#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1loo h ALA 28 N 0.00 0.89 -0.17 0.00 0.00 -2.02 -3.24 119.26 114.72 1loo h ALA 28 Ca 0.00 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.56 1loo h ALA 28 Cb 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1loo h ALA 28 CO 0.00 0.51 0.02 1.15 0.00 0.00 0.00 179.25 180.93 1loo h THR 29 N 0.00 0.91 0.00 0.00 2.02 -1.95 -3.49 112.91 110.39 1loo h THR 29 Ca -0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1loo h THR 29 Cb 1.04 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 68.27 1loo h THR 29 CO 0.05 0.01 0.00 0.61 0.37 0.00 0.00 175.52 176.57 1loo n GLY 30 N -1.16 -1.79 3.77 2.16 0.00 -1.22 -4.79 105.19 102.15 1loo n GLY 30 Ca -0.03 -1.74 -0.38 0.00 0.00 0.00 0.00 46.02 43.86 1loo n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1loo s SER 31 N -4.00 6.29 -0.14 1.61 0.01 0.85 -5.01 113.70 113.31 1loo s SER 31 Ca 0.00 2.45 -0.03 0.00 1.31 0.00 0.00 55.95 59.67 1loo s SER 31 Cb 0.00 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 1loo s SER 31 CO 0.00 -0.84 -0.03 -0.13 0.41 0.00 0.00 173.24 172.65 1loo s ARG 32 N -2.42 3.54 0.58 12.44 0.52 -1.26 -4.80 118.95 127.55 1loo s ARG 32 Ca 0.60 -0.49 -0.17 0.00 -0.52 0.00 0.00 55.73 55.14 1loo s ARG 32 Cb -0.33 -2.90 -0.04 0.00 0.52 0.00 0.00 34.95 32.20 1loo s ARG 32 CO 0.41 0.34 1.08 0.14 0.02 0.00 0.00 175.30 177.29 1loo s VAL 33 N 0.10 3.55 -0.16 3.52 -7.23 0.10 -4.42 120.40 115.87 1loo s VAL 33 Ca -0.00 0.82 -0.06 0.00 -1.81 0.00 0.00 61.98 60.93 1loo s VAL 33 Cb -0.13 -3.31 -0.04 0.00 0.56 0.00 0.00 36.38 33.45 1loo s VAL 33 CO 0.02 -0.35 0.05 -0.89 -0.31 0.00 0.00 175.10 173.62 1loo s THR 34 N -2.20 4.68 0.00 5.32 2.01 -0.49 0.09 115.64 125.04 1loo s THR 34 Ca 0.67 -0.08 0.07 0.00 0.31 0.00 0.00 61.69 62.66 1loo s THR 34 Cb -0.19 -3.08 -0.02 0.00 0.01 0.00 0.00 72.50 69.23 1loo s THR 34 CO 0.33 0.50 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.83 1loo s VAL 35 N 0.09 1.84 -0.21 3.82 1.01 0.20 -0.72 120.40 126.42 1loo s VAL 35 Ca 0.04 -1.07 0.02 0.00 0.00 0.00 0.00 61.98 60.97 1loo s VAL 35 Cb -0.12 -1.54 0.04 0.00 0.00 0.00 0.00 36.38 34.75 1loo s VAL 35 CO 0.01 0.44 -0.16 -0.69 0.00 0.00 0.00 175.10 174.71 1loo s VAL 36 N -0.62 2.07 0.09 2.92 1.01 -0.89 0.52 120.40 125.49 1loo s VAL 36 Ca 0.09 -1.21 0.09 0.00 0.00 0.00 0.00 61.98 60.94 1loo s VAL 36 Cb -0.09 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1loo s VAL 36 CO -0.00 0.29 -0.22 -0.76 0.00 0.00 0.00 175.10 174.40 1loo s LEU 37 N 1.23 2.25 0.17 