.57 0.44 -1.51 0.00 0.00 179.97 178.28 3nam n ILE 639 N -3.91 1.03 0.00 1.20 -5.35 -0.72 -4.99 119.36 106.62 3nam n ILE 639 Ca -0.03 -0.68 0.00 0.00 -0.27 0.00 0.00 62.75 61.77 3nam n ILE 639 Cb 0.63 -0.59 0.00 0.00 -1.74 0.00 0.00 39.64 37.95 3nam n ILE 639 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3nam n GLY 640 N 1.41 1.14 0.29 3.28 0.00 0.80 -4.72 105.19 107.39 3nam n GLY 640 Ca -0.11 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.95 3nam n GLY 640 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3nam h ILE 641 N 0.00 1.09 -3.34 -0.61 2.04 -1.49 -3.43 117.51 111.78 3nam h ILE 641 Ca 0.00 -0.23 -0.47 0.00 1.00 0.00 0.00 64.86 65.16 3nam h ILE 641 Cb 0.00 0.72 -0.17 0.00 -0.74 0.00 0.00 36.82 36.63 3nam h ILE 641 CO 0.00 0.10 -0.77 -0.36 0.00 0.00 0.00 178.15 177.12 3nam s PHE 642 N -5.28 1.65 0.32 1.37 0.08 -1.06 -4.96 117.98 110.09 3nam s PHE 642 Ca -0.07 -0.52 -0.22 0.00 0.12 0.00 0.00 56.93 56.24 3nam s PHE 642 Cb 0.17 -0.83 -0.10 0.00 -0.57 0.00 0.00 43.02 41.70 3nam s PHE 642 CO 0.72 0.26 0.87 0.20 -0.10 0.00 0.00 175.22 177.17 3nam s GLY 643 N -2.70 2.63 0.24 4.36 0.00 -1.26 -4.04 107.32 106.54 3nam s GLY 643 Ca 0.14 0.36 -0.08 0.00 0.00 0.00 0.00 44.72 45.15 3nam s GLY 643 CO 0.05 0.72 1.65 0.83 0.00 0.00 0.00 173.10 176.36 3nam h GLU 644 N 2.90 0.13 -0.01 2.90 5.08 -1.96 -0.39 114.58 123.22 3nam h GLU 644 Ca -0.48 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 3nam h GLU 644 Cb 1.19 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3nam h GLU 644 CO 0.64 0.09 -0.64 0.09 -1.00 0.00 0.00 179.01 178.19 3nam n ASN 645 N -5.29 1.22 -4.70 1.42 3.02 -1.26 -4.99 115.26 104.67 3nam n ASN 645 Ca 0.12 -1.00 -0.42 0.00 -0.03 0.00 0.00 54.58 53.25 3nam n ASN 645 Cb 0.44 0.57 -0.01 0.00 -0.61 0.00 0.00 39.78 40.18 3nam n ASN 645 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 3nam n GLU 646 N -0.93 2.16 -2.48 3.52 2.13 -0.16 -4.97 120.64 119.91 3nam n GLU 646 Ca 0.07 0.76 -0.36 0.00 0.66 0.00 0.00 57.16 58.29 3nam n GLU 646 Cb 0.37 -2.35 -0.03 0.00 0.27 0.00 0.00 31.44 29.70 3nam n GLU 646 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 3nam s GLU 647 N -1.87 4.03 -0.01 5.31 2.56 -1.26 -4.70 118.70 122.75 3nam s GLU 647 Ca 0.55 1.55 0.02 0.00 0.00 0.00 0.00 54.97 57.09 3nam s GLU 647 Cb -0.56 -2.45 0.03 0.00 2.00 0.00 0.00 34.13 33.14 3nam s GLU 647 CO 0.62 -0.27 0.84 0.28 -0.56 0.00 0.00 175.26 176.17 3nam n VAL 648 N -0.28 0.25 -0.01 3.70 0.31 -1.26 -4.88 118.33 116.15 3nam n VAL 648 Ca 0.06 -0.29 -0.09 0.00 -0.01 0.00 0.00 64.34 64.01 3nam n VAL 648 Cb 0.50 0.60 -0.03 0.00 -0.91 0.00 0.00 33.84 34.00 3nam n VAL 648 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3nam h ALA 649 N 0.00 -0.21 -0.63 3.52 0.00 -1.93 -2.76 119.26 117.24 3nam h ALA 649 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3nam h ALA 649 Cb 1.16 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.45 3nam h ALA 649 CO 0.00 -0.71 0.00 -0.25 0.00 0.00 0.00 179.25 178.29 3nam n ASP 650 N -5.38 4.34 -0.10 0.00 8.00 -1.26 -4.24 116.55 117.92 3nam n ASP 650 Ca -0.02 -2.33 0.01 0.00 0.71 0.00 0.00 54.79 53.16 3nam n ASP 650 Cb 0.29 -0.54 0.02 0.00 -0.02 0.00 0.00 41.12 40.87 3nam n ASP 650 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3nam n ARG 651 N 1.16 2.09 -3.48 -1.24 1.74 -1.05 -4.43 116.66 111.46 3nam n ARG 651 Ca 0.24 -1.36 -0.17 0.00 -0.77 0.00 0.00 57.85 55.79 3nam n ARG 651 Cb 0.79 -1.04 -0.12 0.00 -1.02 0.00 0.00 32.46 31.06 3nam n ARG 651 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3nam s ALA 652 N -0.80 -0.35 0.38 7.54 0.00 -1.17 -0.73 121.76 126.62 3nam s ALA 652 Ca 0.04 0.31 0.08 0.00 0.00 0.00 0.00 51.96 52.39 3nam s ALA 652 Cb 0.02 -1.37 -0.05 0.00 0.00 0.00 0.00 23.12 21.72 3nam s ALA 652 CO 0.03 -1.22 0.09 0.71 0.00 0.00 0.00 175.76 175.37 3nam s TYR 653 N 2.35 2.59 0.30 0.00 2.02 -1.04 -4.94 117.35 118.62 3nam s TYR 653 Ca 0.08 -0.51 0.09 0.00 -0.37 0.00 0.00 57.07 56.35 3nam s TYR 653 Cb -0.16 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.64 3nam s TYR 653 CO -0.13 0.34 0.07 -0.08 -1.57 0.00 0.00 175.55 174.19 3nam s THR 654 N -2.56 3.35 0.40 -0.71 -1.32 -1.26 -0.41 115.64 113.12 3nam s THR 654 Ca 0.38 -1.78 0.11 0.00 -1.21 0.00 0.00 61.69 59.19 3nam s THR 654 Cb 0.02 -2.95 0.33 0.00 -1.51 0.00 0.00 72.50 68.39 3nam s THR 654 CO 0.21 -0.29 1.93 1.23 -2.21 0.00 0.00 174.62 175.49 3nam h GLY 655 N 1.71 0.85 0.53 6.08 0.00 -1.62 -2.19 103.07 108.44 3nam h GLY 655 Ca -0.44 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 46.60 3nam h GLY 655 CO 0.62 0.12 -0.18 -0.09 0.00 0.00 0.00 176.54 177.01 3nam h ARG 656 N 0.56 0.19 -0.52 4.80 9.65 -1.96 -2.79 114.38 124.32 3nam h ARG 656 Ca 0.35 -0.15 0.02 0.00 -1.10 0.00 0.00 59.98 59.09 3nam h ARG 656 Cb 0.59 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.18 3nam h ARG 656 CO -0.12 0.80 0.35 0.93 2.80 0.00 0.00 179.97 184.73 3nam h GLU 657 N -0.38 0.65 -0.36 0.20 5.08 -1.90 -1.48 114.58 116.40 3nam h GLU 657 Ca -0.01 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.19 3nam h GLU 657 Cb 0.83 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 3nam h GLU 657 CO 0.04 0.43 -0.26 0.35 -1.00 0.00 0.00 179.01 178.57 3nam h PHE 658 N 0.67 0.95 -0.53 4.33 3.57 -1.45 -3.08 116.94 121.40 3nam h PHE 658 Ca 0.20 -0.26 -0.11 0.00 3.53 0.00 0.00 57.97 61.33 3nam h PHE 658 Cb -0.01 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.50 3nam h PHE 658 CO -0.00 1.03 -0.10 -0.44 -2.23 0.00 0.00 178.31 176.57 3nam h ASP 659 N 0.59 0.99 0.16 0.41 3.32 -1.11 -2.61 116.42 118.18 3nam h ASP 659 Ca 0.07 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 56.80 3nam h ASP 659 Cb 0.83 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.11 3nam h ASP 659 CO 0.07 1.09 0.00 0.47 -1.72 0.00 0.00 179.24 179.15 3nam n ASP 660 N -4.15 0.00 -4.86 6.45 8.00 -0.62 -4.71 116.55 116.66 3nam n ASP 660 Ca 0.02 0.14 -0.33 0.00 0.71 0.00 0.00 54.79 55.32 3nam n ASP 660 Cb 0.39 -0.27 -0.06 0.00 -0.02 0.00 0.00 41.12 41.16 3nam n ASP 660 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3nam s LEU 661 N -2.54 4.21 0.27 0.64 1.43 -0.98 -5.06 118.68 116.64 3nam s LEU 661 Ca 0.09 1.04 -0.29 0.00 -1.03 0.00 0.00 54.13 53.95 3nam s LEU 661 Cb 0.06 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.57 3nam s LEU 661 CO 0.14 -0.04 0.95 -2.16 0.23 0.00 0.00 176.35 175.47 3nam s PRO 662 N -2.56 4.74 0.39 1.29 0.04 -1.26 -4.77 135.00 132.87 3nam s PRO 662 Ca 0.45 1.46 0.22 0.00 0.04 0.00 0.00 61.00 63.17 3nam s PRO 662 Cb -0.12 -3.10 0.77 0.00 0.04 0.00 0.00 34.50 32.09 3nam s PRO 662 CO 0.20 0.40 0.91 1.28 0.04 0.00 0.00 177.00 179.83 3nam n LEU 663 N 1.12 0.00 0.00 -3.56 4.77 -1.26 -1.45 117.00 116.63 3nam n LEU 663 Ca -0.00 0.55 -0.00 0.00 -0.03 0.00 0.00 56.01 56.52 3nam n LEU 663 Cb 0.48 -0.22 -0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3nam n LEU 663 CO 0.48 -0.55 0.19 0.00 -1.33 0.00 0.00 177.39 176.18 3nam h ALA 664 N 0.44 -0.38 -0.12 -1.18 0.00 -2.00 -2.86 119.26 113.16 3nam h ALA 664 Ca 0.42 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.36 3nam h ALA 664 Cb 2.11 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.90 3nam h ALA 664 CO -0.00 -0.38 0.16 0.93 0.00 0.00 0.00 179.25 179.95 3nam h GLU 665 N -0.03 0.00 0.02 0.00 3.07 -1.63 -0.77 114.58 115.24 3nam h GLU 665 Ca -0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3nam h GLU 665 Cb 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 3nam h GLU 665 CO 0.00 0.00 -0.01 0.37 -1.40 0.00 0.00 179.01 177.97 3nam h GLN 666 N 0.00 -0.03 0.00 2.33 4.15 -1.50 0.27 115.11 120.33 3nam h GLN 666 Ca 0.06 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.42 3nam h GLN 666 Cb 0.37 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 3nam h GLN 666 CO -0.00 0.20 -0.27 -0.09 -1.93 0.00 0.00 178.83 176.74 3nam h ARG 667 N -0.26 0.00 0.00 1.69 2.43 -0.92 -2.65 114.38 114.67 3nam h ARG 667 Ca -0.00 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 3nam h ARG 667 Cb 0.24 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 3nam h ARG 667 CO 0.01 0.27 -0.98 1.49 -1.51 0.00 0.00 179.97 179.25 3nam h GLU 668 N 0.00 0.00 -0.15 0.20 4.57 -1.18 -3.21 114.58 114.81 3nam h GLU 668 Ca -0.00 -0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.08 3nam h GLU 668 Cb 0.60 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 3nam h GLU 668 CO 0.04 0.98 -0.32 0.00 -1.18 0.00 0.00 179.01 178.53 3nam h ALA 669 N 1.02 1.18 0.00 2.92 0.00 -0.59 -2.83 119.26 120.96 3nam h ALA 669 Ca -0.01 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3nam h ALA 669 Cb 1.74 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.43 3nam h ALA 669 CO 0.13 0.54 0.00 0.00 0.00 0.00 0.00 179.25 179.91 3nam n ARG 671 N -2.68 1.62 0.00 0.00 1.85 -1.07 -4.34 116.66 112.04 3nam n ARG 671 Ca 0.01 -0.97 0.00 0.00 -1.00 0.00 0.00 57.85 55.89 3nam n ARG 671 Cb 0.25 -1.48 0.00 0.00 -1.05 0.00 0.00 32.46 30.18 3nam n ARG 671 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 3nam n ARG 672 N 0.15 2.78 -1.43 2.89 1.85 -1.04 -5.10 116.66 116.76 3nam n ARG 672 Ca 0.18 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.67 3nam n ARG 672 Cb 0.37 -0.70 0.08 0.00 -1.05 0.00 0.00 32.46 31.16 3nam n ARG 672 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3nam n ALA 673 N -0.80 0.09 -1.75 2.89 0.00 0.15 -4.72 120.51 116.38 3nam n ALA 673 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3nam n ALA 673 Cb 0.08 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.36 3nam n ALA 673 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3nam s PHE 676 N 2.00 3.41 0.00 0.00 0.40 0.53 -2.49 117.98 121.82 3nam s PHE 676 Ca -0.04 -2.32 0.00 0.00 -0.60 0.00 0.00 56.93 53.96 3nam s PHE 676 Cb -0.04 -2.35 0.00 0.00 0.51 0.00 0.00 43.02 41.14 3nam s PHE 676 CO -0.16 -0.88 0.00 0.00 0.70 0.00 0.00 175.22 174.88 3nam n ALA 677 N 4.48 0.00 -3.82 5.36 0.00 0.46 -2.35 120.51 124.63 3nam n ALA 677 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.00 3nam n ALA 677 Cb 0.42 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.75 3nam n ALA 677 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3nam s ARG 678 N 0.00 1.91 0.30 0.00 0.52 -1.26 -3.07 118.95 117.35 3nam s ARG 678 Ca 0.00 -1.81 0.11 0.00 -0.52 0.00 0.00 55.73 53.51 3nam s ARG 678 Cb 0.00 -3.49 -0.06 0.00 0.52 0.00 0.00 34.95 31.92 3nam s ARG 678 CO 0.00 -1.03 -0.15 0.14 0.02 0.00 0.00 175.30 174.28 3nam s VAL 679 N 1.10 2.34 0.00 3.52 -7.23 -1.26 -1.60 120.40 117.27 3nam s VAL 679 Ca 0.08 -2.31 0.00 0.00 -1.81 0.00 0.00 61.98 57.94 3nam s VAL 679 Cb -0.22 -2.44 0.00 0.00 0.56 0.00 0.00 36.38 34.28 3nam s VAL 679 CO -0.05 -0.32 0.00 -1.84 -0.31 0.00 0.00 175.10 172.58 3nam n GLU 680 N -0.68 3.91 0.08 4.82 0.28 -1.26 -4.99 120.64 122.80 3nam n GLU 680 Ca -0.05 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.79 3nam n GLU 680 Cb 0.62 0.00 -0.09 0.00 1.43 0.00 0.00 31.44 33.40 3nam n GLU 680 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 177.13 175.97 3nam h PRO 681 N 0.00 0.44 -0.83 3.44 0.13 -2.01 -3.16 132.00 130.01 3nam h PRO 681 Ca 0.00 -0.55 0.08 0.00 -0.87 0.00 0.00 66.00 64.66 3nam h PRO 681 Cb 0.00 0.18 -0.11 0.00 0.13 0.00 0.00 31.00 31.20 3nam h PRO 681 CO 0.00 1.20 -0.57 1.03 -0.23 0.00 0.00 178.00 179.44 3nam h SER 682 N 0.21 -2.04 -0.29 1.44 0.87 -1.96 -1.94 113.55 109.84 3nam h SER 682 Ca -0.12 0.30 0.06 0.00 -1.23 0.00 0.00 61.79 60.80 3nam h SER 682 Cb 1.75 0.89 -0.06 0.00 -0.44 0.00 0.00 62.40 64.55 3nam h SER 682 CO 0.19 -0.27 -0.07 0.45 -0.53 0.00 0.00 176.83 176.60 3nam h HIS 683 N -0.10 -0.16 -0.96 2.24 3.86 -1.96 -2.44 115.15 115.64 3nam h HIS 683 Ca 0.13 0.03 0.21 0.00 -1.16 0.00 0.00 60.37 59.58 3nam h HIS 683 Cb 0.45 0.12 -0.08 0.00 1.06 0.00 0.00 27.41 28.95 3nam h HIS 683 CO -0.95 -0.13 0.62 0.87 0.86 0.00 0.00 177.93 179.20 3nam h LYS 684 N -0.00 0.49 0.02 2.45 1.57 -1.32 -1.27 116.57 118.51 3nam h LYS 684 Ca 0.14 -0.03 -0.21 0.00 -1.87 0.00 0.00 60.65 58.68 3nam h LYS 684 Cb 0.21 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3nam h LYS 684 CO -0.30 0.32 -0.95 0.77 -0.57 0.00 0.00 179.45 178.73 3nam h SER 685 N 0.51 0.17 -0.09 0.86 0.02 -1.19 -3.10 113.55 110.72 3nam