3.92 1.43 -0.34 -0.44 118.68 126.90 1loo s LEU 37 Ca -0.01 -0.64 -0.30 0.00 -1.03 0.00 0.00 54.13 52.15 1loo s LEU 37 Cb -0.16 -1.01 -0.07 0.00 0.03 0.00 0.00 46.19 44.98 1loo s LEU 37 CO -0.09 0.13 0.99 -0.83 0.23 0.00 0.00 176.35 176.78 1loo s GLY 38 N -1.66 3.00 0.00 -3.19 0.00 -1.23 -0.88 107.32 103.35 1loo s GLY 38 Ca 0.09 0.65 0.22 0.00 0.00 0.00 0.00 44.72 45.68 1loo s GLY 38 CO 0.04 1.43 1.04 0.00 0.00 0.00 0.00 173.10 175.61 1loo n ALA 39 N 2.30 4.31 -2.92 3.20 0.00 -0.91 -1.02 120.51 125.48 1loo n ALA 39 Ca 0.01 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1loo n ALA 39 Cb 0.48 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.09 1loo n ALA 39 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1loo n GLN 40 N -1.21 0.00 -0.62 0.00 6.02 -1.26 -4.62 117.38 115.69 1loo n GLN 40 Ca 0.05 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.08 1loo n GLN 40 Cb 0.36 0.00 0.26 0.00 1.02 0.00 0.00 30.24 31.87 1loo n GLN 40 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1loo n TRP 41 N 0.00 1.23 0.00 1.08 8.01 -1.26 -1.29 117.44 125.21 1loo n TRP 41 Ca 0.00 -1.08 0.00 0.00 -1.31 0.00 0.00 57.50 55.11 1loo n TRP 41 Cb 0.00 -0.41 0.00 0.00 -2.01 0.00 0.00 31.31 28.89 1loo n TRP 41 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1loo n GLY 42 N -0.57 0.54 2.44 6.99 0.00 -1.26 -4.73 105.19 108.59 1loo n GLY 42 Ca 0.27 -1.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.18 1loo n GLY 42 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1loo n ASP 43 N -0.51 -5.78 0.10 1.61 8.00 -1.26 -4.86 116.55 113.85 1loo n ASP 43 Ca 0.00 0.09 -0.05 0.00 0.71 0.00 0.00 54.79 55.54 1loo n ASP 43 Cb 0.00 -4.85 0.02 0.00 -0.02 0.00 0.00 41.12 36.27 1loo n ASP 43 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1loo h GLU 44 N 0.00 0.04 0.00 -1.24 3.07 -1.93 -3.47 114.58 111.04 1loo h GLU 44 Ca -0.48 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.34 1loo h GLU 44 Cb 1.36 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.28 1loo h GLU 44 CO 0.59 0.84 0.00 0.41 -1.40 0.00 0.00 179.01 179.45 1loo n GLY 45 N 0.82 1.95 0.21 -3.84 0.00 -1.26 -4.44 105.19 98.63 1loo n GLY 45 Ca -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.95 1loo n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1loo h LYS 46 N 0.00 0.57 -0.96 1.61 1.57 -1.94 -2.56 116.57 114.87 1loo h LYS 46 Ca 0.00 -0.03 0.23 0.00 -1.87 0.00 0.00 60.65 58.98 1loo h LYS 46 Cb 0.00 -0.13 -0.07 0.00 0.08 0.00 0.00 32.23 32.11 1loo h LYS 46 CO 0.00 0.38 0.64 0.78 -0.57 