h SER 685 Ca 0.52 -0.15 -0.06 0.00 -0.84 0.00 0.00 61.79 61.26 3nam h SER 685 Cb 1.16 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.65 3nam h SER 685 CO -0.25 1.02 -0.18 0.11 -1.14 0.00 0.00 176.83 176.39 3nam h LYS 686 N 0.06 0.28 -0.31 3.45 1.57 -1.02 -2.93 116.57 117.67 3nam h LYS 686 Ca -0.04 -0.18 0.04 0.00 -1.87 0.00 0.00 60.65 58.60 3nam h LYS 686 Cb 1.62 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.94 3nam h LYS 686 CO 0.14 0.77 0.21 0.82 -0.57 0.00 0.00 179.45 180.82 3nam h ILE 687 N -0.18 0.97 -0.29 1.86 2.04 -1.37 -0.92 117.51 119.61 3nam h ILE 687 Ca 0.00 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 3nam h ILE 687 Cb 0.77 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 3nam h ILE 687 CO 0.04 0.04 0.01 0.58 0.00 0.00 0.00 178.15 178.82 3nam h VAL 688 N 0.24 1.25 -0.65 1.67 2.07 -1.47 -0.52 116.25 118.84 3nam h VAL 688 Ca 0.13 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 3nam h VAL 688 Cb 0.24 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 3nam h VAL 688 CO -0.03 0.29 0.34 -0.33 0.02 0.00 0.00 177.57 177.87 3nam h GLU 689 N 0.31 0.90 -0.15 1.57 5.08 -1.03 0.12 114.58 121.38 3nam h GLU 689 Ca 0.08 -0.10 -0.17 0.00 -1.00 0.00 0.00 59.36 58.17 3nam h GLU 689 Cb 0.41 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.49 3nam h GLU 689 CO 0.01 0.67 -0.59 1.88 -1.00 0.00 0.00 179.01 179.98 3nam h TYR 690 N 0.91 0.88 0.00 4.33 0.05 -1.13 -1.10 116.97 120.91 3nam h TYR 690 Ca 0.23 -0.37 -0.02 0.00 0.05 0.00 0.00 58.73 58.62 3nam h TYR 690 Cb 0.04 -0.14 -0.00 0.00 1.01 0.00 0.00 36.73 37.64 3nam h TYR 690 CO 0.01 1.17 -0.10 -0.07 -1.05 0.00 0.00 178.16 178.12 3nam h LEU 691 N 0.33 0.00 0.00 3.88 3.38 -0.70 -2.01 115.31 120.20 3nam h LEU 691 Ca -0.03 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.74 3nam h LEU 691 Cb 1.22 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 3nam h LEU 691 CO 0.12 0.10 -1.08 1.56 0.09 0.00 0.00 178.44 179.24 3nam h GLN 692 N 0.00 0.00 0.00 1.13 4.20 -0.49 -2.55 115.11 117.40 3nam h GLN 692 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3nam h GLN 692 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 3nam h GLN 692 CO 0.01 0.73 0.00 -1.13 -0.67 0.00 0.00 178.83 177.78 3nam n SER 693 N -3.22 0.54 -1.53 1.46 3.41 -0.44 -1.09 113.62 112.75 3nam n SER 693 Ca -0.04 0.64 0.05 0.00 -0.26 0.00 0.00 58.87 59.26 3nam n SER 693 Cb 0.91 -0.75 0.33 0.00 -0.26 0.00 0.00 64.21 64.44 3nam n SER 693 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3nam n TYR 694 N -2.10 1.71 -4.01 7.33 4.01 -1.19 -4.94 117.16 117.96 3nam n TYR 694 Ca 0.02 -0.89 -0.27 0.00 -0.16 0.00 0.00 57.90 56.61 3nam n TYR 694 Cb 0.21 -0.47 -0.03 0.00 -0.31 0.00 0.00 39.34 38.74 3nam n TYR 694 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3nam n ASP 695 N 0.03 -0.33 -4.84 7.72 8.00 -0.25 -4.98 116.55 121.90 3nam n ASP 695 Ca 0.28 -1.04 -0.33 0.00 0.71 0.00 0.00 54.79 54.41 3nam n ASP 695 Cb 1.12 -2.87 -0.06 0.00 -0.02 0.00 0.00 41.12 39.29 3nam n ASP 695 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3nam s GLU 696 N -6.67 3.22 -0.46 -1.24 2.02 -0.96 -5.04 118.70 109.56 3nam s GLU 696 Ca 0.05 -0.44 -0.18 0.00 0.02 0.00 0.00 54.97 54.42 3nam s GLU 696 Cb -0.02 -2.95 0.04 0.00 0.10 0.00 0.00 34.13 31.30 3nam s GLU 696 CO 0.90 0.65 0.52 0.42 0.02 0.00 0.00 175.26 177.77 3nam s ILE 697 N -1.29 5.01 -0.00 -1.63 -1.09 -1.26 -4.55 121.20 116.39 3nam s ILE 697 Ca 0.26 -0.48 0.04 0.00 -2.23 0.00 0.00 60.65 58.24 3nam s ILE 697 Cb -0.12 -4.16 -0.03 0.00 -1.58 0.00 0.00 42.46 36.56 3nam s ILE 697 CO 0.18 -0.60 -0.10 0.28 -1.23 0.00 0.00 174.94 173.47 3nam s THR 698 N 2.29 3.43 -0.05 2.92 -1.32 -1.26 -1.38 115.64 120.28 3nam s THR 698 Ca 0.13 -0.81 -0.01 0.00 -1.21 0.00 0.00 61.69 59.79 3nam s THR 698 Cb -0.19 -2.46 -0.04 0.00 -1.51 0.00 0.00 72.50 68.31 3nam s THR 698 CO 0.12 0.43 0.05 0.00 -2.21 0.00 0.00 174.62 173.01 3nam s ALA 699 N -0.93 3.46 -0.01 11.08 0.00 -0.25 -2.54 121.76 132.57 3nam s ALA 699 Ca 0.15 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.29 3nam s ALA 699 Cb -0.11 -1.55 0.01 0.00 0.00 0.00 0.00 23.12 21.46 3nam s ALA 699 CO 0.06 0.64 0.00 1.41 0.00 0.00 0.00 175.76 177.87 3nam s MET 700 N -1.30 0.03 0.10 0.00 0.00 -0.95 -1.44 119.30 115.75 3nam s MET 700 Ca 0.18 0.04 0.03 0.00 0.00 0.00 0.00 55.69 55.94 3nam s MET 700 Cb -0.12 -0.11 -0.04 0.00 0.00 0.00 0.00 34.83 34.56 3nam s MET 700 CO 0.08 -0.04 0.09 0.95 0.00 0.00 0.00 175.02 176.09 3nam s THR 701 N 0.29 4.50 0.15 10.11 -4.23 -1.06 0.44 115.64 125.84 3nam s THR 701 Ca -0.02 -0.84 -0.24 0.00 -1.18 0.00 0.00 61.69 59.40 3nam s THR 701 Cb -0.04 -3.19 0.07 0.00 1.34 0.00 0.00 72.50 70.69 3nam s THR 701 CO -0.01 0.08 1.03 -0.83 -0.54 0.00 0.00 174.62 174.35 3nam s GLY 702 N -2.52 -0.12 0.00 3.99 0.00 -1.07 -4.75 107.32 102.85 3nam s GLY 702 Ca 0.29 0.01 0.00 0.00 0.00 0.00 0.00 44.72 45.02 3nam s GLY 702 CO 0.22 0.93 0.00 2.09 0.00 0.00 0.00 173.10 176.34 3nam n ASP 703 N -0.76 0.00 -4.87 1.64 5.68 -1.26 -2.24 116.55 114.74 3nam n ASP 703 Ca -0.05 0.00 -0.29 0.00 -0.50 0.00 0.00 54.79 53.95 3nam n ASP 703 Cb 0.60 0.00 0.10 0.00 -1.14 0.00 0.00 41.12 40.69 3nam n ASP 703 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3nam s GLY 704 N -1.46 1.59 0.48 6.12 0.00 -1.26 -1.57 107.32 111.22 3nam s GLY 704 Ca 0.00 -0.61 0.29 0.00 0.00 0.00 0.00 44.72 44.40 3nam s GLY 704 CO 0.00 -0.10 1.83 -0.24 0.00 0.00 0.00 173.10 174.59 3nam h VAL 705 N -1.18 0.00 0.00 1.40 3.04 -1.54 -2.13 116.25 115.84 3nam h VAL 705 Ca -0.47 -0.66 0.00 0.00 -1.01 0.00 0.00 66.70 64.56 3nam h VAL 705 Cb 1.33 1.64 0.00 0.00 -2.01 0.00 0.00 31.29 32.25 3nam h VAL 705 CO 0.65 0.00 0.00 -0.55 -1.01 0.00 0.00 177.57 176.66 3nam h ASN 706 N 0.00 0.00 0.62 3.17 7.08 -1.85 -2.89 115.58 121.71 3nam h ASN 706 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 3nam h ASN 706 Cb 0.68 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.92 3nam h ASN 706 CO 0.00 0.00 -0.57 0.47 -2.08 0.00 0.00 177.43 175.25 3nam n ASP 707 N -2.32 0.55 0.10 6.14 8.00 -0.80 -4.44 116.55 123.78 3nam n ASP 707 Ca 0.05 -0.11 -0.13 0.00 0.71 0.00 0.00 54.79 55.30 3nam n ASP 707 Cb 0.39 0.24 -0.06 0.00 -0.02 0.00 0.00 41.12 41.67 3nam n ASP 707 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3nam h ALA 708 N 2.81 -0.59 -0.54 2.24 0.00 -1.51 -1.15 119.26 120.53 3nam h ALA 708 Ca 0.00 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.94 3nam h ALA 708 Cb 0.59 0.59 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 3nam h ALA 708 CO 0.00 -0.89 0.36 -1.00 0.00 0.00 0.00 179.25 177.72 3nam h PRO 709 N -0.56 0.39 0.01 0.00 0.13 -1.79 -0.83 132.00 129.35 3nam h PRO 709 Ca 0.04 -0.02 -0.23 0.00 -0.87 0.00 0.00 66.00 64.91 3nam h PRO 709 Cb 0.61 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.65 3nam h PRO 709 CO -0.23 0.26 -0.96 0.00 -0.23 0.00 0.00 178.00 176.85 3nam h ALA 710 N 1.72 0.35 -0.09 -0.56 0.00 -1.73 -2.20 119.26 116.74 3nam h ALA 710 Ca 0.24 -0.72 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 3nam h ALA 710 Cb 0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3nam h ALA 710 CO -0.06 0.82 -0.43 -0.07 0.00 0.00 0.00 179.25 179.51 3nam h LEU 711 N 0.23 0.22 -0.31 0.00 3.38 -0.64 -1.53 115.31 116.65 3nam h LEU 711 Ca -0.08 -0.09 -0.20 0.00 0.09 0.00 0.00 57.88 57.59 3nam h LEU 711 Cb 1.60 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.29 3nam h LEU 711 CO 0.17 0.63 -0.75 0.50 0.09 0.00 0.00 178.44 179.07 3nam h LYS 712 N 0.17 0.55 -0.07 1.13 3.64 -1.16 -3.28 116.57 117.56 3nam h LYS 712 Ca 0.01 -0.45 -0.17 0.00 -1.27 0.00 0.00 60.65 58.78 3nam h LYS 712 Cb 0.83 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 3nam h LYS 712 CO 0.06 1.07 -0.69 -0.22 -2.27 0.00 0.00 179.45 177.41 3nam h LYS 713 N 0.37 0.32 -7.13 1.90 3.64 -0.99 -3.44 116.57 111.23 3nam h LYS 713 Ca -0.04 -0.25 -0.52 0.00 -1.27 0.00 0.00 60.65 58.58 3nam h LYS 713 Cb 1.35 0.05 0.10 0.00 -0.41 0.00 0.00 32.23 33.32 3nam h LYS 713 CO 0.14 0.89 0.43 0.00 -2.27 0.00 0.00 179.45 178.63 3nam s ALA 714 N -3.63 2.53 0.21 5.00 0.00 -0.61 -4.92 121.76 120.34 3nam s ALA 714 Ca -0.05 0.83 -0.09 0.00 0.00 0.00 0.00 51.96 52.66 3nam s ALA 714 Cb 0.11 -3.39 0.28 0.00 0.00 0.00 0.00 23.12 20.12 3nam s ALA 714 CO 0.82 -1.14 1.78 0.93 0.00 0.00 0.00 175.76 178.16 3nam h GLU 715 N 0.66 0.57 -3.52 0.00 3.07 -1.79 -3.38 114.58 110.20 3nam h GLU 715 Ca -0.49 -0.03 -0.55 0.00 -0.50 0.00 0.00 59.36 57.78 3nam h GLU 715 Cb 1.27 -0.13 -0.40 0.00 -0.84 0.00 0.00 28.75 28.66 3nam h GLU 715 CO 0.55 0.38 -0.76 0.42 -1.40 0.00 0.00 179.01 178.19 3nam s ILE 716 N -6.08 0.66 -0.10 3.13 1.09 -1.05 -4.97 121.20 113.88 3nam s ILE 716 Ca -0.13 -0.95 -0.23 0.00 -1.10 0.00 0.00 60.65 58.25 3nam s ILE 716 Cb 0.17 -1.32 -0.03 0.00 -1.06 0.00 0.00 42.46 40.21 3nam s ILE 716 CO 0.76 -0.44 0.68 -0.83 -0.10 0.00 0.00 174.94 175.00 3nam s GLY 717 N 1.76 2.49 -0.40 6.18 0.00 -1.24 -2.24 107.32 113.87 3nam s GLY 717 Ca 0.04 0.04 -0.06 0.00 0.00 0.00 0.00 44.72 44.74 3nam s GLY 717 CO -0.18 1.19 0.21 -0.42 0.00 0.00 0.00 173.10 173.91 3nam s ILE 718 N 1.02 3.76 0.43 0.90 1.01 0.17 -1.63 121.20 126.86 3nam s ILE 718 Ca 0.35 -1.63 -0.12 0.00 0.00 0.00 0.00 60.65 59.25 3nam s ILE 718 Cb -0.17 -3.38 -0.07 0.00 0.01 0.00 0.00 42.46 38.85 3nam s ILE 718 CO 0.16 -0.53 0.82 0.00 0.00 0.00 0.00 174.94 175.38 3nam s ALA 719 N 1.31 3.29 0.10 9.38 0.00 -0.70 -2.59 121.76 132.54 3nam s ALA 719 Ca 0.04 -0.12 -0.27 0.00 0.00 0.00 0.00 51.96 51.61 3nam s ALA 719 Cb -0.23 -2.80 -0.06 0.00 0.00 0.00 0.00 23.12 20.03 3nam s ALA 719 CO -0.01 -0.07 0.84 -1.64 0.00 0.00 0.00 175.76 174.88 3nam s MET 720 N -3.91 4.59 0.06 0.00 1.00 -0.95 -1.04 119.30 119.05 3nam s MET 720 Ca 0.53 1.22 0.11 0.00 0.00 0.00 0.00 55.69 57.55 3nam s MET 720 Cb -0.10 -3.34 0.51 0.00 0.00 0.00 0.00 34.83 31.89 3nam s MET 720 CO 0.32 0.33 1.36 0.41 0.00 0.00 0.00 175.02 177.43 3nam n GLY 721 N 2.14 -0.85 0.27 -0.03 0.00 0.31 -1.05 105.19 105.98 3nam n GLY 721 Ca -0.02 0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.08 3nam n GLY 721 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3nam n SER 722 N -1.67 1.34 -3.90 1.61 3.41 -1.26 -4.98 113.62 108.17 3nam n SER 722 Ca 0.02 -1.17 -0.29 0.00 -0.26 0.00 0.00 58.87 57.17 3nam n SER 722 Cb 0.11 0.52 0.20 0.00 -0.26 0.00 0.00 64.21 64.78 3nam n SER 722 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3nam n GLY 723 N 1.05 -1.43 3.44 5.00 0.00 -0.22 -5.04 105.19 108.00 3nam n GLY 723 Ca 0.05 -1.72 -0.31 0.00 0.00 0.00 0.00 46.02 44.04 3nam n GLY 723 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3nam n THR 724 N -3.78 0.00 0.52 2.61 -2.24 -0.61 -4.91 114.28 105.87 3nam n THR 724 Ca 0.16 -0.29 0.12 0.00 -2.27 0.00 0.00 64.05 61.78 3nam n THR 724 Cb 0.57 -0.82 0.18 0.00 -2.10 0.00 0.00 70.33 68.15 3nam n THR 724 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3nam h ALA 725 N -2.20 0.63 -0.06 6.98 0.00 -1.95 -3.14 119.26 119.51 3nam h ALA 725 Ca -0.53 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.15 3nam h ALA 725 Cb 1.32 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.13 3nam h ALA 725 CO 0.42 0.00 -0.84 0.28 0.00 0.00 0.00 179.25 179.11 3nam h VAL 726 N 0.00 1.30 -0.36 0.00 2.07 -1.90 -2.68 116.25 114.69 3nam h VAL 726 Ca 0.00 -2.09 0.00 0.00 0.82 0.00 0.00 66.70 65.44 3nam h VAL 726 Cb 0.78 2.26 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 3nam h VAL 726 CO 0.00 0.64 0.24 0.00 0.02 0.00 0.00 177.57 178.47 3nam h ALA 727 N 0.45 0.46 -0.93 1.67 0.00 -1.78 -2.53 119.26 116.60 3nam h ALA 727 Ca -0.09 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.85 3nam h ALA 727 Cb 1.49 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 3nam h ALA 727 CO 0.17 -0.08 0.59 0.87 0.00 0.00 0.00 179.25 180.80 3nam h LYS 728 N 0.48 1.05 0.00 0.00 1.57 -1.56 -1.17 116.57 116.95 3nam h LYS 728 Ca 0.13 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3nam h LYS 728 Cb -0.05 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.03 3nam h LYS 728 CO -0.03 0.69 0.00 0.25 -0.57 0.00 0.00 179.45 179.80 3nam n THR 729 N -4.56 0.42 0.97 -0.16 -2.24 -0.98 -2.49 114.28 105.25 3nam n THR 729 Ca 0.14 0.08 0.12 0.00 -2.27 0.00 0.00 64.05 62.11 3nam n THR 729 Cb 0.17 -0.71 0.09 0.00 -2.10 0.00 0.00 70.33 67.78 3nam n THR 729 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3nam n ALA 730 N -1.53 2.57 -2.71 6.98 0.00 -0.49 -4.22 120.51 121.10 3nam n ALA 730 Ca 0.05 -0.68 -0.30 0.00 0.00 0.00 0.00 53.44 52.51 3nam n ALA 730 Cb 0.28 -0.79 -0.08 0.00 0.00 0.00 0.00 19.45 18.87 3nam n ALA 730 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3nam s SER 731 N -1.99 5.17 0.12 0.00 1.04 -0.94 -4.04 113.70 113.06 3nam s SER 731 Ca 0.26 -0.13 -0.07 0.00 0.48 0.00 0.00 55.95 56.49 3nam s SER 731 Cb 0.19 -1.28 -0.10 0.00 0.10 0.00 0.00 66.02 64.93 3nam s SER 731 CO 0.32 0.17 1.31 -0.33 0.98 0.00 0.00 173.24 175.69 3nam h GLU 732 N 3.39 0.54 -4.46 4.02 3.07 -1.60 -3.45 114.58 116.10 3nam h GLU 732 Ca -0.47 -0.52 -0.19 0.00 -0.50 0.00 0.00 59.36 57.68 3nam h GLU 732 Cb 1.16 0.14 -0.16 0.00 -0.84 0.00 0.00 28.75 29.05 3nam h GLU 732 CO 0.62 1.15 -0.69 1.41 -1.40 0.00 0.00 179.01 180.10 3nam s MET 733 N -3.43 0.70 -0.10 2.33 -2.45 -1.16 -0.43 119.30 114.76 3nam s MET 733 Ca -0.07 -1.21 -0.00 0.00 -1.25 0.00 0.00 55.69 53.15 3nam s MET 733 Cb 0.09 -0.04 0.02 0.00 1.25 0.00 0.00 34.83 36.15 3nam s MET 733 CO 0.88 -0.05 -0.07 0.08 1.05 0.00 0.00 175.02 176.91 3nam s VAL 734 N -3.45 0.95 -0.59 10.11 1.01 0.08 -1.73 120.40 126.77 3nam s VAL 734 Ca 0.07 -0.26 -0.28 0.00 0.00 0.00 0.00 61.98 61.51 3nam s VAL 734 Cb 0.04 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.48 3nam s VAL 734 CO -0.06 0.35 1.32 -0.76 0.00 0.00 0.00 175.10 175.95 3nam s LEU 735 N 1.54 3.38 0.40 3.92 1.43 -0.21 -1.89 118.68 127.25 3nam s LEU 735 Ca 0.01 0.12 0.12 0.00 -1.03 0.00 0.00 54.13 53.35 3nam s LEU 735 Cb -0.13 -3.02 0.94 0.00 0.03 0.00 0.00 46.19 44.01 3nam s LEU 735 CO -0.06 -1.66 1.91 0.00 0.23 0.00 0.00 176.35 176.78 3nam h ALA 736 N 10.43 1.97 -0.32 4.21 0.00 -1.81 0.11 119.26 133.85 3nam h ALA 736 Ca -0.26 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 3nam h ALA 736 Cb 1.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3nam h ALA 736 CO 1.20 -0.18 0.01 -0.40 0.00 0.00 0.00 179.25 179.88 3nam n ASP 737 N -4.50 3.86 -0.57 0.00 5.75 -1.26 -4.53 116.55 115.30 3nam n ASP 737 Ca 0.15 -3.13 -0.02 0.00 -0.01 0.00 0.00 54.79 51.77 3nam n ASP 737 Cb 0.47 -0.58 -0.01 0.00 -1.03 0.00 0.00 41.12 39.97 3nam n ASP 737 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3nam n ASP 738 N -0.52 -1.31 -4.66 -1.12 8.00 -0.81 -4.88 116.55 111.26 3nam n ASP 738 Ca 0.25 0.06 -0.41 0.00 0.71 0.00 0.00 54.79 55.40 3nam n ASP 738 Cb 0.97 -1.34 -0.05 0.00 -0.02 0.00 0.00 41.12 40.68 3nam n ASP 738 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3nam s ASN 739 N -0.93 6.78 0.46 -2.24 3.84 -1.26 -3.62 114.94 117.97 3nam s ASN 739 Ca 0.00 0.95 0.17 0.00 0.21 0.00 0.00 52.86 54.19 3nam s ASN 739 Cb 0.00 -2.38 1.14 0.00 -0.55 0.00 0.00 41.25 39.45 3nam s ASN 739 CO 0.00 -0.32 1.99 0.15 -2.79 0.00 0.00 177.10 176.13 3nam h PHE 740 N 7.44 0.30 0.00 0.43 3.57 -1.83 0.24 116.94 127.08 3nam h PHE 740 Ca -0.30 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.20 3nam h PHE 740 Cb 1.14 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.78 3nam h PHE 740 CO 0.72 0.14 0.00 0.66 -2.23 0.00 0.00 178.31 177.60 3nam h SER 741 N 0.28 0.00 0.57 0.41 4.64 -1.86 -1.60 113.55 115.99 3nam h SER 741 Ca 0.25 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.39 3nam h SER 741 Cb 0.62 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 3nam h SER 741 CO -0.06 0.00 -0.80 0.74 -0.87 0.00 0.00 176.83 175.85 3nam h THR 742 N 0.00 1.48 0.51 2.95 2.02 -0.88 -2.63 112.91 116.36 3nam h THR 742 Ca 0.00 -2.48 -0.03 0.00 0.77 0.00 0.00 66.41 64.67 3nam h THR 742 Cb 0.26 2.36 0.01 0.00 -1.74 0.00 0.00 68.15 69.03 3nam h THR 742 CO 0.00 0.72 -0.25 0.40 0.37 0.00 0.00 175.52 176.76 3nam h ILE 743 N 0.10 0.45 -0.42 3.11 2.04 -1.34 -2.29 117.51 119.17 3nam h ILE 743 Ca -0.03 -0.23 0.12 0.00 1.00 0.00 0.00 64.86 65.72 3nam h ILE 743 Cb 1.39 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 3nam h ILE 743 CO 0.12 0.04 0.32 0.58 0.00 0.00 0.00 178.15 179.20 3nam h VAL 744 N -0.84 0.72 0.00 1.67 2.07 -1.57 0.77 116.25 119.06 3nam h VAL 744 Ca -0.07 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 3nam h VAL 744 Cb 0.59 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 3nam h VAL 744 CO 0.12 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 177.70 3nam h ALA 745 N 1.76 1.00 0.00 1.67 0.00 -1.20 -2.70 119.26 119.78 3nam h ALA 745 Ca 0.20 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 3nam h ALA 745 Cb 0.83 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3nam h ALA 745 CO -0.00 0.01 -1.61 0.00 0.00 0.00 0.00 179.25 177.65 3nam n ALA 746 N -2.10 2.22 0.39 0.00 0.00 0.24 -3.34 120.51 117.92 3nam n ALA 746 Ca 0.02 -0.58 0.13 0.00 0.00 0.00 0.00 53.44 53.01 3nam n ALA 746 Cb 0.41 -0.83 0.31 0.00 0.00 0.00 0.00 19.45 19.34 3nam n ALA 746 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3nam h VAL 747 N 0.00 0.00 0.17 0.00 2.07 -0.66 -2.82 116.25 115.02 3nam h VAL 747 Ca -0.14 -0.73 -0.28 0.00 0.82 0.00 0.00 66.70 66.37 3nam h VAL 747 Cb 1.40 1.72 0.02 0.00 -1.52 0.00 0.00 31.29 32.91 3nam h VAL 747 CO 0.02 0.00 -1.32 -0.08 0.02 0.00 0.00 177.57 176.21 3nam h GLU 748 N 0.00 0.36 -0.46 1.57 4.81 -1.56 -3.19 114.58 116.12 3nam h GLU 748 Ca 0.00 -0.62 -0.05 0.00 -0.13 0.00 0.00 59.36 58.56 3nam h GLU 748 Cb 0.84 0.23 -0.02 0.00 0.63 0.00 0.00 28.75 30.43 3nam h GLU 748 CO 0.00 1.30 0.09 0.93 -0.73 0.00 0.00 179.01 180.60 3nam h GLU 749 N -0.14 0.70 -0.32 1.92 4.39 -1.60 -1.82 114.58 117.72 3nam h GLU 749 Ca -0.25 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.29 3nam h GLU 749 Cb 1.89 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 30.42 3nam h GLU 749 CO 0.16 0.65 0.11 0.78 -1.16 0.00 0.00 179.01 179.56 3nam h GLY 750 N 0.90 0.48 1.72 -3.84 0.00 -1.59 0.50 103.07 101.24 3nam h GLY 750 Ca 0.15 -0.22 -0.22 0.00 0.00 0.00 0.00 47.33 47.03 3nam h GLY 750 CO 0.00 0.21 -1.00 3.21 0.00 0.00 0.00 176.54 178.96 3nam h ARG 751 N 0.45 0.24 -0.04 4.80 3.08 -1.40 -2.57 114.38 118.93 3nam h ARG 751 Ca 0.11 -0.30 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 3nam h ARG 751 Cb 0.12 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 3nam h ARG 751 CO -0.01 1.06 -0.05 0.00 -1.07 0.00 0.00 179.97 179.90 3nam h ALA 752 N 0.82 0.07 0.18 0.04 0.00 -0.56 -2.33 119.26 117.49 3nam h ALA 752 Ca -0.07 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.56 3nam h ALA 752 Cb 1.67 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 3nam h ALA 752 CO 0.16 -0.13 -0.23 0.82 0.00 0.00 0.00 179.25 179.87 3nam h ILE 753 N -0.35 0.50 -0.06 0.00 1.08 -0.09 -2.74 117.51 115.85 3nam h ILE 753 Ca 0.01 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.45 3nam h ILE 753 Cb 0.57 0.50 -0.01 0.00 -3.07 0.00 0.00 36.82 34.82 3nam h ILE 753 CO 0.01 0.00 -0.09 0.22 -0.69 0.00 0.00 178.15 177.60 3nam h TYR 754 N -0.46 0.09 -0.19 1.37 3.20 -1.53 0.92 116.97 120.37 3nam h TYR 754 Ca 0.01 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 3nam h TYR 754 Cb 0.45 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 3nam h TYR 754 CO -0.18 0.18 -0.02 -0.91 -1.64 0.00 0.00 178.16 175.59 3nam h ASN 755 N 0.09 0.34 0.06 -2.11 4.21 -1.15 -0.56 115.58 116.46 3nam h ASN 755 Ca 0.02 -0.33 -0.00 0.00 1.21 0.00 0.00 56.30 57.19 3nam h ASN 755 Cb 0.22 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 37.32 3nam h ASN 755 CO 0.01 0.59 -0.03 0.78 -1.29 0.00 0.00 177.43 177.50 3nam h ASN 756 N 0.08 -0.07 -0.04 5.81 4.21 -1.21 -2.54 115.58 121.82 3nam h ASN 756 Ca 0.05 -0.27 0.01 0.00 1.21 0.00 0.00 56.30 57.30 3nam h ASN 756 Cb 0.43 0.02 -0.00 0.00 -1.12 0.00 0.00 38.32 37.65 3nam h ASN 756 CO 0.01 0.23 0.09 -0.03 -1.29 0.00 0.00 177.43 176.45 3nam h MET 757 N -0.38 0.00 0.03 0.81 1.85 -0.87 0.18 114.93 116.55 3nam h MET 757 Ca -0.01 0.00 -0.24 0.00 -0.61 0.00 0.00 59.70 58.84 3nam h MET 757 Cb 0.33 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.37 3nam h MET 757 CO 0.01 0.00 -1.02 -0.22 -0.40 0.00 0.00 176.91 175.28 3nam h LYS 758 N 0.00 0.39 0.45 0.39 3.64 -0.68 -3.13 116.57 117.64 3nam h LYS 758 Ca 0.02 -0.47 -0.02 0.00 -1.27 0.00 0.00 60.65 58.91 3nam h LYS 758 Cb 0.21 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 3nam h LYS 758 CO -0.00 1.14 -0.22 1.96 -2.27 0.00 0.00 179.45 180.06 3nam h GLN 759 N 0.20 -0.59 0.00 1.90 1.08 -0.40 -2.84 115.11 114.46 3nam h GLN 759 Ca -0.10 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 3nam h GLN 759 Cb 1.68 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 29.24 3nam h GLN 759 CO 0.18 -0.35 0.08 0.27 -0.95 0.00 0.00 178.83 178.06 3nam h PHE 760 N -1.12 0.00 0.13 2.96 -5.15 -1.58 0.60 116.94 112.78 3nam h PHE 760 Ca -0.06 0.00 -0.23 0.00 -0.20 0.00 0.00 57.97 57.48 3nam h PHE 760 Cb 0.51 0.00 0.02 0.00 0.22 0.00 0.00 35.95 36.71 3nam h PHE 760 CO 0.01 0.00 -0.98 0.82 -2.00 0.00 0.00 178.31 176.16 3nam h ILE 761 N 0.00 1.41 -0.65 0.88 2.04 -1.51 -2.40 117.51 117.28 3nam h ILE 761 Ca 0.00 -2.46 -0.06 0.00 1.00 0.00 0.00 64.86 63.33 3nam h ILE 761 Cb 0.17 2.96 -0.03 0.00 -0.74 0.00 0.00 36.82 39.18 3nam h ILE 761 CO 0.00 0.72 0.15 0.03 0.00 0.00 0.00 178.15 179.05 3nam h ARG 762 N -0.10 1.03 0.00 2.37 3.08 -0.80 -0.01 114.38 119.95 3nam h ARG 762 Ca -0.16 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.65 3nam h ARG 762 Cb 1.73 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.64 3nam h ARG 762 CO 0.19 0.92 0.00 0.98 -1.07 0.00 0.00 179.97 180.98 3nam n TYR 763 N -4.24 0.00 -0.34 3.04 9.36 0.02 -0.94 117.16 124.05 3nam n TYR 763 Ca 0.05 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.41 3nam n TYR 763 Cb 0.25 -0.49 0.34 0.00 -0.63 0.00 0.00 39.34 38.81 3nam n TYR 763 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 3nam h LEU 764 N 0.00 0.71 -0.67 2.98 3.38 -1.40 0.99 115.31 121.30 3nam h LEU 764 Ca 0.00 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 3nam h LEU 764 Cb 0.00 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 3nam h LEU 764 CO 0.00 0.20 0.34 0.40 0.09 0.00 0.00 178.44 179.46 3nam h ILE 765 N 0.67 1.22 -0.34 1.22 1.08 -0.90 -2.83 117.51 117.64 3nam h ILE 765 Ca 0.59 -0.61 -0.07 0.00 -0.39 0.00 0.00 64.86 64.38 3nam h ILE 765 Cb 1.01 0.39 -0.02 0.00 -3.07 0.00 0.00 36.82 35.12 3nam h ILE 765 CO -0.42 0.26 -0.08 0.77 -0.69 0.00 0.00 178.15 177.99 3nam h SER 766 N 0.93 0.54 0.90 1.72 4.64 0.10 -1.97 113.55 120.42 3nam h SER 766 Ca 0.23 -0.13 -0.06 0.00 -0.47 0.00 0.00 61.79 61.36 3nam h SER 766 Cb 0.10 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 3nam h SER 766 CO -0.03 0.66 -0.28 0.77 -0.87 0.00 0.00 176.83 177.09 3nam h SER 767 N 0.52 0.00 -0.00 4.97 4.64 -1.29 -2.19 113.55 120.20 3nam h SER 767 Ca 0.10 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.23 3nam h SER 767 Cb 0.45 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3nam h SER 767 CO 0.02 0.28 -0.67 0.78 -0.87 0.00 0.00 176.83 176.37 3nam h ASN 768 N 0.00 0.73 -0.90 4.97 -0.26 -1.14 -2.52 115.58 116.45 3nam h ASN 768 Ca -0.00 -0.44 0.02 0.00 -0.56 0.00 0.00 56.30 55.32 3nam h ASN 768 Cb 0.80 -0.21 -0.05 0.00 -1.06 0.00 0.00 38.32 37.80 3nam h ASN 768 CO 0.04 1.20 0.59 0.58 -1.06 0.00 0.00 177.43 178.78 3nam h VAL 769 N 0.45 1.20 -0.45 2.81 2.07 -0.83 -1.90 116.25 119.60 3nam h VAL 769 Ca -0.02 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.04 3nam h VAL 769 Cb 1.25 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3nam h VAL 769 CO 0.13 0.22 0.09 1.23 0.02 0.00 0.00 177.57 179.25 3nam h GLY 770 N 1.19 0.80 2.00 2.17 0.00 -1.26 -2.12 103.07 105.84 3nam h GLY 770 Ca 0.34 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 3nam h GLY 770 CO -0.09 0.49 -0.12 0.83 0.00 0.00 0.00 176.54 177.65 3nam h GLU 771 N 0.61 0.00 0.07 4.80 5.08 -1.04 -1.43 114.58 122.68 3nam h GLU 771 Ca 0.14 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.22 3nam h GLU 771 Cb 0.36 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.64 3nam h GLU 771 CO 0.01 0.12 -1.16 0.28 -1.00 0.00 0.00 179.01 177.25 3nam h VAL 772 N 0.00 1.30 -0.27 3.13 2.07 -0.97 -2.53 116.25 118.98 3nam h VAL 772 Ca -0.00 -2.42 