0.00 0.00 179.45 180.67 1loo h GLY 47 N 0.59 0.84 1.28 3.86 0.00 -1.97 0.21 103.07 107.88 1loo h GLY 47 Ca 0.21 -0.16 -0.18 0.00 0.00 0.00 0.00 47.33 47.20 1loo h GLY 47 CO -0.11 -0.04 -0.56 1.70 0.00 0.00 0.00 176.54 177.54 1loo h LYS 48 N 0.34 0.76 -0.18 4.80 3.64 -1.88 -1.27 116.57 122.78 1loo h LYS 48 Ca 0.51 -0.48 -0.16 0.00 -1.27 0.00 0.00 60.65 59.24 1loo h LYS 48 Cb 1.37 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.25 1loo h LYS 48 CO -0.18 1.11 -0.56 0.28 -2.27 0.00 0.00 179.45 177.82 1loo h VAL 49 N 0.58 1.32 0.10 2.00 2.07 -0.74 -2.66 116.25 118.92 1loo h VAL 49 Ca 0.01 -1.81 -0.00 0.00 0.82 0.00 0.00 66.70 65.71 1loo h VAL 49 Cb 1.14 1.79 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 1loo h VAL 49 CO 0.12 0.56 -0.05 0.58 0.02 0.00 0.00 177.57 178.80 1loo h VAL 50 N 0.42 1.09 -0.95 2.57 2.07 -0.62 -2.56 116.25 118.28 1loo h VAL 50 Ca 0.01 -0.75 0.13 0.00 0.82 0.00 0.00 66.70 66.90 1loo h VAL 50 Cb 1.10 1.57 -0.08 0.00 -1.52 0.00 0.00 31.29 32.37 1loo h VAL 50 CO 0.10 0.18 0.60 0.44 0.02 0.00 0.00 177.57 178.92 1loo h ASP 51 N -0.48 0.79 -0.11 0.57 3.45 -1.27 0.54 116.42 119.91 1loo h ASP 51 Ca -0.01 0.04 -0.08 0.00 0.43 0.00 0.00 57.03 57.41 1loo h ASP 51 Cb 0.40 -0.11 -0.02 0.00 -0.56 0.00 0.00 39.33 39.04 1loo h ASP 51 CO 0.02 0.41 -0.17 0.25 -1.57 0.00 0.00 179.24 178.19 1loo h LEU 52 N 0.85 0.49 0.00 1.55 5.85 -1.41 -3.17 115.31 119.47 1loo h LEU 52 Ca 0.47 -0.14 -0.18 0.00 0.84 0.00 0.00 57.88 58.88 1loo h LEU 52 Cb 0.60 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1loo h LEU 52 CO -0.24 0.67 -1.39 -0.07 -0.34 0.00 0.00 178.44 177.08 1loo h LEU 53 N 0.45 0.00 -1.33 2.25 3.38 -0.62 -3.35 115.31 116.10 1loo h LEU 53 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1loo h LEU 53 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1loo h LEU 53 CO 0.04 0.62 0.00 0.00 0.09 0.00 0.00 178.44 179.18 1loo h ALA 54 N 1.38 1.00 0.08 1.53 0.00 0.02 -3.24 119.26 120.03 1loo h ALA 54 Ca -0.16 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1loo h ALA 54 Cb 1.61 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.36 1loo h ALA 54 CO 0.05 0.00 -0.40 1.15 0.00 0.00 0.00 179.25 180.05 1loo h THR 55 N 0.00 0.19 -0.62 0.00 2.02 -1.70 -3.11 112.91 109.69 1loo h THR 55 Ca 0.00 0.00 -0.27 0.00 0.77 0.00 0.00 66.41 66.91 1loo h THR 55 Cb 0.21 0.19 -0.16 0.00 -1.74 0.00 0.00 68.15 66.64 1loo h THR 55 CO 0.00 0.00 0.23 -0.90 0.37 0.00 0.00 175.52 175.22 1loo n ASP 56 N -5.45 3.58 -4.81 4.18 5.75 -1.22 -4.98 116.55 113.59 