0.02 0.00 0.82 0.00 0.00 66.70 65.12 3nam h VAL 772 Cb 0.26 2.58 -0.03 0.00 -1.52 0.00 0.00 31.29 32.59 3nam h VAL 772 CO 0.02 0.74 0.11 0.58 0.02 0.00 0.00 177.57 179.03 3nam h VAL 773 N 0.30 0.96 0.10 2.57 2.07 -0.71 -0.94 116.25 120.59 3nam h VAL 773 Ca -0.16 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.28 3nam h VAL 773 Cb 1.83 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 3nam h VAL 773 CO 0.22 0.04 -0.25 0.00 0.02 0.00 0.00 177.57 177.61 3nam h ILE 775 N -0.39 0.40 0.00 0.00 1.08 -1.30 0.42 117.51 117.72 3nam h ILE 775 Ca -0.01 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.37 3nam h ILE 775 Cb 0.37 0.53 -0.01 0.00 -3.07 0.00 0.00 36.82 34.64 3nam h ILE 775 CO -0.11 0.00 -0.68 0.15 -0.69 0.00 0.00 178.15 176.81 3nam h PHE 776 N 0.00 0.00 0.07 1.37 3.57 -0.21 -2.91 116.94 118.83 3nam h PHE 776 Ca 0.33 0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.67 3nam h PHE 776 Cb 1.57 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.31 3nam h PHE 776 CO 0.00 0.41 -0.79 -0.07 -2.23 0.00 0.00 178.31 175.63 3nam h LEU 777 N 0.00 0.22 -0.85 0.59 3.38 0.17 -2.54 115.31 116.28 3nam h LEU 777 Ca -0.04 -0.87 0.21 0.00 0.09 0.00 0.00 57.88 57.27 3nam h LEU 777 Cb 1.34 -0.07 -0.13 0.00 0.09 0.00 0.00 40.66 41.89 3nam h LEU 777 CO 0.05 1.35 0.26 0.00 0.09 0.00 0.00 178.44 180.19 3nam h THR 778 N -0.66 0.41 0.15 0.22 1.03 -0.94 -1.79 112.91 111.33 3nam h THR 778 Ca -0.17 -0.10 -0.32 0.00 -0.01 0.00 0.00 66.41 65.81 3nam h THR 778 Cb 1.42 0.11 0.00 0.00 -1.07 0.00 0.00 68.15 68.61 3nam h THR 778 CO 0.02 0.05 -1.58 0.00 -0.01 0.00 0.00 175.52 174.00 3nam h ALA 779 N 1.72 0.19 -0.61 0.00 0.00 -1.63 -2.21 119.26 116.73 3nam h ALA 779 Ca 0.52 -1.09 0.02 0.00 0.00 0.00 0.00 54.91 54.36 3nam h ALA 779 Cb 0.99 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 3nam h ALA 779 CO -0.58 1.06 0.40 0.00 0.00 0.00 0.00 179.25 180.13 3nam h ALA 780 N 0.36 1.63 0.13 0.00 0.00 -1.02 -3.02 119.26 117.34 3nam h ALA 780 Ca -0.27 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.37 3nam h ALA 780 Cb 2.05 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 19.63 3nam h ALA 780 CO 0.18 0.31 -1.18 -0.07 0.00 0.00 0.00 179.25 178.49 3nam h LEU 781 N 0.76 0.42 0.00 0.00 3.38 -1.45 -3.44 115.31 114.98 3nam h LEU 781 Ca 0.24 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.32 3nam h LEU 781 Cb 0.02 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.63 3nam h LEU 781 CO -0.06 1.53 0.00 0.61 0.09 0.00 0.00 178.44 180.61 3nam n GLY 782 N 1.71 1.06 3.22 0.83 0.00 -0.90 -4.99 105.19 106.11 3nam n GLY 782 Ca -0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 3nam n GLY 782 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3nam n LEU 783 N 0.00 -2.68 -4.77 0.99 4.32 -0.88 -4.81 117.00 109.17 3nam n LEU 783 Ca 0.00 0.18 -0.38 0.00 -0.02 0.00 0.00 56.01 55.79 3nam n LEU 783 Cb 0.00 -0.95 -0.06 0.00 -1.62 0.00 0.00 43.42 40.79 3nam n LEU 783 CO 0.00 -4.20 0.66 -2.84 -1.22 0.00 0.00 177.39 169.79 3nam s PRO 784 N -2.92 4.63 -0.50 3.23 0.02 -1.26 -4.73 135.00 133.47 3nam s PRO 784 Ca 0.49 1.41 -0.44 0.00 0.02 0.00 0.00 61.00 62.48 3nam s PRO 784 Cb -0.15 -2.93 -0.19 0.00 0.02 0.00 0.00 34.50 31.24 3nam s PRO 784 CO 0.72 0.31 2.12 0.39 -0.33 0.00 0.00 177.00 180.21 3nam n GLU 785 N 0.80 0.00 -0.03 5.54 1.02 -1.26 -4.82 120.64 121.88 3nam n GLU 785 Ca 0.01 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.00 3nam n GLU 785 Cb 0.49 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.29 3nam n GLU 785 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3nam h ALA 786 N 8.83 0.00 -3.71 0.62 0.00 -1.95 -3.46 119.26 119.60 3nam h ALA 786 Ca -0.11 -0.49 -0.68 0.00 0.00 0.00 0.00 54.91 53.63 3nam h ALA 786 Cb 1.42 0.02 -0.26 0.00 0.00 0.00 0.00 17.79 18.96 3nam h ALA 786 CO 1.09 0.06 -0.79 -0.51 0.00 0.00 0.00 179.25 179.09 3nam s LEU 787 N -8.38 2.62 0.05 0.00 1.43 -1.26 -4.37 118.68 108.77 3nam s LEU 787 Ca -0.17 -0.30 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 3nam s LEU 787 Cb -0.01 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 3nam s LEU 787 CO 0.73 0.25 0.17 -0.63 0.23 0.00 0.00 176.35 177.10 3nam s ILE 788 N -0.16 5.17 0.23 -0.59 -1.09 -1.26 -5.00 121.20 118.50 3nam s ILE 788 Ca -0.01 -0.44 -0.07 0.00 -2.23 0.00 0.00 60.65 57.89 3nam s ILE 788 Cb -0.14 -3.49 0.22 0.00 -1.58 0.00 0.00 42.46 37.48 3nam s ILE 788 CO 0.03 0.17 1.67 -0.65 -1.23 0.00 0.00 174.94 174.94 3nam h PRO 789 N 3.28 0.19 -0.66 2.79 0.11 -1.91 -0.79 132.00 135.01 3nam h PRO 789 Ca -0.46 -0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.71 3nam h PRO 789 Cb 1.17 -0.04 -0.06 0.00 0.11 0.00 0.00 31.00 32.17 3nam h PRO 789 CO 0.72 0.13 0.35 0.28 -0.21 0.00 0.00 178.00 179.27 3nam h VAL 790 N 0.20 0.92 -0.11 3.15 2.07 -1.95 -0.76 116.25 119.77 3nam h VAL 790 Ca 0.38 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 3nam h VAL 790 Cb 0.65 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 3nam h VAL 790 CO -0.53 0.11 0.03 1.56 0.02 0.00 0.00 177.57 178.76 3nam h GLN 791 N 0.63 0.17 -0.92 1.57 4.20 -1.51 -2.76 115.11 116.49 3nam h GLN 791 Ca 0.31 -0.04 0.12 0.00 0.06 0.00 0.00 58.65 59.10 3nam h GLN 791 Cb 0.25 -0.02 -0.08 0.00 0.30 0.00 0.00 27.48 27.92 3nam h GLN 791 CO -0.21 0.34 0.55 -0.07 -0.67 0.00 0.00 178.83 178.77 3nam h LEU 792 N -0.03 0.78 0.65 1.46 3.38 -0.69 -1.77 115.31 119.09 3nam h LEU 792 Ca 0.03 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 3nam h LEU 792 Cb 0.24 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.91 3nam h LEU 792 CO 0.00 0.40 -0.31 -0.07 0.09 0.00 0.00 178.44 178.55 3nam h LEU 793 N 0.86 -0.74 -0.86 1.67 3.38 -1.05 0.92 115.31 119.49 3nam h LEU 793 Ca 0.47 0.02 0.20 0.00 0.09 0.00 0.00 57.88 58.65 3nam h LEU 793 Cb 0.50 0.19 -0.16 0.00 0.09 0.00 0.00 40.66 41.28 3nam h LEU 793 CO -0.28 -0.51 -0.08 -0.25 0.09 0.00 0.00 178.44 177.40 3nam h TRP 794 N -0.89 -0.22 0.50 1.13 2.91 -1.13 0.46 115.95 118.70 3nam h TRP 794 Ca -0.09 0.07 -0.02 0.00 1.13 0.00 0.00 58.89 59.98 3nam h TRP 794 Cb 0.67 0.23 0.00 0.00 -0.51 0.00 0.00 29.16 29.56 3nam h TRP 794 CO -0.03 -0.34 -0.24 0.28 -1.03 0.00 0.00 178.44 177.08 3nam h VAL 795 N 0.04 0.47 0.00 2.65 2.07 -0.96 0.26 116.25 120.77 3nam h VAL 795 Ca 0.46 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 3nam h VAL 795 Cb 0.81 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 3nam h VAL 795 CO -0.83 0.04 -0.07 0.78 0.02 0.00 0.00 177.57 177.52 3nam h ASN 796 N -0.84 0.00 0.00 0.57 2.35 0.65 0.14 115.58 118.45 3nam h ASN 796 Ca -0.07 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 3nam h ASN 796 Cb 0.58 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.95 3nam h ASN 796 CO 0.11 0.07 -0.55 0.18 -1.65 0.00 0.00 177.43 175.59 3nam n LEU 797 N -4.19 1.81 -0.02 1.61 4.77 0.15 -2.77 117.00 118.36 3nam n LEU 797 Ca -0.03 0.63 -0.01 0.00 -0.03 0.00 0.00 56.01 56.56 3nam n LEU 797 Cb 0.15 -0.88 -0.00 0.00 -2.33 0.00 0.00 43.42 40.36 3nam n LEU 797 CO 0.33 -0.44 -0.11 0.52 -1.33 0.00 0.00 177.39 176.36 3nam n VAL 798 N -4.61 0.38 0.34 4.08 0.31 0.89 -3.09 118.33 116.62 3nam n VAL 798 Ca -0.09 0.42 0.21 0.00 -0.01 0.00 0.00 64.34 64.87 3nam n VAL 798 Cb 0.29 -1.73 1.11 0.00 -0.91 0.00 0.00 33.84 32.59 3nam n VAL 798 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 3nam h THR 799 N -0.27 0.02 0.00 2.52 1.35 -1.36 -2.10 112.91 113.07 3nam h THR 799 Ca 0.00 0.00 -0.28 0.00 -0.55 0.00 0.00 66.41 65.58 3nam h THR 799 Cb 0.16 0.91 -0.05 0.00 -1.73 0.00 0.00 68.15 67.43 3nam h THR 799 CO 0.00 0.00 -2.13 0.47 -0.25 0.00 0.00 175.52 173.61 3nam n ASP 800 N -3.05 0.83 -0.23 5.36 9.92 0.48 -4.31 116.55 125.56 3nam n ASP 800 Ca -0.03 0.00 -0.04 0.00 -0.53 0.00 0.00 54.79 54.20 3nam n ASP 800 Cb 0.16 1.00 0.14 0.00 -0.64 0.00 0.00 41.12 41.78 3nam n ASP 800 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 3nam h GLY 801 N 3.34 1.11 0.81 0.44 0.00 -1.33 -0.94 103.07 106.50 3nam h GLY 801 Ca -0.42 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 46.33 3nam h GLY 801 CO 0.02 0.55 -0.09 1.41 0.00 0.00 0.00 176.54 178.43 3nam h LEU 802 N 1.02 -0.21 -1.84 3.11 3.38 -1.65 0.27 115.31 119.39 3nam h LEU 802 Ca 0.24 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 3nam h LEU 802 Cb 0.18 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3nam h LEU 802 CO -0.02 0.02 -0.01 -0.65 0.09 0.00 0.00 178.44 177.87 3nam h PRO 803 N -0.45 0.00 -0.02 1.13 0.11 -1.73 -2.63 132.00 128.42 3nam h PRO 803 Ca -0.03 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.03 3nam h PRO 803 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.46 3nam h PRO 803 CO 0.04 0.01 -0.18 0.00 -0.21 0.00 0.00 178.00 177.66 3nam h ALA 804 N 1.99 0.05 0.00 -0.75 0.00 -0.63 -2.91 119.26 117.01 3nam h ALA 804 Ca -0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 3nam h ALA 804 Cb 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3nam h ALA 804 CO 0.00 0.03 -0.12 1.79 0.00 0.00 0.00 179.25 180.95 3nam h THR 805 N -0.48 0.30 -0.00 0.00 1.35 -0.32 -2.84 112.91 110.91 3nam h THR 805 Ca -0.02 -0.86 -0.17 0.00 -0.55 0.00 0.00 66.41 64.82 3nam h THR 805 Cb 0.89 1.67 -0.02 0.00 -1.73 0.00 0.00 68.15 68.96 3nam h THR 805 CO 0.04 0.12 -0.80 0.00 -0.25 0.00 0.00 175.52 174.63 3nam h ALA 806 N 1.88 0.68 0.00 6.62 0.00 -1.52 -2.73 119.26 124.20 3nam h ALA 806 Ca -0.00 -0.72 -0.01 0.00 0.00 0.00 0.00 54.91 54.18 3nam h ALA 806 Cb 0.66 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3nam h ALA 806 CO 0.02 0.99 -0.02 -0.07 0.00 0.00 0.00 179.25 180.16 3nam h LEU 807 N 0.00 0.00 -1.01 0.00 3.38 -1.29 0.50 115.31 116.89 3nam h LEU 807 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3nam h LEU 807 Cb 1.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3nam h LEU 807 CO 0.10 0.02 0.00 1.23 0.09 0.00 0.00 178.44 179.89 3nam h GLY 808 N 0.51 0.00 -3.61 0.83 0.00 -1.54 -2.45 103.07 96.80 3nam h GLY 808 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 3nam h GLY 808 CO 0.00 0.00 0.42 0.69 0.00 0.00 0.00 176.54 177.65 3nam n PHE 809 N -2.47 2.46 -1.50 5.60 3.72 0.17 -4.86 117.46 120.57 3nam n PHE 809 Ca 0.01 -1.40 -0.32 0.00 -0.05 0.00 0.00 57.45 55.70 3nam n PHE 809 Cb 0.23 -0.75 0.07 0.00 -0.94 0.00 0.00 39.48 38.09 3nam n PHE 809 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3nam s ASN 810 N -0.92 4.73 0.06 4.37 0.01 -0.93 -4.95 114.94 117.32 3nam s ASN 810 Ca 0.49 1.96 -0.31 0.00 -0.71 0.00 0.00 52.86 54.29 3nam s ASN 810 Cb 0.40 -2.54 -0.07 0.00 0.41 0.00 0.00 41.25 39.45 3nam s ASN 810 CO 0.11 -1.89 1.45 -2.84 -1.51 0.00 0.00 177.10 172.42 3nam s PRO 811 N -4.43 4.28 0.37 -0.60 0.02 -1.26 -4.97 135.00 128.41 3nam s PRO 811 Ca 0.65 2.09 -0.27 0.00 0.02 0.00 0.00 61.00 63.49 3nam s PRO 811 Cb -0.20 -3.43 -0.09 0.00 0.02 0.00 0.00 34.50 30.79 3nam s PRO 811 CO 0.48 -0.55 1.28 -2.14 -0.33 0.00 0.00 177.00 175.73 3nam s PRO 812 N 1.89 4.19 0.78 5.54 0.02 -1.26 -4.96 135.00 141.20 3nam s PRO 812 Ca 0.66 2.12 -0.14 0.00 0.02 0.00 0.00 61.00 63.66 3nam s PRO 812 Cb -0.36 -2.91 0.04 0.00 0.02 0.00 0.00 34.50 31.30 3nam s PRO 812 CO 0.29 -0.30 1.00 -0.25 -0.33 0.00 0.00 177.00 177.42 3nam n ASP 813 N 0.47 0.43 -0.03 2.53 8.00 -1.26 -4.90 116.55 121.80 3nam n ASP 813 Ca 0.02 0.60 0.13 0.00 0.71 0.00 0.00 54.79 56.24 3nam n ASP 813 Cb 0.43 -1.43 0.37 0.00 -0.02 0.00 0.00 41.12 40.48 3nam n ASP 813 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3nam n LEU 814 N -2.29 0.44 -0.82 0.64 4.77 -1.26 -3.76 117.00 114.71 3nam n LEU 814 Ca 0.13 0.08 0.07 0.00 -0.03 0.00 0.00 56.01 56.27 3nam n LEU 814 Cb 0.50 -0.29 0.22 0.00 -2.33 0.00 0.00 43.42 41.53 3nam n LEU 814 CO 0.49 0.10 0.68 -0.90 -1.33 0.00 0.00 177.39 176.43 3nam n ASP 815 N -1.38 3.56 -0.31 -1.43 5.75 -1.26 -4.70 116.55 116.79 3nam n ASP 815 Ca 0.07 -2.63 0.15 0.00 -0.01 0.00 0.00 54.79 52.37 3nam n ASP 815 Cb 0.33 -0.43 0.32 0.00 -1.03 0.00 0.00 41.12 40.31 3nam n ASP 815 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 3nam h ILE 816 N 1.94 0.27 -0.87 2.12 2.04 -1.95 0.54 117.51 121.59 3nam h ILE 816 Ca 0.00 -0.06 -0.51 0.00 1.00 0.00 0.00 64.86 65.29 3nam h ILE 816 Cb 1.19 0.07 -0.26 0.00 -0.74 0.00 0.00 36.82 37.07 3nam h ILE 816 CO 0.14 0.03 0.66 0.23 