1loo n ASP 56 Ca -0.07 -3.51 -0.38 0.00 -0.01 0.00 0.00 54.79 50.83 1loo n ASP 56 Cb 0.37 -0.71 -0.06 0.00 -1.03 0.00 0.00 41.12 39.68 1loo n ASP 56 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1loo s ALA 57 N -3.16 3.67 0.11 2.12 0.00 -1.18 -4.86 121.76 118.46 1loo s ALA 57 Ca 0.51 -0.28 -0.05 0.00 0.00 0.00 0.00 51.96 52.13 1loo s ALA 57 Cb 0.43 -2.39 -0.16 0.00 0.00 0.00 0.00 23.12 21.00 1loo s ALA 57 CO 0.07 0.38 1.24 -0.44 0.00 0.00 0.00 175.76 177.01 1loo h ASP 58 N 5.26 0.54 -3.73 0.00 3.32 -0.64 -3.41 116.42 117.76 1loo h ASP 58 Ca -0.49 -0.47 -0.42 0.00 0.02 0.00 0.00 57.03 55.67 1loo h ASP 58 Cb 1.21 -0.17 -0.31 0.00 0.22 0.00 0.00 39.33 40.28 1loo h ASP 58 CO 0.65 1.30 -0.78 -0.63 -1.72 0.00 0.00 179.24 178.06 1loo s ILE 59 N -3.07 0.70 -0.12 0.35 1.01 -0.45 -0.57 121.20 119.05 1loo s ILE 59 Ca -0.06 -0.30 0.03 0.00 0.00 0.00 0.00 60.65 60.32 1loo s ILE 59 Cb 0.08 -0.64 0.01 0.00 0.01 0.00 0.00 42.46 41.92 1loo s ILE 59 CO 0.88 0.23 -0.20 -0.69 0.00 0.00 0.00 174.94 175.16 1loo s VAL 60 N 0.34 1.87 0.23 2.92 1.01 -0.23 0.05 120.40 126.59 1loo s VAL 60 Ca -0.05 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.05 1loo s VAL 60 Cb -0.10 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 1loo s VAL 60 CO 0.00 0.51 0.12 -0.94 0.00 0.00 0.00 175.10 174.80 1loo s SER 61 N 0.78 0.60 -0.07 3.32 1.04 0.54 -1.00 113.70 118.91 1loo s SER 61 Ca -0.09 -1.40 0.02 0.00 0.48 0.00 0.00 55.95 54.96 1loo s SER 61 Cb -0.16 0.30 0.02 0.00 0.10 0.00 0.00 66.02 66.28 1loo s SER 61 CO 0.00 -0.80 -0.11 -0.13 0.98 0.00 0.00 173.24 173.18 1loo s ARG 62 N -4.10 1.63 -0.03 4.02 0.52 -0.44 -1.35 118.95 119.20 1loo s ARG 62 Ca 0.39 -0.37 0.20 0.00 -0.52 0.00 0.00 55.73 55.43 1loo s ARG 62 Cb 0.07 -1.42 -0.31 0.00 0.52 0.00 0.00 34.95 33.81 1loo s ARG 62 CO 0.13 -0.03 0.44 0.00 0.02 0.00 0.00 175.30 175.86 1loo s GLN 64 N -3.39 0.10 -0.01 0.00 -1.52 -1.26 -3.26 119.66 110.32 1loo s GLN 64 Ca -0.07 0.22 -0.23 0.00 -1.95 0.00 0.00 55.36 53.32 1loo s GLN 64 Cb 0.13 -0.04 -0.19 0.00 -0.22 0.00 0.00 33.01 32.69 1loo s GLN 64 CO 0.84 -0.07 1.23 0.78 -0.25 0.00 0.00 175.29 177.81 1loo h GLY 65 N 6.47 0.20 0.00 3.09 0.00 -1.90 -3.41 103.07 107.52 1loo h GLY 65 Ca -0.32 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.77 1loo h GLY 65 CO 0.44 0.21 0.00 0.61 0.00 0.00 0.00 176.54 177.80 1loo n GLY 66 N 0.44 1.26 0.00 4.60 0.00 -1.26 -2.04 105.19 108.18 1loo n GLY 66 Ca -0.08 0.27 0.08 0.00 0.00 0.00 0.00 46.02 46.29 1loo n GLY 66 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1loo n ASN 67 N 10.59 0.85 -3.48 1.61 5.15 -1.26 -4.54 115.26 124.18 1loo n ASN 67 Ca 0.00 -0.70 -0.25 0.00 -0.60 0.00 0.00 54.58 53.03 1loo n ASN 67 Cb 0.00 1.16 0.03 0.00 -0.53 0.00 0.00 39.78 40.44 1loo n ASN 67 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1loo n ASN 68 N -1.53 -5.21 -4.71 1.20 5.03 -0.87 -4.93 115.26 104.25 1loo n ASN 68 Ca 0.02 -0.51 -0.33 0.00 0.87 0.00 0.00 54.58 54.63 1loo n ASN 68 Cb 0.29 -4.19 0.12 0.00 -1.02 0.00 0.00 39.78 34.98 1loo n ASN 68 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1loo s ALA 69 N -3.18 1.93 0.55 5.41 0.00 -1.26 -4.85 121.76 120.35 1loo s ALA 69 Ca 0.49 0.70 -0.11 0.00 0.00 0.00 0.00 51.96 53.03 1loo s ALA 69 Cb -0.24 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.40 1loo s ALA 69 CO 0.60 -2.14 0.95 0.20 0.00 0.00 0.00 175.76 175.37 1loo s GLY 70 N -2.44 1.77 -0.08 0.00 0.00 -1.26 -4.60 107.32 100.71 1loo s GLY 70 Ca 0.70 -0.10 -0.03 0.00 0.00 0.00 0.00 44.72 45.29 1loo s GLY 70 CO 0.51 0.15 0.16 -1.58 0.00 0.00 0.00 173.10 172.33 1loo s HIS 71 N -2.88 -0.18 -0.17 1.90 5.04 0.15 -4.98 115.29 114.16 1loo s HIS 71 Ca 0.54 0.58 -0.11 0.00 -1.54 0.00 0.00 55.06 54.53 1loo s HIS 71 Cb -0.11 -0.20 -0.05 0.00 0.04 0.00 0.00 32.58 32.27 1loo s HIS 71 CO 0.44 -0.24 0.19 0.99 -2.34 0.00 0.00 174.74 173.79 1loo s THR 72 N 1.94 5.37 -0.03 0.89 2.01 -1.26 -0.92 115.64 123.65 1loo s THR 72 Ca -0.01 0.33 0.03 0.00 0.31 0.00 0.00 61.69 62.35 1loo s THR 72 Cb -0.12 -3.52 0.00 0.00 0.01 0.00 0.00 72.50 68.87 1loo s THR 72 CO -0.06 0.44 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.52 1loo s VAL 73 N 0.22 0.93 -0.17 3.82 1.01 -0.68 -4.97 120.40 120.57 1loo s VAL 73 Ca 0.12 -0.44 -0.00 0.00 0.00 0.00 0.00 61.98 61.65 1loo s VAL 73 Cb -0.12 -0.82 -0.00 0.00 0.00 0.00 0.00 36.38 35.44 1loo s VAL 73 CO 0.01 0.28 -0.14 0.68 0.00 0.00 0.00 175.10 175.94 1loo s VAL 74 N 0.16 2.74 -0.01 2.92 -7.23 -1.26 -0.19 120.40 117.53 1loo s VAL 74 Ca -0.03 -0.74 -0.00 0.00 -1.81 0.00 0.00 61.98 59.40 1loo s VAL 74 Cb -0.09 -2.17 0.01 0.00 0.56 0.00 0.00 36.38 34.69 1loo s VAL 74 CO 0.01 0.50 0.02 0.68 -0.31 0.00 0.00 175.10 176.00 1loo s VAL 75 N 0.94 -0.03 -0.31 1.32 -7.23 -0.46 -4.89 120.40 109.75 1loo s VAL 75 Ca -0.03 0.11 0.00 0.00 -1.81 0.00 0.00 61.98 60.25 1loo s VAL 75 Cb -0.15 -0.05 0.00 0.00 0.56 0.00 0.00 36.38 36.74 1loo s VAL 75 CO -0.02 0.04 0.00 0.47 -0.31 0.00 0.00 175.10 175.29 1loo n ASP 76 N 3.62 -1.84 0.00 4.85 8.00 -1.26 -0.39 116.55 129.53 1loo n ASP 76 Ca -0.20 