0.00 0.00 0.00 178.15 179.21 3nam n MET 817 N -5.24 2.25 0.00 2.37 2.81 -1.26 -3.76 117.12 114.29 3nam n MET 817 Ca 0.23 -2.73 0.00 0.00 -1.81 0.00 0.00 57.70 53.39 3nam n MET 817 Cb 0.74 -2.07 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 3nam n MET 817 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3nam n ASP 818 N -0.81 0.13 -4.92 7.83 8.00 0.17 -3.27 116.55 123.68 3nam n ASP 818 Ca 0.53 -0.27 -0.29 0.00 0.71 0.00 0.00 54.79 55.47 3nam n ASP 818 Cb 1.16 0.58 -0.04 0.00 -0.02 0.00 0.00 41.12 42.80 3nam n ASP 818 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3nam s ARG 819 N -0.60 3.47 1.26 -1.24 0.52 -1.18 -4.73 118.95 116.45 3nam s ARG 819 Ca 0.00 -0.43 -0.18 0.00 -0.52 0.00 0.00 55.73 54.60 3nam s ARG 819 Cb 0.00 -2.98 0.31 0.00 0.52 0.00 0.00 34.95 32.80 3nam s ARG 819 CO 0.00 0.55 1.01 -2.14 0.02 0.00 0.00 175.30 174.74 3nam s PRO 820 N -2.80 -1.70 0.43 3.54 0.02 -1.26 -4.43 135.00 128.81 3nam s PRO 820 Ca 0.36 0.34 -0.24 0.00 0.02 0.00 0.00 61.00 61.48 3nam s PRO 820 Cb -0.12 -1.50 -0.08 0.00 0.02 0.00 0.00 34.50 32.81 3nam s PRO 820 CO 0.28 -4.11 1.13 -2.14 -0.33 0.00 0.00 177.00 171.82 3nam s PRO 821 N -4.93 3.94 0.67 5.54 0.02 -1.22 -4.94 135.00 134.08 3nam s PRO 821 Ca 0.69 1.70 -0.17 0.00 0.02 0.00 0.00 61.00 63.24 3nam s PRO 821 Cb -0.17 -2.49 0.01 0.00 0.02 0.00 0.00 34.50 31.86 3nam s PRO 821 CO 0.60 -0.38 1.21 0.50 -0.33 0.00 0.00 177.00 178.60 3nam s ARG 822 N -2.57 2.52 0.09 5.54 3.52 -1.26 -5.00 118.95 121.78 3nam s ARG 822 Ca 0.61 1.79 -0.16 0.00 -0.13 0.00 0.00 55.73 57.83 3nam s ARG 822 Cb -0.27 -1.88 -0.07 0.00 -1.56 0.00 0.00 34.95 31.18 3nam s ARG 822 CO 0.33 -1.55 0.53 0.45 -0.81 0.00 0.00 175.30 174.24 3nam s SER 823 N -1.86 6.91 0.01 -2.12 0.15 -1.26 -4.77 113.70 110.76 3nam s SER 823 Ca 0.76 1.12 0.22 0.00 0.70 0.00 0.00 55.95 58.75 3nam s SER 823 Cb -0.30 -2.31 0.96 0.00 -1.71 0.00 0.00 66.02 62.66 3nam s SER 823 CO 0.40 0.22 1.72 -2.65 1.20 0.00 0.00 173.24 174.13 3nam n PRO 824 N 1.36 0.01 -0.17 5.44 -0.02 -1.26 -2.65 135.00 137.71 3nam n PRO 824 Ca -0.09 0.12 0.11 0.00 -2.02 0.00 0.00 63.50 61.62 3nam n PRO 824 Cb 0.51 -1.51 0.26 0.00 -0.02 0.00 0.00 33.50 32.75 3nam n PRO 824 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3nam n LYS 825 N -1.53 2.27 -2.49 -0.52 5.02 -1.26 -4.88 118.16 114.77 3nam n LYS 825 Ca 0.05 -1.92 -0.43 0.00 -2.02 0.00 0.00 58.31 54.00 3nam n LYS 825 Cb 0.27 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.78 3nam n LYS 825 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3nam s GLU 826 N -1.55 4.29 0.57 1.97 2.12 -1.08 -5.00 118.70 120.01 3nam s GLU 826 Ca 0.37 1.61 -0.12 0.00 0.36 0.00 0.00 54.97 57.18 3nam s GLU 826 Cb 0.21 -3.67 -0.05 0.00 0.26 0.00 0.00 34.13 30.88 3nam s GLU 826 CO 0.29 -0.59 0.99 -1.25 -0.54 0.00 0.00 175.26 174.17 3nam s PRO 827 N 2.94 3.71 0.13 4.30 0.05 -1.26 -4.99 135.00 139.87 3nam s PRO 827 Ca 0.53 0.77 -0.06 0.00 0.05 0.00 0.00 61.00 62.29 3nam s PRO 827 Cb -0.21 -2.13 -0.09 0.00 0.05 0.00 0.00 34.50 32.12 3nam s PRO 827 CO 0.16 -0.43 1.31 -0.07 0.05 0.00 0.00 177.00 178.02 3nam h LEU 828 N 0.17 0.61 -7.42 -3.56 3.38 -2.00 -3.44 115.31 103.06 3nam h LEU 828 Ca -0.45 -0.47 -0.41 0.00 0.09 0.00 0.00 57.88 56.65 3nam h LEU 828 Cb 1.19 -0.19 -0.38 0.00 0.09 0.00 0.00 40.66 41.37 3nam h LEU 828 CO 0.62 1.25 -0.76 -0.63 0.09 0.00 0.00 178.44 179.02 3nam s ILE 829 N -3.39 0.18 0.28 1.22 1.01 -1.26 -5.03 121.20 114.22 3nam s ILE 829 Ca -0.07 0.24 -0.20 0.00 0.00 0.00 0.00 60.65 60.62 3nam s ILE 829 Cb 0.09 -0.38 0.05 0.00 0.01 0.00 0.00 42.46 42.23 3nam s ILE 829 CO 0.87 0.22 0.84 -0.94 0.00 0.00 0.00 174.94 175.94 3nam s SER 830 N 2.00 -0.10 0.63 3.58 1.04 -1.26 -4.77 113.70 114.82 3nam s SER 830 Ca 0.04 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.68 3nam s SER 830 Cb -0.12 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.69 3nam s SER 830 CO -0.04 -1.34 0.00 0.61 0.98 0.00 0.00 173.24 173.45 3nam n GLY 831 N -0.53 2.34 0.31 7.32 0.00 -1.26 -2.10 105.19 111.27 3nam n GLY 831 Ca -0.06 -0.32 0.09 0.00 0.00 0.00 0.00 46.02 45.73 3nam n GLY 831 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3nam h TRP 832 N 0.00 0.73 -0.76 1.61 2.91 -2.00 -0.83 115.95 117.61 3nam h TRP 832 Ca 0.00 0.04 0.01 0.00 1.13 0.00 0.00 58.89 60.06 3nam h TRP 832 Cb 0.00 -0.19 -0.04 0.00 -0.51 0.00 0.00 29.16 28.42 3nam h TRP 832 CO 0.00 0.11 0.50 1.25 -1.03 0.00 0.00 178.44 179.28 3nam h LEU 833 N 0.56 0.87 -1.52 0.65 5.85 -1.84 0.91 115.31 120.79 3nam h LEU 833 Ca 0.49 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 59.16 3nam h LEU 833 Cb 0.77 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 3nam h LEU 833 CO -0.41 0.63 0.01 0.15 -0.34 0.00 0.00 178.44 178.48 3nam h PHE 834 N 1.03 0.31 0.00 1.25 3.57 -0.88 -2.61 116.94 119.61 3nam h PHE 834 Ca 0.28 -0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.62 3nam h PHE 834 Cb -0.12 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.51 3nam h PHE 834 CO 0.00 0.32 -0.69 0.35 -2.23 0.00 0.00 178.31 176.06 3nam h PHE 835 N 0.31 0.00 -0.16 0.41 3.57 -0.57 -2.03 116.94 118.47 3nam h PHE 835 Ca 0.07 0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.38 3nam h PHE 835 Cb 0.20 0.00 0.01 0.00 2.79 0.00 0.00 35.95 38.95 3nam h PHE 835 CO 0.00 0.69 -0.65 0.00 -2.23 0.00 0.00 178.31 176.12 3nam h ARG 836 N 0.00 0.73 0.00 1.11 3.08 -0.99 -1.39 114.38 116.91 3nam h ARG 836 Ca -0.01 -0.57 -0.07 0.00 0.07 0.00 0.00 59.98 59.40 3nam h ARG 836 Cb 1.26 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.41 3nam h ARG 836 CO 0.09 1.18 -0.35 1.88 -1.07 0.00 0.00 179.97 181.70 3nam h TYR 837 N 0.43 0.00 -0.46 3.04 0.05 -1.59 1.34 116.97 119.78 3nam h TYR 837 Ca -0.04 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.62 3nam h TYR 837 Cb 1.28 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.01 3nam h TYR 837 CO 0.09 0.35 -0.20 1.98 -1.05 0.00 0.00 178.16 179.33 3nam h MET 838 N 0.00 0.91 0.12 4.88 4.05 -1.24 -0.86 114.93 122.79 3nam h MET 838 Ca -0.00 -0.37 -0.26 0.00 -0.28 0.00 0.00 59.70 58.79 3nam h MET 838 Cb 0.97 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.73 3nam h MET 838 CO 0.05 1.02 -1.31 0.00 0.23 0.00 0.00 176.91 176.90 3nam h ALA 839 N 0.97 0.13 -0.82 0.39 0.00 -0.44 -2.92 119.26 116.57 3nam h ALA 839 Ca 0.11 -1.02 0.01 0.00 0.00 0.00 0.00 54.91 54.00 3nam h ALA 839 Cb 0.75 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 3nam h ALA 839 CO 0.06 0.75 0.54 0.82 0.00 0.00 0.00 179.25 181.42 3nam h ILE 840 N -0.33 1.21 -0.01 0.00 1.08 0.17 -1.47 117.51 118.16 3nam h ILE 840 Ca -0.28 -0.40 -0.00 0.00 -0.39 0.00 0.00 64.86 63.79 3nam h ILE 840 Cb 1.73 0.02 -0.00 0.00 -3.07 0.00 0.00 36.82 35.50 3nam h ILE 840 CO 0.07 0.21 0.00 1.23 -0.69 0.00 0.00 178.15 178.97 3nam h GLY 841 N 1.11 0.02 1.39 5.37 0.00 -1.29 -1.66 103.07 108.01 3nam h GLY 841 Ca 0.30 -0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.66 3nam h GLY 841 CO -0.06 0.01 0.27 -1.33 0.00 0.00 0.00 176.54 175.42 3nam h GLY 842 N -0.19 0.00 0.03 4.60 0.00 -1.29 0.12 103.07 106.34 3nam h GLY 842 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 3nam h GLY 842 CO -0.00 0.00 -0.00 -1.82 0.00 0.00 0.00 176.54 174.72 3nam h TYR 843 N 0.00 -0.00 -0.28 5.60 3.20 -0.41 -3.09 116.97 121.99 3nam h TYR 843 Ca 0.07 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.85 3nam h TYR 843 Cb 0.60 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.86 3nam h TYR 843 CO 0.00 0.92 -0.19 -0.39 -1.64 0.00 0.00 178.16 176.86 3nam h VAL 844 N -0.97 1.25 -0.89 1.81 -1.51 -0.55 0.89 116.25 116.29 3nam h VAL 844 Ca -0.00 -1.16 0.05 0.00 -1.23 0.00 0.00 66.70 64.36 3nam h VAL 844 Cb 0.92 1.24 -0.05 0.00 -2.13 0.00 0.00 31.29 31.27 3nam h VAL 844 CO 0.00 0.37 0.58 1.23 -1.23 0.00 0.00 177.57 178.52 3nam h GLY 845 N 0.98 1.27 0.83 5.19 0.00 -0.90 -0.99 103.07 109.46 3nam h GLY 845 Ca 0.08 -0.42 -0.15 0.00 0.00 0.00 0.00 47.33 46.83 3nam h GLY 845 CO 0.04 0.34 -0.56 0.00 0.00 0.00 0.00 176.54 176.37 3nam h ALA 846 N 1.50 0.13 -1.00 3.60 0.00 -1.27 -3.04 119.26 119.17 3nam h ALA 846 Ca 0.36 -0.54 0.04 0.00 0.00 0.00 0.00 54.91 54.78 3nam h ALA 846 Cb 0.09 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 3nam h ALA 846 CO -0.12 0.37 0.66 0.00 0.00 0.00 0.00 179.25 180.15 3nam h ALA 847 N 0.40 1.34 0.10 0.00 0.00 -0.28 0.19 119.26 121.01 3nam h ALA 847 Ca -0.06 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3nam h ALA 847 Cb 1.23 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3nam h ALA 847 CO 0.11 0.54 -0.05 1.79 0.00 0.00 0.00 179.25 181.65 3nam h THR 848 N 1.26 1.12 0.42 0.00 1.35 -1.30 -0.19 112.91 115.57 3nam h THR 848 Ca 0.41 -1.28 -0.01 0.00 -0.55 0.00 0.00 66.41 64.97 3nam h THR 848 Cb 0.03 1.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.31 3nam h THR 848 CO -0.13 0.29 -0.30 0.58 -0.25 0.00 0.00 175.52 175.70 3nam h VAL 849 N -0.77 0.37 -0.26 6.82 2.07 -1.51 -2.79 116.25 120.18 3nam h VAL 849 Ca -0.01 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.57 3nam h VAL 849 Cb 0.57 0.37 -0.06 0.00 -1.52 0.00 0.00 31.29 30.65 3nam h VAL 849 CO 0.02 0.00 -0.13 1.23 0.02 0.00 0.00 177.57 178.71 3nam h GLY 850 N -0.71 0.08 1.82 2.17 0.00 -0.69 -1.04 103.07 104.71 3nam h GLY 850 Ca -0.04 0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.47 3nam h GLY 850 CO 0.01 -0.15 0.07 0.00 0.00 0.00 0.00 176.54 176.48 3nam h ALA 851 N 1.11 1.55 0.03 3.60 0.00 -0.98 0.91 119.26 125.48 3nam h ALA 851 Ca 0.14 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 3nam h ALA 851 Cb 0.31 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 3nam h ALA 851 CO -0.32 -0.10 -0.33 0.00 0.00 0.00 0.00 179.25 178.49 3nam h ALA 852 N 1.91 0.02 0.00 0.00 0.00 -1.03 -3.23 119.26 116.94 3nam h ALA 852 Ca 0.03 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3nam h ALA 852 Cb 0.17 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3nam h ALA 852 CO -0.00 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.42 3nam h ALA 853 N -0.04 1.00 0.09 0.00 0.00 -0.55 -2.45 119.26 117.32 3nam h ALA 853 Ca -0.07 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3nam h ALA 853 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3nam h ALA 853 CO 0.01 0.00 -0.04 2.35 0.00 0.00 0.00 179.25 181.56 3nam h TRP 854 N 0.00 -0.11 0.00 0.00 7.01 -0.90 -1.59 115.95 120.35 3nam h TRP 854 Ca 0.00 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 3nam h TRP 854 Cb 0.15 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.24 3nam h TRP 854 CO 0.00 0.42 0.01 1.87 -2.79 0.00 0.00 178.44 177.95 3nam n TRP 855 N -4.84 0.75 -0.07 2.65 -0.00 -0.93 -1.63 117.44 113.38 3nam n TRP 855 Ca -0.08 0.39 -0.07 0.00 -0.00 0.00 0.00 57.50 57.74 3nam n TRP 855 Cb 0.29 -1.13 -0.05 0.00 -0.00 0.00 0.00 31.31 30.42 3nam n TRP 855 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 177.69 178.43 3nam h PHE 856 N 0.00 0.00 0.00 5.87 0.04 -1.40 -3.41 116.94 118.04 3nam h PHE 856 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3nam h PHE 856 Cb 0.01 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.16 3nam h PHE 856 CO 0.00 0.47 0.00 -1.33 -0.60 0.00 0.00 178.31 176.85 3nam n MET 857 N -4.66 0.00 -0.27 1.51 2.81 -0.61 0.61 117.12 116.51 3nam n MET 857 Ca -0.08 0.00 -0.03 0.00 -1.81 0.00 0.00 57.70 55.78 3nam n MET 857 Cb 0.27 0.00 -0.04 0.00 -0.71 0.00 0.00 33.22 32.74 3nam n MET 857 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3nam n TYR 858 N 0.00 0.00 -3.71 2.03 4.01 -1.12 -4.20 117.16 114.17 3nam n TYR 858 Ca 0.00 -0.42 -0.37 0.00 -0.16 0.00 0.00 57.90 56.95 3nam n TYR 858 Cb 0.00 -0.66 -0.12 0.00 -0.31 0.00 0.00 39.34 38.25 3nam n TYR 858 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3nam s ALA 859 N 2.16 3.25 0.62 -0.72 0.00 -1.11 -4.85 121.76 121.12 3nam s ALA 859 Ca 0.16 -1.15 0.22 0.00 0.00 0.00 0.00 51.96 51.18 3nam s ALA 859 Cb 0.07 -2.20 0.99 0.00 0.00 0.00 0.00 23.12 21.98 3nam s ALA 859 CO 0.00 -0.55 1.49 1.49 0.00 0.00 0.00 175.76 178.19 3nam h GLU 860 N 8.28 0.00 -1.24 0.00 4.57 -1.90 -3.13 114.58 121.16 3nam h GLU 860 Ca -0.37 0.00 -0.30 0.00 -1.18 0.00 0.00 59.36 57.51 3nam h GLU 860 Cb 1.17 0.00 -0.23 0.00 -0.16 0.00 0.00 28.75 29.53 3nam h GLU 860 CO 0.58 0.00 -0.66 -3.47 -1.18 0.00 0.00 179.01 174.27 3nam n ASP 861 N -3.14 -2.34 0.00 1.04 2.03 -1.26 -5.12 116.55 107.76 3nam n ASP 861 Ca 0.10 -2.84 0.00 0.00 0.52 0.00 0.00 54.79 52.58 3nam n ASP 861 Cb 1.01 1.01 0.00 0.00 -0.72 0.00 0.00 41.12 42.41 3nam n ASP 861 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3nam n GLY 862 N 2.55 1.53 0.00 0.27 0.00 -1.19 -5.05 105.19 103.31 3nam n GLY 862 Ca 0.20 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3nam n GLY 862 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3nam n PRO 863 N -0.25 0.00 0.00 1.61 -0.02 -1.26 -4.68 135.00 130.40 3nam n PRO 863 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3nam n PRO 863 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 3nam n PRO 863 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3nam n GLY 864 N 0.00 4.05 2.71 -1.23 0.00 0.20 -4.97 105.19 105.95 3nam n GLY 864 Ca 0.00 -1.15 -0.07 0.00 0.00 0.00 0.00 46.02 44.79 3nam n GLY 864 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3nam n VAL 865 N -0.12 0.00 -0.01 1.61 0.31 -1.26 -4.86 118.33 114.00 3nam n VAL 865 Ca 0.00 -1.47 -0.00 0.00 -0.01 0.00 0.00 64.34 62.86 3nam n VAL 865 Cb 0.00 1.14 -0.00 0.00 -0.91 0.00 0.00 33.84 34.07 3nam n VAL 865 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3nam n THR 866 N -0.30 -0.01 -0.06 2.52 -2.24 -1.26 -3.41 114.28 109.53 3nam n THR 866 Ca -0.01 0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 3nam n THR 866 Cb 0.80 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 3nam n THR 866 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3nam n TYR 867 N -2.78 0.00 -1.16 4.78 0.18 -1.26 -4.96 117.16 111.95 3nam n TYR 867 Ca 0.00 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.54 3nam n TYR 867 Cb 0.00 0.00 0.19 0.00 -0.38 0.00 0.00 39.34 39.15 3nam n TYR 867 CO 0.00 0.00 0.00 -2.39 -2.08 0.00 0.00 176.86 172.39 3nam n HIS 868 N -0.19 -3.79 -2.45 -3.48 1.44 -1.22 -4.93 115.22 100.60 3nam n HIS 868 Ca 0.00 -0.83 -0.39 0.00 -2.01 0.00 0.00 57.72 54.49 3nam n HIS 868 Cb 0.01 -0.88 -0.03 0.00 0.12 0.00 0.00 29.99 29.22 3nam n HIS 868 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 3nam s GLN 869 N -5.07 3.47 0.05 -1.40 -0.21 -1.26 -4.65 119.66 110.59 3nam s GLN 869 Ca 0.58 -1.25 0.26 0.00 0.02 0.00 0.00 55.36 54.97 3nam s GLN 869 Cb -0.04 -5.36 0.67 0.00 1.00 0.00 0.00 33.01 29.28 3nam s GLN 869 CO 0.43 -2.53 1.55 1.47 -2.12 0.00 0.00 175.29 174.10 3nam n LEU 870 N 9.91 0.46 0.24 2.90 -0.00 -1.26 -3.63 117.00 125.62 3nam n LEU 870 Ca 0.39 0.24 0.11 0.00 -0.00 0.00 0.00 56.01 56.76 3nam n LEU 870 Cb 0.49 -0.30 0.56 0.00 -0.00 0.00 0.00 43.42 44.16 3nam n LEU 870 CO 0.68 0.02 0.86 0.71 -0.00 0.00 0.00 177.39 179.66 3nam h THR 871 N 0.00 0.51 -0.38 1.47 1.35 -1.89 -3.06 112.91 110.91 3nam h THR 871 Ca 0.00 -0.92 -0.16 0.00 -0.55 0.00 0.00 66.41 64.78 3nam h THR 871 Cb 0.59 1.63 -0.10 0.00 -1.73 0.00 0.00 68.15 68.54 3nam h THR 871 CO 0.00 0.18 0.21 1.41 -0.25 0.00 0.00 175.52 177.06 3nam n HIS 872 N -3.42 1.19 0.31 4.73 8.25 -1.24 -4.40 115.22 120.64 3nam n HIS 872 Ca -0.00 -0.87 0.14 0.00 -0.26 0.00 0.00 57.72 56.73 3nam n HIS 872 Cb 0.37 -0.48 0.76 0.00 1.12 0.00 0.00 29.99 31.76 3nam n HIS 872 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3nam h PHE 873 N 0.75 0.00 -0.62 4.41 -5.15 -1.80 0.88 116.94 115.41 3nam h PHE 873 Ca 0.20 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.94 3nam h PHE 873 Cb 1.62 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 37.76 3nam h PHE 873 CO 0.62 0.00 0.25 0.52 -2.00 0.00 0.00 178.31 177.71 3nam h MET 874 N 0.00 0.93 -3.61 6.09 2.86 -1.90 -3.37 114.93 115.93 3nam h MET 874 Ca 0.00 -0.16 -0.71 0.00 -2.06 0.00 0.00 59.70 56.76 3nam h MET 874 Cb 0.65 -0.15 -0.34 0.00 0.06 0.00 0.00 31.60 31.82 3nam h MET 874 CO 0.00 0.78 -0.29 1.14 1.06 0.00 0.00 176.91 179.60 3nam s GLN 875 N -5.57 2.74 0.17 1.72 -2.07 0.30 -4.79 119.66 112.17 3nam s GLN 875 Ca -0.13 -2.54 0.00 0.00 -1.82 0.00 0.00 55.36 50.87 3nam s GLN 875 Cb 0.13 -3.84 0.00 0.00 -1.09 0.00 0.00 33.01 28.21 3nam s GLN 875 CO 0.80 -1.19 0.00 0.00 -1.32 0.00 0.00 175.29 173.58 3nam n THR 877 N -3.06 -0.15 0.79 0.00 -2.24 -1.26 0.22 114.28 108.58 3nam n THR 877 Ca 0.00 1.57 0.08 0.00 -2.27 0.00 0.00 64.05 63.43 3nam n THR 877 Cb 0.00 -2.59 -0.09 0.00 -2.10 0.00 0.00 70.33 65.54 3nam n THR 877 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3nam n GLU 878 N -4.29 1.47 -0.24 -0.78 4.71 -1.26 -4.32 120.64 115.92 3nam n GLU 878 Ca 0.39 -0.01 0.09 0.00 -0.01 0.00 0.00 57.16 57.61 3nam n GLU 878 Cb 1.60 -1.29 0.19 0.00 -1.01 0.00 0.00 31.44 30.93 3nam n GLU 878 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 3nam n ASP 879 N -1.38 3.06 -0.32 1.62 -0.08 0.59 -4.76 116.55 115.28 3nam n ASP 879 Ca 0.03 -2.97 0.17 0.00 -1.51 0.00 0.00 54.79 50.51 3nam n ASP 879 Cb 0.26 -0.46 0.37 0.00 2.34 0.00 0.00 41.12 43.63 3nam n ASP 879 CO 0.00 0.00 0.00 1.12 0.12 0.00 0.00 177.20 178.44 3nam h HIS 880 N 0.90 0.81 -0.82 -0.67 2.07 0.33 0.15 115.15 117.93 3nam h HIS 880 Ca 0.00 0.04 0.08 0.00 -2.85 0.00 0.00 60.37 57.64 3nam h HIS 880 Cb 1.17 -0.20 -0.07 0.00 2.57 0.00 0.00 27.41 30.88 3nam h HIS 880 CO 0.24 -0.06 0.48 -1.00 -3.07 0.00 0.00 177.93 174.52 3nam h PRO 881 N 0.42 0.82 -6.03 5.12 0.13 -1.86 -2.93 132.00 127.68 3nam h PRO 881 Ca 0.63 -0.05 -0.59 0.00 -0.87 0.00 0.00 66.00 65.12 3nam h PRO 881 Cb 1.26 -0.18 -0.08 0.00 0.13 0.00 0.00 31.00 32.12 3nam h PRO 881 CO -0.54 0.54 0.62 -1.58 -0.23 0.00 0.00 178.00 176.81 3nam s HIS 882 N -6.05 3.18 -0.19 1.56 5.65 0.54 -4.53 115.29 115.45 3nam s HIS 882 Ca -0.12 1.01 -0.01 0.00 0.25 0.00 0.00 55.06 56.18 3nam s HIS 882 Cb 0.18 -3.44 0.00 0.00 -1.18 0.00 0.00 32.58 28.15 3nam s HIS 882 CO 0.78 -0.66 0.15 1.19 -0.65 0.00 0.00 174.74 175.56 3nam n PHE 883 N 6.51 -0.52 -2.71 3.88 3.72 -1.26 -4.84 117.46 122.25 3nam n PHE 883 Ca 0.08 0.21 -0.07 0.00 -0.05 0.00 0.00 57.45 57.62 3nam n PHE 883 Cb 0.48 -0.64 0.10 0.00 -0.94 0.00 0.00 39.48 38.47 3nam n PHE 883 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3nam n GLU 884 N -0.90 0.73 -2.99 -1.08 -0.58 -1.10 -4.98 120.64 109.74 3nam n GLU 884 Ca -0.07 -1.51 -0.44 0.00 -0.42 0.00 0.00 57.16 54.72 3nam n GLU 884 Cb 0.17 -0.70 -0.01 0.00 -0.57 0.00 0.00 31.44 30.33 3nam n GLU 884 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 3nam s GLY 885 N -0.90 2.22 0.00 0.62 0.00 -1.26 -4.61 107.32 103.40 3nam s GLY 885 Ca 0.21 -3.08 0.00 0.00 0.00 0.00 0.00 44.72 41.85 3nam s GLY 885 CO -0.10 1.93 0.00 1.47 0.00 0.00 0.00 173.10 176.40 3nam n LEU 886 N 5.83 0.00 -4.63 0.66 -0.00 -1.26 -5.14 117.00 112.47 3nam n LEU 886 Ca 0.28 0.00 -0.38 0.00 -0.00 0.00 0.00 56.01 55.91 3nam n LEU 886 Cb 0.46 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.78 3nam n LEU 886 CO 0.53 0.00 -0.10 -0.62 -0.00 0.00 0.00 177.39 177.20 3nam s ASP 887 N -4.00 6.14 0.00 1.45 2.15 -1.26 -4.98 116.67 116.16 3nam s ASP 887 Ca 0.00 0.14 -0.05 0.00 0.43 0.00 0.00 52.55 53.07 3nam s ASP 887 Cb 0.00 -2.14 -0.20 0.00 -0.30 0.00 0.00 42.92 40.28 3nam s ASP 887 CO 0.00 -0.03 2.93 0.00 -0.17 0.00 0.00 175.17 177.90 3nam n GLU 889 N 2.53 0.00 0.26 0.00 2.13 -1.26 -4.77 120.64 119.53 3nam n GLU 889 Ca 0.32 0.00 0.14 0.00 0.66 0.00 0.00 57.16 58.28 3nam n GLU 889 Cb 0.72 -0.34 0.71 0.00 0.27 0.00 0.00 31.44 32.81 3nam n GLU 889 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 3nam h ILE 890 N 0.71 0.43 0.00 6.31 1.08 -1.99 -2.46 117.51 121.59 3nam h ILE 890 Ca 0.00 -0.60 0.00 0.00 -0.39 0.00 0.00 64.86 63.87 3nam h ILE 890 Cb 0.35 1.43 0.00 0.00 -3.07 0.00 0.00 36.82 35.53 3nam h ILE 890 CO 0.00 0.11 0.00 0.49 -0.69 0.00 0.00 178.15 178.06 3nam n PHE 891 N -3.45 0.00 -1.01 1.37 3.72 -1.26 -1.05 117.46 115.78 3nam n PHE 891 Ca -0.01 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.46 3nam n PHE 891 Cb 0.27 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.91 3nam n PHE 891 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3nam n GLU 892 N -0.81 1.37 -1.92 -1.08 1.02 -0.92 -4.87 120.64 113.42 3nam n GLU 892 Ca 0.08 -2.16 -0.38 0.00 -0.02 0.00 0.00 57.16 54.67 3nam n GLU 892 Cb 0.03 -1.27 0.02 0.00 -0.02 0.00 0.00 31.44 30.21 3nam n GLU 892 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3nam s ALA 893 N -2.15 2.92 0.07 0.62 0.00 -0.21 -4.96 121.76 118.04 3nam s ALA 893 Ca 0.22 1.24 -0.03 0.00 0.00 0.00 0.00 51.96 53.39 3nam s ALA 893 Cb 0.19 -3.52 -0.28 0.00 0.00 0.00 0.00 23.12 19.52 3nam s ALA 893 CO 0.02 -1.15 1.10 -1.35 0.00 0.00 0.00 175.76 174.38 3nam h PRO 894 N 1.75 0.24 -0.60 0.00 0.11 -1.89 -3.37 132.00 128.24 3nam h PRO 894 Ca -0.50 -0.42 0.12 0.00 0.11 0.00 0.00 66.00 65.31 3nam h PRO 894 Cb 1.28 0.15 -0.10 0.00 0.11 0.00 0.00 31.00 32.45 3nam h PRO 894 CO 0.59 1.18 0.03 0.93 -0.21 0.00 0.00 178.00 180.51 3nam h GLU 895 N 0.07 0.14 -0.85 1.05 3.07 -1.89 -0.19 114.58 115.98 3nam h GLU 895 Ca -0.14 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.71 3nam h GLU 895 Cb 1.96 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 29.80 3nam h GLU 895 CO 0.19 0.09 0.52 -1.35 -1.40 0.00 0.00 179.01 177.07 3nam h PRO 896 N 0.15 1.15 -0.06 2.33 0.11 -1.87 -0.91 132.00 132.90 3nam h PRO 896 Ca 0.31 -0.10 -0.01 0.00 0.11 0.00 0.00 66.00 66.32 3nam h PRO 896 Cb 0.50 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 31.36 3nam h PRO 896 CO -0.49 0.80 -0.00 0.52 -0.21 0.00 0.00 178.00 178.62 3nam h MET 897 N 1.17 0.10 0.00 1.05 2.86 -1.52 -1.78 114.93 116.80 3nam h MET 897 Ca 0.31 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.91 3nam h MET 897 Cb -0.06 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.59 3nam h MET 897 CO -0.06 0.39 0.00 0.25 1.06 0.00 0.00 176.91 178.55 3nam n THR 898 N -4.87 0.85 -0.01 2.22 -2.24 -0.16 -0.07 114.28 110.01 3nam n THR 898 Ca -0.07 0.24 -0.13 0.00 -2.27 0.00 0.00 64.05 61.82 3nam n THR 898 Cb 0.19 -1.15 -0.10 0.00 -2.10 0.00 0.00 70.33 67.17 3nam n THR 898 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 3nam h MET 899 N 0.00 -0.05 0.00 -0.78 2.86 -0.77 -1.98 114.93 114.21 3nam h MET 899 Ca 0.00 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.60 3nam h MET 899 Cb 0.35 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 3nam h MET 899 CO 0.00 0.56 -0.22 0.00 1.06 0.00 0.00 176.91 178.31 3nam h ALA 900 N 0.17 0.97 0.00 6.32 0.00 -0.64 -2.49 119.26 123.59 3nam h ALA 900 Ca -0.01 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 3nam h ALA 900 Cb 0.63 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3nam h ALA 900 CO 0.01 0.27 -0.80 1.25 0.00 0.00 0.00 179.25 179.98 3nam h LEU 901 N 0.00 0.00 -0.14 0.00 6.46 -0.51 -2.89 115.31 118.23 3nam h LEU 901 Ca -0.00 0.00 -0.14 0.00 -0.12 0.00 0.00 57.88 57.62 3nam h LEU 901 Cb 0.82 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.73 3nam h LEU 901 CO 0.03 0.60 -0.68 0.28 -0.62 0.00 0.00 178.44 178.05 3nam h SER 902 N 0.00 0.00 1.41 1.25 0.02 -1.15 -2.01 113.55 113.07 3nam h SER 902 Ca -0.05 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.85 3nam h SER 902 Cb 1.50 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.03 3nam h SER 902 CO 0.07 0.68 -0.25 1.62 -1.14 0.00 0.00 176.83 177.81 3nam h VAL 903 N 0.00 0.47 0.00 2.27 3.04 -1.46 -2.37 116.25 118.20 3nam h VAL 903 Ca -0.01 -1.43 -0.02 0.00 -1.01 0.00 0.00 66.70 64.24 3nam h VAL 903 Cb 1.46 2.04 -0.00 0.00 -2.01 0.00 0.00 31.29 32.78 3nam h VAL 903 CO 0.09 0.24 -0.15 0.25 -1.01 0.00 0.00 177.57 176.99 3nam h LEU 904 N 0.00 0.00 -1.17 3.16 5.85 -1.42 -2.29 115.31 119.43 3nam h LEU 904 Ca -0.00 -0.43 0.18 0.00 0.84 0.00 0.00 57.88 58.47 3nam h LEU 904 Cb 1.02 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 41.96 3nam h LEU 904 CO 0.03 0.80 0.61 0.58 -0.34 0.00 0.00 178.44 180.12 3nam h VAL 905 N -1.00 0.75 0.07 1.05 2.07 -1.43 0.35 116.25 118.10 3nam h VAL 905 Ca -0.03 -0.24 -0.28 0.00 0.82 0.00 0.00 66.70 66.97 3nam h VAL 905 Cb 0.54 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 3nam h VAL 905 CO -0.02 0.13 -1.42 0.71 0.02 0.00 0.00 177.57 176.99 3nam h THR 906 N 0.70 1.26 0.00 2.57 1.35 -1.56 -3.03 112.91 114.19 3nam h THR 906 Ca 0.52 -2.95 0.00 0.00 -0.55 0.00 0.00 66.41 63.43 3nam h THR 906 Cb 