0.41 0.00 0.00 0.71 0.00 0.00 54.79 55.71 1loo n ASP 76 Cb 0.55 -1.67 0.00 0.00 -0.02 0.00 0.00 41.12 39.98 1loo n ASP 76 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1loo n GLY 77 N -0.58 0.78 3.14 0.44 0.00 -1.26 -5.08 105.19 102.63 1loo n GLY 77 Ca -0.04 -0.32 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 1loo n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1loo s LYS 78 N -0.71 1.34 -0.21 1.61 3.01 0.47 -5.13 119.74 120.12 1loo s LYS 78 Ca 0.00 -0.58 -0.06 0.00 -1.01 0.00 0.00 55.97 54.32 1loo s LYS 78 Cb 0.00 -1.29 -0.03 0.00 -1.01 0.00 0.00 37.83 35.50 1loo s LYS 78 CO 0.00 0.35 0.03 -2.00 0.51 0.00 0.00 175.35 174.24 1loo s GLU 79 N -0.36 3.67 0.15 1.68 2.12 -1.26 -1.35 118.70 123.35 1loo s GLU 79 Ca 0.06 -0.49 0.07 0.00 0.36 0.00 0.00 54.97 54.97 1loo s GLU 79 Cb -0.07 -3.17 -0.04 0.00 0.26 0.00 0.00 34.13 31.11 1loo s GLU 79 CO -0.00 -0.02 0.00 0.71 -0.54 0.00 0.00 175.26 175.41 1loo s TYR 80 N 1.12 2.89 -0.22 5.30 2.02 0.73 -4.96 117.35 124.23 1loo s TYR 80 Ca 0.03 -0.11 -0.00 0.00 -0.37 0.00 0.00 57.07 56.62 1loo s TYR 80 Cb -0.14 -1.42 0.06 0.00 -0.40 0.00 0.00 41.96 40.05 1loo s TYR 80 CO 0.02 0.50 -0.03 0.34 -1.57 0.00 0.00 175.55 174.81 1loo s ASP 81 N -2.79 3.57 0.00 2.29 3.68 -1.26 -1.68 116.67 120.49 1loo s ASP 81 Ca 0.27 -1.06 0.03 0.00 2.13 0.00 0.00 52.55 53.92 1loo s ASP 81 Cb -0.10 -1.03 -0.03 0.00 -1.45 0.00 0.00 42.92 40.31 1loo s ASP 81 CO 0.19 -0.25 -0.07 -0.36 0.13 0.00 0.00 175.17 174.80 1loo s PHE 82 N 1.52 2.87 0.14 -5.34 0.08 -0.10 -4.85 117.98 112.30 1loo s PHE 82 Ca -0.04 -0.05 0.00 0.00 0.12 0.00 0.00 56.93 56.96 1loo s PHE 82 Cb -0.18 -1.60 0.00 0.00 -0.57 0.00 0.00 43.02 40.67 1loo s PHE 82 CO -0.07 0.37 0.00 0.72 -0.10 0.00 0.00 175.22 176.14 1loo n HIS 83 N 1.56 -0.79 -0.04 0.36 8.25 -1.26 -0.68 115.22 122.62 1loo n HIS 83 Ca -0.15 0.14 -0.07 0.00 -0.26 0.00 0.00 57.72 57.38 1loo n HIS 83 Cb 0.52 0.22 -0.14 0.00 1.12 0.00 0.00 29.99 31.71 1loo n HIS 83 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1loo n LEU 84 N -3.36 0.51 -4.72 2.41 4.77 -1.26 -4.69 117.00 110.66 1loo n LEU 84 Ca 0.00 0.24 -0.41 0.00 -0.03 0.00 0.00 56.01 55.80 1loo n LEU 84 Cb 0.06 0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 41.38 1loo n LEU 84 CO 0.00 0.37 0.74 -0.76 -1.33 0.00 0.00 177.39 176.40 1loo s LEU 85 N -5.74 4.44 0.50 2.23 1.43 -1.26 -4.98 118.68 115.30 1loo s LEU 85 Ca -0.06 1.86 -0.23 0.00 -1.03 0.00 0.00 54.13 54.67 1loo s LEU 85 Cb 0.08 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.65 