0.89 2.73 0.00 0.00 -1.73 0.00 0.00 68.15 70.04 3nam h THR 906 CO -0.29 0.80 0.00 -0.38 -0.25 0.00 0.00 175.52 175.41 3nam n ILE 907 N -3.36 1.14 0.03 6.82 5.41 -0.62 -2.27 119.36 126.51 3nam n ILE 907 Ca -0.12 0.31 -0.02 0.00 1.00 0.00 0.00 62.75 63.92 3nam n ILE 907 Cb 1.02 -1.14 -0.09 0.00 -0.71 0.00 0.00 39.64 38.72 3nam n ILE 907 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3nam h GLU 908 N 0.00 0.00 0.00 0.38 4.39 -0.86 -2.72 114.58 115.78 3nam h GLU 908 Ca 0.00 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.56 3nam h GLU 908 Cb 0.22 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 3nam h GLU 908 CO 0.00 0.36 -0.73 0.52 -1.16 0.00 0.00 179.01 178.00 3nam h MET 909 N 0.00 0.00 0.13 2.33 2.86 -1.37 -2.22 114.93 116.65 3nam h MET 909 Ca -0.18 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 3nam h MET 909 Cb 1.67 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.33 3nam h MET 909 CO 0.06 0.63 -0.06 0.00 1.06 0.00 0.00 176.91 178.60 3nam h ASN 911 N -0.67 0.00 1.86 0.00 -1.24 -1.51 -0.47 115.58 113.55 3nam h ASN 911 Ca -0.02 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.98 3nam h ASN 911 Cb 0.51 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.55 3nam h ASN 911 CO 0.03 0.00 -0.07 0.00 -1.29 0.00 0.00 177.43 176.10 3nam h ALA 912 N 2.03 0.96 0.00 1.57 0.00 -1.29 -2.91 119.26 119.62 3nam h ALA 912 Ca 0.00 -0.06 -0.28 0.00 0.00 0.00 0.00 54.91 54.57 3nam h ALA 912 Cb 0.25 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 3nam h ALA 912 CO 0.00 0.09 -1.60 -0.07 0.00 0.00 0.00 179.25 177.67 3nam h LEU 913 N 0.00 0.01 -0.54 0.00 3.38 -0.98 -3.25 115.31 113.94 3nam h LEU 913 Ca -0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3nam h LEU 913 Cb 1.02 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 3nam h LEU 913 CO 0.01 1.02 0.00 0.59 0.09 0.00 0.00 178.44 180.15 3nam n ASN 914 N -3.11 0.69 -0.76 -0.43 5.03 -0.89 -2.76 115.26 113.02 3nam n ASN 914 Ca -0.14 0.64 0.11 0.00 0.87 0.00 0.00 54.58 56.06 3nam n ASN 914 Cb 1.03 -0.80 0.31 0.00 -1.02 0.00 0.00 39.78 39.30 3nam n ASN 914 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 3nam n SER 915 N -2.23 2.29 0.20 6.41 7.64 -1.10 -4.10 113.62 122.73 3nam n SER 915 Ca 0.03 -1.82 0.15 0.00 1.01 0.00 0.00 58.87 58.24 3nam n SER 915 Cb 0.27 -0.15 0.54 0.00 -1.01 0.00 0.00 64.21 63.86 3nam n SER 915 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3nam h LEU 916 N 3.01 0.00 -7.08 -3.43 3.38 -1.65 -3.44 115.31 106.10 3nam h LEU 916 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3nam h LEU 916 Cb 0.66 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.21 3nam h LEU 916 CO 0.00 0.00 0.10 -0.55 0.09 0.00 0.00 178.44 178.08 3nam s SER 917 N -5.12 -0.61 0.06 -0.43 0.15 -1.26 -5.01 113.70 101.48 3nam s SER 917 Ca 0.04 0.81 -0.17 0.00 0.70 0.00 0.00 55.95 57.33 3nam s SER 917 Cb 0.09 0.73 -0.14 0.00 -1.71 0.00 0.00 66.02 65.00 3nam s SER 917 CO 0.51 -0.49 1.32 -0.08 1.20 0.00 0.00 173.24 175.70 3nam h GLU 918 N 3.67 0.55 0.00 5.44 4.81 -1.86 -3.39 114.58 123.81 3nam h GLU 918 Ca -0.28 -0.35 0.00 0.00 -0.13 0.00 0.00 59.36 58.60 3nam h GLU 918 Cb 1.15 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.57 3nam h GLU 918 CO 0.31 0.96 0.00 0.09 -0.73 0.00 0.00 179.01 179.64 3nam n ASN 919 N -4.31 0.60 -4.72 1.04 3.02 -1.26 -4.94 115.26 104.69 3nam n ASN 919 Ca -0.06 -0.95 -0.40 0.00 -0.03 0.00 0.00 54.58 53.14 3nam n ASN 919 Cb 0.50 0.05 -0.04 0.00 -0.61 0.00 0.00 39.78 39.68 3nam n ASN 919 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3nam s GLN 920 N -0.05 4.47 1.00 3.52 -1.52 -1.26 -4.77 119.66 121.05 3nam s GLN 920 Ca 0.00 1.00 -0.11 0.00 -1.95 0.00 0.00 55.36 54.30 3nam s GLN 920 Cb 0.00 -3.45 0.18 0.00 -0.22 0.00 0.00 33.01 29.52 3nam s GLN 920 CO 0.00 0.05 1.01 0.45 -0.25 0.00 0.00 175.29 176.55 3nam n SER 921 N 3.77 -0.55 0.18 5.90 2.88 -1.26 -4.73 113.62 119.81 3nam n SER 921 Ca 0.00 0.23 0.07 0.00 -1.33 0.00 0.00 58.87 57.84 3nam n SER 921 Cb 0.51 -1.38 0.13 0.00 -0.75 0.00 0.00 64.21 62.73 3nam n SER 921 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 3nam h LEU 922 N -2.11 0.00 -0.20 2.46 3.38 -1.94 0.60 115.31 117.49 3nam h LEU 922 Ca -0.49 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.36 3nam h LEU 922 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3nam h LEU 922 CO 0.43 0.30 -0.37 -0.03 0.09 0.00 0.00 178.44 178.86 3nam h MET 923 N 0.00 0.60 -0.03 1.13 4.05 -1.99 -2.29 114.93 116.40 3nam h MET 923 Ca -0.00 -0.38 -0.17 0.00 -0.28 0.00 0.00 59.70 58.87 3nam h MET 923 Cb 1.18 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 32.01 3nam h MET 923 CO 0.04 0.99 -0.74 -0.09 0.23 0.00 0.00 176.91 177.34 3nam h ARG 924 N 0.28 0.21 -2.99 0.39 2.43 -1.90 -3.38 114.38 109.42 3nam h ARG 924 Ca 0.01 -0.19 -0.61 0.00 -0.81 0.00 0.00 59.98 58.38 3nam h ARG 924 Cb 0.96 0.04 -0.40 0.00 -0.42 0.00 0.00 29.97 30.15 3nam h ARG 924 CO 0.08 0.86 -0.74 1.41 -1.51 0.00 0.00 179.97 180.08 3nam s MET 925 N -3.48 1.30 0.67 0.20 1.75 0.19 -4.99 119.30 114.95 3nam s MET 925 Ca -0.03 -2.01 -0.16 0.00 -1.25 0.00 0.00 55.69 52.23 3nam s MET 925 Cb 0.11 -2.35 0.01 0.00 2.84 0.00 0.00 34.83 35.44 3nam s MET 925 CO 0.81 -1.16 1.20 -2.14 -0.65 0.00 0.00 175.02 173.08 3nam s PRO 926 N 0.34 2.51 0.38 4.11 0.02 -0.87 -4.34 135.00 137.15 3nam s PRO 926 Ca 0.18 1.74 0.07 0.00 0.02 0.00 0.00 61.00 63.01 3nam s PRO 926 Cb -0.24 -1.88 0.75 0.00 0.02 0.00 0.00 34.50 33.15 3nam s PRO 926 CO 0.00 -1.55 1.94 -1.00 -0.33 0.00 0.00 177.00 176.07 3nam h PRO 927 N 0.16 0.41 0.00 5.54 0.13 -1.92 -2.00 132.00 134.32 3nam h PRO 927 Ca -0.49 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 3nam h PRO 927 Cb 1.29 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3nam h PRO 927 CO 0.52 0.43 0.00 -2.67 -0.23 0.00 0.00 178.00 176.05 3nam n TRP 928 N -4.34 0.00 -0.04 1.56 2.14 -1.26 -1.56 117.44 113.95 3nam n TRP 928 Ca 0.01 0.00 0.02 0.00 2.07 0.00 0.00 57.50 59.60 3nam n TRP 928 Cb 0.20 -0.25 0.36 0.00 -0.81 0.00 0.00 31.31 30.81 3nam n TRP 928 CO 0.00 0.00 0.00 0.28 2.07 0.00 0.00 177.69 180.04 3nam h VAL 929 N 0.00 1.14 -3.76 -1.67 2.07 -1.73 -3.34 116.25 108.96 3nam h VAL 929 Ca 0.00 -0.37 -0.67 0.00 0.82 0.00 0.00 66.70 66.48 3nam h VAL 929 Cb 0.05 0.54 -0.38 0.00 -1.52 0.00 0.00 31.29 29.98 3nam h VAL 929 CO 0.00 0.16 -0.75 0.21 0.02 0.00 0.00 177.57 177.21 3nam s ASN 930 N -6.64 4.65 0.09 0.57 3.84 -0.60 -4.86 114.94 111.99 3nam s ASN 930 Ca -0.09 -1.83 -0.16 0.00 0.21 0.00 0.00 52.86 50.99 3nam s ASN 930 Cb 0.17 -1.60 -0.08 0.00 -0.55 0.00 0.00 41.25 39.18 3nam s ASN 930 CO 0.75 -0.30 1.44 0.40 -2.79 0.00 0.00 177.10 176.60 3nam h ILE 931 N 6.67 1.30 -1.09 -5.21 2.04 -1.78 -3.02 117.51 116.41 3nam h ILE 931 Ca -0.11 -1.27 0.30 0.00 1.00 0.00 0.00 64.86 64.78 3nam h ILE 931 Cb 1.03 1.53 -0.07 0.00 -0.74 0.00 0.00 36.82 38.57 3nam h ILE 931 CO 0.50 0.40 0.75 -0.50 0.00 0.00 0.00 178.15 179.30 3nam h TRP 932 N 0.33 0.31 0.44 1.37 4.06 -1.94 -0.90 115.95 119.62 3nam h TRP 932 Ca 0.06 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 61.00 3nam h TRP 932 Cb 0.69 -0.09 0.00 0.00 -1.00 0.00 0.00 29.16 28.76 3nam h TRP 932 CO 0.06 0.02 -0.21 1.25 -3.56 0.00 0.00 178.44 176.01 3nam h LEU 933 N 0.18 -0.50 -0.52 -4.49 5.85 -1.78 -1.38 115.31 112.66 3nam h LEU 933 Ca 0.57 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 59.24 3nam h LEU 933 Cb 1.87 0.13 -0.05 0.00 0.37 0.00 0.00 40.66 42.98 3nam h LEU 933 CO -0.14 -0.14 0.25 -0.07 -0.34 0.00 0.00 178.44 177.99 3nam h LEU 934 N -0.90 0.35 -1.88 2.25 3.38 -1.24 -1.52 115.31 115.75 3nam h LEU 934 Ca -0.06 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 3nam h LEU 934 Cb 0.57 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 3nam h LEU 934 CO 0.10 0.24 0.04 1.23 0.09 0.00 0.00 178.44 180.14 3nam h GLY 935 N 0.49 0.12 1.81 0.83 0.00 -1.26 -1.78 103.07 103.28 3nam h GLY 935 Ca 0.24 -0.05 -0.22 0.00 0.00 0.00 0.00 47.33 47.29 3nam h GLY 935 CO -0.18 0.05 -1.02 1.48 0.00 0.00 0.00 176.54 176.87 3nam h SER 936 N 0.12 0.22 -0.26 0.19 4.64 -0.38 -2.92 113.55 115.15 3nam h SER 936 Ca 0.03 -0.21 -0.02 0.00 -0.47 0.00 0.00 61.79 61.12 3nam h SER 936 Cb 0.02 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 3nam h SER 936 CO -0.00 1.10 0.12 0.40 -0.87 0.00 0.00 176.83 177.58 3nam h ILE 937 N 0.06 1.13 -0.06 0.95 2.04 -0.44 0.11 117.51 121.30 3nam h ILE 937 Ca -0.06 -0.40 -0.05 0.00 1.00 0.00 0.00 64.86 65.34 3nam h ILE 937 Cb 1.72 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 3nam h ILE 937 CO 0.15 0.15 -0.17 0.00 0.00 0.00 0.00 178.15 178.28 3nam h LEU 939 N -0.28 0.48 -0.09 0.00 5.85 -1.23 0.20 115.31 120.25 3nam h LEU 939 Ca -0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 3nam h LEU 939 Cb 0.79 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.71 3nam h LEU 939 CO 0.04 0.31 -0.03 0.28 -0.34 0.00 0.00 178.44 178.70 3nam h SER 940 N 0.54 0.18 -0.19 1.25 0.02 -0.67 -0.05 113.55 114.63 3nam h SER 940 Ca 0.26 -0.38 -0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3nam h SER 940 Cb 0.32 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 3nam h SER 940 CO -0.08 0.52 0.12 0.24 -1.14 0.00 0.00 176.83 176.49 3nam h MET 941 N -0.16 0.26 -0.59 3.45 2.86 -0.60 0.32 114.93 120.47 3nam h MET 941 Ca 0.02 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 3nam h MET 941 Cb 0.44 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.02 3nam h MET 941 CO 0.01 0.21 0.22 0.66 1.06 0.00 0.00 176.91 179.06 3nam h SER 942 N 0.24 0.83 -0.06 1.22 4.64 -1.04 -0.45 113.55 118.94 3nam h SER 942 Ca 0.07 -0.19 0.02 0.00 -0.47 0.00 0.00 61.79 61.22 3nam h SER 942 Cb 0.01 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 61.88 3nam h SER 942 CO -0.01 0.79 0.07 -0.07 -0.87 0.00 0.00 176.83 176.74 3nam h LEU 943 N 0.82 0.00 0.01 5.97 3.38 -0.49 0.37 115.31 125.37 3nam h LEU 943 Ca 0.19 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.90 3nam h LEU 943 Cb 0.24 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.00 3nam h LEU 943 CO -0.01 0.00 -1.12 -0.74 0.09 0.00 0.00 178.44 176.65 3nam h HIS 944 N 0.00 0.78 -0.08 1.13 2.76 0.57 -3.21 115.15 117.09 3nam h HIS 944 Ca 0.03 -0.47 -0.10 0.00 -2.20 0.00 0.00 60.37 57.63 3nam h HIS 944 Cb 0.16 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.04 3nam h HIS 944 CO 0.00 1.32 -0.41 0.74 -1.30 0.00 0.00 177.93 178.28 3nam h PHE 945 N 0.23 0.20 0.37 5.26 0.04 0.41 -3.09 116.94 120.36 3nam h PHE 945 Ca -0.14 -0.05 -0.00 0.00 2.80 0.00 0.00 57.97 60.58 3nam h PHE 945 Cb 1.79 -0.05 -0.03 0.00 2.20 0.00 0.00 35.95 39.87 3nam h PHE 945 CO 0.08 0.56 -0.41 1.25 -0.60 0.00 0.00 178.31 179.19 3nam h LEU 946 N 0.15 -1.14 -1.04 1.54 5.85 -1.08 -1.18 115.31 118.41 3nam h LEU 946 Ca 0.01 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3nam h LEU 946 Cb 0.79 0.39 0.00 0.00 0.37 0.00 0.00 40.66 42.20 3nam h LEU 946 CO 0.06 -0.56 0.00 2.30 -0.34 0.00 0.00 178.44 179.90 3nam n ILE 947 N -5.50 0.03 0.00 4.05 -5.35 -1.17 -1.67 119.36 109.75 3nam n ILE 947 Ca -0.10 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.38 3nam n ILE 947 Cb 0.40 -0.38 0.00 0.00 -1.74 0.00 0.00 39.64 37.92 3nam n ILE 947 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3nam n LEU 948 N 0.16 1.98 0.00 7.28 4.77 -0.74 -3.82 117.00 126.63 3nam n LEU 948 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.09 3nam n LEU 948 Cb 0.19 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.16 3nam n LEU 948 CO 0.00 0.32 -0.33 -1.22 -1.33 0.00 0.00 177.39 174.82 3nam n TYR 949 N -2.54 0.06 0.00 -1.77 4.01 -0.52 -3.86 117.16 112.53 3nam n TYR 949 Ca 0.00 0.02 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 3nam n TYR 949 Cb 0.45 -0.29 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 3nam n TYR 949 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3nam n VAL 950 N -1.91 0.00 0.00 -0.72 0.31 -0.67 -5.00 118.33 110.35 3nam n VAL 950 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.30 3nam n VAL 950 Cb 0.45 -0.62 -0.01 0.00 -0.91 0.00 0.00 33.84 32.75 3nam n VAL 950 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3nam n ASP 951 N 0.00 1.25 0.24 4.52 8.00 -1.26 -4.51 116.55 124.79 3nam n ASP 951 Ca 0.00 0.18 0.14 0.00 0.71 0.00 0.00 54.79 55.82 3nam n ASP 951 Cb 0.00 -0.43 0.36 0.00 -0.02 0.00 0.00 41.12 41.04 3nam n ASP 951 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 3nam h PRO 952 N -0.28 0.00 0.51 -0.24 0.11 -1.98 -3.31 132.00 126.80 3nam h PRO 952 Ca -0.02 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 3nam h PRO 952 Cb 0.39 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 3nam h PRO 952 CO -0.02 0.00 -0.24 -0.07 -0.21 0.00 0.00 178.00 177.47 3nam h LEU 953 N 0.00 -0.57 -1.99 2.35 3.38 -1.91 -2.31 115.31 114.26 3nam h LEU 953 Ca -0.00 0.01 0.12 0.00 0.09 0.00 0.00 57.88 58.10 3nam h LEU 953 Cb 0.82 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 3nam h LEU 953 CO 0.00 -0.16 0.44 -0.65 0.09 0.00 0.00 178.44 178.16 3nam h PRO 954 N -1.17 0.00 0.09 1.13 0.11 -1.69 -1.37 132.00 129.10 3nam h PRO 954 Ca -0.07 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.87 3nam h PRO 954 Cb 0.53 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.66 3nam h PRO 954 CO 0.11 0.00 -0.71 1.98 -0.21 0.00 0.00 178.00 179.17 3nam h MET 955 N 0.00 0.32 0.00 1.05 4.05 -1.64 -0.25 114.93 118.46 3nam h MET 955 Ca 0.20 -0.47 0.00 0.00 -0.28 0.00 0.00 59.70 59.15 3nam h MET 955 Cb 1.07 0.16 0.00 0.00 -0.80 0.00 0.00 31.60 32.03 3nam h MET 955 CO -0.00 1.19 0.00 -0.84 0.23 0.00 0.00 176.91 177.48 3nam h ILE 956 N -0.31 0.00 -0.01 1.77 3.07 -0.68 -3.08 117.51 118.28 3nam h ILE 956 Ca -0.11 -0.58 0.00 0.00 1.55 0.00 0.00 64.86 65.72 3nam h ILE 956 Cb 1.51 1.55 0.00 0.00 -0.27 0.00 0.00 36.82 39.61 3nam h ILE 956 CO 0.14 0.00 -0.64 0.49 -1.05 0.00 0.00 178.15 177.09 3nam n PHE 957 N -2.50 0.00 -3.34 0.16 3.72 -0.74 -4.98 117.46 109.78 3nam n PHE 957 Ca 0.05 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.29 3nam n PHE 957 Cb 0.43 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.05 3nam n PHE 957 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3nam n LYS 958 N -0.77 -4.79 -4.44 -1.08 5.02 -1.02 -4.82 118.16 106.27 3nam n LYS 958 Ca 0.06 0.85 -0.22 0.00 -2.02 0.00 0.00 58.31 56.97 3nam n LYS 958 Cb 0.34 -5.81 -0.16 0.00 -0.02 0.00 0.00 35.03 29.38 3nam n LYS 958 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3nam s LEU 959 N -5.92 1.64 -0.15 -0.35 1.43 -0.14 -4.66 118.68 110.52 3nam s LEU 959 Ca 0.18 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 3nam s LEU 959 Cb -0.02 -0.65 0.02 0.00 0.03 0.00 0.00 46.19 45.56 3nam s LEU 959 CO 0.73 0.03 -0.18 -0.75 0.23 0.00 0.00 176.35 176.41 3nam s LYS 960 N 0.52 2.68 0.46 1.70 2.20 -1.26 -4.54 119.74 121.50 3nam s LYS 960 Ca -0.09 -0.71 -0.15 0.00 -0.36 0.00 0.00 55.97 54.65 3nam s LYS 960 Cb -0.13 -2.32 -0.12 0.00 -1.51 0.00 0.00 37.83 33.75 3nam s LYS 960 CO 0.02 -0.17 -0.17 0.00 -0.36 0.00 0.00 175.35 174.67 3nam n ALA 961 N 4.53 -3.05 -2.39 3.13 0.00 -1.25 -4.67 120.51 116.81 3nam n ALA 961 Ca -0.19 -0.09 -0.30 0.00 0.00 0.00 0.00 53.44 52.85 3nam n ALA 961 Cb 0.50 -1.14 -0.14 0.00 0.00 0.00 0.00 19.45 18.67 3nam n ALA 961 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 3nam s LEU 962 N 4.43 2.34 1.28 0.00 0.05 -1.26 -4.99 118.68 120.54 3nam s LEU 962 Ca 0.46 -0.55 -0.18 0.00 0.05 0.00 0.00 54.13 53.91 3nam s LEU 962 Cb -0.38 -1.37 0.32 0.00 -2.05 0.00 0.00 46.19 42.71 3nam s LEU 962 CO 0.56 0.25 1.00 1.51 -0.55 0.00 0.00 176.35 179.12 3nam s ASP 963 N -1.40 0.09 0.62 1.48 1.47 -1.26 -4.74 116.67 112.93 3nam s ASP 963 Ca 0.13 1.05 0.40 0.00 1.18 0.00 0.00 52.55 55.31 3nam s ASP 963 Cb -0.10 -1.57 1.97 0.00 -0.34 0.00 0.00 42.92 42.89 3nam s ASP 963 CO 0.04 -4.69 2.21 0.25 0.68 0.00 0.00 175.17 173.66 3nam h LEU 964 N -2.96 0.00 0.14 2.11 6.46 -2.00 -1.91 115.31 117.15 3nam h LEU 964 Ca -0.51 0.00 -0.34 0.00 -0.12 0.00 0.00 57.88 56.91 3nam h LEU 964 Cb 1.33 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.26 3nam h LEU 964 CO 0.39 0.01 -1.79 0.00 -0.62 0.00 0.00 178.44 176.43 3nam h THR 965 N 0.00 0.87 0.00 1.05 1.03 -1.99 -3.14 112.91 110.72 3nam h THR 965 Ca -0.00 -2.52 -0.03 0.00 -0.01 0.00 0.00 66.41 63.85 3nam h THR 965 Cb 0.22 2.65 -0.00 0.00 -1.07 0.00 0.00 68.15 69.94 3nam h THR 965 CO 0.00 0.84 -0.12 1.56 -0.01 0.00 0.00 175.52 177.78 3nam h GLN 966 N 0.08 0.00 0.01 0.00 4.20 -1.79 -1.93 115.11 115.68 3nam h GLN 966 Ca -0.35 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.17 3nam h GLN 966 Cb 2.06 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.82 3nam h GLN 966 CO 0.14 0.12 -0.87 -1.49 -0.67 0.00 0.00 178.83 176.07 3nam h TRP 967 N 0.00 0.13 0.00 2.96 4.06 -1.42 -2.76 115.95 118.93 3nam h TRP 967 Ca -0.00 -0.08 -0.00 0.00 2.06 0.00 0.00 58.89 60.87 3nam h TRP 967 Cb 0.46 -0.01 -0.00 0.00 -1.00 0.00 0.00 29.16 28.60 3nam h TRP 967 CO 0.00 0.91 -0.02 -0.07 -3.56 0.00 0.00 178.44 175.70 3nam h LEU 968 N 0.05 0.00 -0.08 -4.49 3.38 -1.32 -2.41 115.31 110.44 3nam h LEU 968 Ca -0.03 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.71 3nam h LEU 968 Cb 1.51 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.27 3nam h LEU 968 CO 0.12 0.02 -0.85 -0.03 0.09 0.00 0.00 178.44 177.79 3nam h MET 969 N 0.00 0.72 -0.79 1.13 4.05 -1.23 -2.10 114.93 116.71 3nam h MET 969 Ca -0.00 -0.66 0.03 0.00 -0.28 0.00 0.00 59.70 58.78 3nam h MET 969 Cb 0.76 0.16 -0.05 0.00 -0.80 0.00 0.00 31.60 31.67 3nam h MET 969 CO 0.00 1.26 0.51 0.28 0.23 0.00 0.00 176.91 179.19 3nam h VAL 970 N 0.41 1.14 -0.38 -5.77 2.07 -1.20 -2.04 116.25 110.49 3nam h VAL 970 Ca -0.08 -0.34 -0.15 0.00 0.82 0.00 0.00 66.70 66.94 3nam h VAL 970 Cb 1.49 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3nam h VAL 970 CO 0.17 0.18 -0.35 -0.07 0.02 0.00 0.00 177.57 177.52 3nam h LEU 971 N 1.00 0.96 -1.83 2.57 3.38 -1.42 -0.63 115.31 119.34 3nam h LEU 971 Ca 0.31 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3nam h LEU 971 Cb -0.02 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 3nam h LEU 971 CO -0.10 1.22 -0.05 0.11 0.09 0.00 0.00 178.44 179.71 3nam h LYS 972 N 0.72 0.00 0.00 1.13 1.57 -1.01 -2.39 116.57 116.58 3nam h LYS 972 Ca 0.06 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.72 3nam h LYS 972 Cb 0.94 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.23 3nam h LYS 972 CO 0.09 0.05 -0.82 0.82 -0.57 0.00 0.00 179.45 179.02 3nam h ILE 973 N 0.00 0.72 0.00 1.86 2.04 -1.24 -3.42 117.51 117.47 3nam h ILE 973 Ca -0.00 -1.81 0.00 0.00 1.00 0.00 0.00 64.86 64.05 3nam h ILE 973 Cb 0.40 1.63 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 3nam h ILE 973 CO 0.01 0.24 0.00 -1.54 0.00 0.00 0.00 178.15 176.86 3nam n SER 974 N -4.53 0.00 -0.11 1.72 3.41 -0.26 -4.14 113.62 109.71 3nam n SER 974 Ca -0.21 0.50 0.07 0.00 -0.26 0.00 0.00 58.87 58.97 3nam n SER 974 Cb 0.50 -0.07 0.12 0.00 -0.26 0.00 0.00 64.21 64.50 3nam n SER 974 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3nam n LEU 975 N -0.72 0.01 0.00 1.04 4.77 -0.91 0.11 117.00 121.31 3nam n LEU 975 Ca 0.00 0.54 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 3nam n LEU 975 Cb 0.00 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 3nam n LEU 975 CO 0.00 -0.56 0.50 -2.65 -1.33 0.00 0.00 177.39 173.34 3nam n PRO 976 N -4.07 0.00 -0.13 3.23 -0.02 -1.26 -1.25 135.00 131.49 3nam n PRO 976 Ca 0.09 0.34 -0.08 0.00 -2.02 0.00 0.00 63.50 61.83 3nam n PRO 976 Cb 0.30 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 3nam n PRO 976 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3nam h VAL 977 N 0.00 1.13 -0.01 -1.45 2.07 -0.58 -1.42 116.25 115.99 3nam h VAL 977 Ca 0.00 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.21 3nam h VAL 977 Cb 0.31 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3nam h VAL 977 CO 0.00 0.14 0.15 0.40 0.02 0.00 0.00 177.57 178.27 3nam h ILE 978 N 0.54 0.04 0.06 4.57 2.04 -1.41 -2.27 117.51 121.08 3nam h ILE 978 Ca 0.15 0.00 -0.22 0.00 1.00 0.00 0.00 64.86 65.79 3nam h ILE 978 Cb 0.00 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 3nam h ILE 978 CO -0.03 0.00 -1.15 1.23 0.00 0.00 0.00 178.15 178.20 3nam h GLY 979 N 0.00 0.15 0.94 5.37 0.00 -1.43 -2.67 103.07 105.43 3nam h GLY 979 Ca 0.01 -0.37 0.11 0.00 0.00 0.00 0.00 47.33 47.07 3nam h GLY 979 CO -0.00 0.33 0.43 -2.00 0.00 0.00 0.00 176.54 175.30 3nam h LEU 980 N -0.62 0.36 0.14 3.11 5.85 -0.93 -0.11 115.31 123.11 3nam h LEU 980 Ca -0.27 0.01 -0.34 0.00 0.84 0.00 0.00 57.88 58.12 3nam h LEU 980 Cb 1.50 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.46 3nam h LEU 980 CO -0.03 0.21 -1.72 -0.78 -0.34 0.00 0.00 178.44 175.77 3nam h ASP 981 N 0.40 0.47 -1.00 1.25 3.58 -1.57 -2.78 116.42 116.77 3nam h ASP 981 Ca 0.30 -0.75 0.07 0.00 0.42 0.00 0.00 57.03 57.08 3nam h ASP 981 Cb 0.64 -0.15 -0.07 0.00 1.72 0.00 0.00 39.33 41.47 3nam h ASP 981 CO -0.08 1.64 0.65 -0.33 -2.88 0.00 0.00 179.24 178.23 3nam h GLU 982 N 0.08 1.12 -0.65 0.28 4.39 -1.04 0.20 114.58 118.96 3nam h GLU 982 Ca -0.32 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.23 3nam h GLU 982 Cb 2.06 -0.25 -0.03 0.00 -0.10 0.00 0.00 28.75 30.43 3nam h GLU 982 CO 0.15 0.74 0.08 0.82 -1.16 0.00 0.00 179.01 179.64 3nam h ILE 983 N 1.15 1.26 0.00 3.13 2.04 -1.12 -1.61 117.51 122.37 3nam h ILE 983 Ca 0.44 -1.07 -0.10 0.00 1.00 0.00 0.00 64.86 65.14 3nam h ILE 983 Cb 0.21 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 3nam h ILE 983 CO -0.19 0.40 -0.47 -0.07 0.00 0.00 0.00 178.15 177.82 3nam h LEU 984 N 1.01 0.00 -0.15 1.44 3.38 -0.89 -2.50 115.31 117.60 3nam h LEU 984 Ca 0.19 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.96 3nam h LEU 984 Cb 0.47 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.23 3nam h LEU 984 CO 0.02 0.47 -0.71 0.11 0.09 0.00 0.00 178.44 178.42 3nam h LYS 985 N 0.00 0.75 -0.92 1.13 1.57 -0.34 -2.90 116.57 115.87 3nam h LYS 985 Ca -0.00 -0.60 0.06 0.00 -1.87 0.00 0.00 60.65 58.23 3nam h LYS 985 Cb 0.86 0.12 -0.06 0.00 0.08 0.00 0.00 32.23 33.24 3nam h LYS 985 CO 0.06 1.21 0.60 0.35 -0.57 0.00 0.00 179.45 181.11 3nam h PHE 986 N 0.47 1.08 0.10 -1.35 3.57 -1.14 -1.52 116.94 118.15 3nam h PHE 986 Ca -0.05 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 3nam h PHE 986 Cb 1.34 -0.36 -0.00 0.00 2.79 0.00 0.00 35.95 39.72 3nam h PHE 986 CO 0.09 0.59 -0.06 0.82 -2.23 0.00 0.00 178.31 177.52 3nam h ILE 987 N 1.08 0.00 -0.97 1.41 1.08 -1.36 -1.33 117.51 117.43 3nam h ILE 987 Ca 0.39 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 65.03 3nam h ILE 987 Cb 0.14 0.00 -0.17 0.00 -3.07 0.00 0.00 36.82 33.72 3nam h ILE 987 CO -0.14 0.00 -0.31 0.00 -0.69 0.00 0.00 178.15 177.01 3nam n ALA 988 N -2.17 0.06 -0.36 1.87 0.00 -1.05 -2.48 120.51 116.38 3nam n ALA 988 Ca -0.02 1.02 0.00 0.00 0.00 0.00 0.00 53.44 54.44 3nam n ALA 988 Cb 0.06 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 18.97 3nam n ALA 988 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3nam n ARG 989 N -5.51 0.00 0.00 0.00 1.74 -0.60 -4.47 116.66 107.82 3nam n ARG 989 Ca 0.13 0.32 0.00 0.00 -0.77 0.00 0.00 57.85 57.53 3nam n ARG 989 Cb 0.44 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.59 3nam n ARG 989 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3nam n ASN 990 N -1.45 0.00 -4.51 0.55 4.13 -0.50 -4.52 115.26 108.95 3nam n ASN 990 Ca 0.00 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.84 3nam n ASN 990 Cb 0.00 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.17 3nam n ASN 990 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 3nam n TYR 991 N 0.00 1.32 -1.44 3.10 4.01 -1.13 -4.57 117.16 118.44 3nam n TYR 991 Ca 0.00 0.21 0.00 0.00 -0.16 0.00 0.00 57.90 57.95 3nam n TYR 991 Cb 0.00 -2.55 0.00 0.00 -0.31 0.00 0.00 39.34 36.48 3nam n TYR 991 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 3nam n LEU 992 N 12.48 0.00 -3.31 7.72 7.94 -1.26 -4.36 117.00 136.20 3nam n LEU 992 Ca 0.45 0.00 -0.32 0.00 -1.11 0.00 0.00 56.01 55.03 3nam n LEU 992 Cb 0.32 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.25 3nam n LEU 992 CO 0.78 0.00 2.71 -0.62 -1.11 0.00 0.00 177.39 179.14 3nam n GLU 993 N -0.66 2.62 -0.84 1.96 4.71 -1.26 -5.04 120.64 122.12 3nam n GLU 993 Ca 0.00 -1.84 0.00 0.00 -0.01 0.00 0.00 57.16 55.31 3nam n GLU 993 Cb 0.00 -2.69 0.00 0.00 -1.01 0.00 0.00 31.44 27.74 3nam n GLU 993 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63