1loo s LEU 85 CO 0.83 -0.23 1.34 -2.84 0.23 0.00 0.00 176.35 175.68 1loo s PRO 86 N 0.39 3.44 0.32 1.29 0.02 -1.26 -4.80 135.00 134.40 1loo s PRO 86 Ca 0.51 2.20 0.02 0.00 0.02 0.00 0.00 61.00 63.75 1loo s PRO 86 Cb -0.25 -2.42 0.60 0.00 0.02 0.00 0.00 34.50 32.45 1loo s PRO 86 CO 0.30 -0.94 1.93 0.66 -0.33 0.00 0.00 177.00 178.62 1loo h SER 87 N 1.87 0.82 0.02 2.53 4.64 -1.94 -1.92 113.55 119.57 1loo h SER 87 Ca -0.50 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1loo h SER 87 Cb 1.28 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1loo h SER 87 CO 0.59 0.53 0.00 0.61 -0.87 0.00 0.00 176.83 177.69 1loo n GLY 88 N -1.41 -0.20 0.01 -0.77 0.00 -1.26 -2.28 105.19 99.28 1loo n GLY 88 Ca 0.13 -0.01 0.04 0.00 0.00 0.00 0.00 46.02 46.18 1loo n GLY 88 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1loo n ILE 89 N -1.14 1.46 -0.02 -0.61 3.06 -0.72 -1.11 119.36 120.29 1loo n ILE 89 Ca 0.01 0.39 -0.04 0.00 -2.50 0.00 0.00 62.75 60.61 1loo n ILE 89 Cb 0.01 -1.27 0.18 0.00 0.54 0.00 0.00 39.64 39.10 1loo n ILE 89 CO 0.00 0.00 0.00 0.40 -2.50 0.00 0.00 176.55 174.45 1loo h ILE 90 N 0.00 1.26 -3.07 9.51 1.08 -1.71 -3.40 117.51 121.18 1loo h ILE 90 Ca 0.00 -1.23 -0.57 0.00 -0.39 0.00 0.00 64.86 62.67 1loo h ILE 90 Cb 0.13 1.26 -0.04 0.00 -3.07 0.00 0.00 36.82 35.09 1loo h ILE 90 CO 0.00 0.40 1.06 0.21 -0.69 0.00 0.00 178.15 179.13 1loo s ASN 91 N -6.78 6.44 0.03 1.72 3.84 -0.26 -4.86 114.94 115.07 1loo s ASN 91 Ca -0.08 1.19 0.22 0.00 0.21 0.00 0.00 52.86 54.40 1loo s ASN 91 Cb 0.14 -2.54 0.93 0.00 -0.55 0.00 0.00 41.25 39.23 1loo s ASN 91 CO 0.80 -1.28 1.70 0.35 -2.79 0.00 0.00 177.10 175.89 1loo n THR 92 N 6.61 0.52 0.87 -5.21 -2.24 -1.26 -2.59 114.28 110.98 1loo n THR 92 Ca 0.17 0.11 0.12 0.00 -2.27 0.00 0.00 64.05 62.17 1loo n THR 92 Cb 0.47 -0.76 0.24 0.00 -2.10 0.00 0.00 70.33 68.18 1loo n THR 92 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1loo n LYS 93 N -1.59 2.20 -4.52 -0.78 5.02 -1.26 -4.95 118.16 112.29 1loo n LYS 93 Ca 0.05 -1.78 -0.25 0.00 -2.02 0.00 0.00 58.31 54.31 1loo n LYS 93 Cb 0.26 -1.47 -0.10 0.00 -0.02 0.00 0.00 35.03 33.70 1loo n LYS 93 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1loo s ALA 94 N -1.79 2.88 -0.18 7.82 0.00 -1.07 -4.88 121.76 124.53 1loo s ALA 94 Ca 0.34 -2.02 -0.09 0.00 0.00 0.00 0.00 51.96 50.19 1loo s ALA 94 Cb 0.21 -0.10 -0.05 0.00 0.00 0.00 0.00 23.12 23.18 1loo s ALA 94 CO 0.31 0.14 0.10 0.08 0.00 0.00 0.00 175.76 176.38 1loo s VAL 95 N -2.59 5.17 -0.16 0.00 1.01 0.27 -4.88 120.40 119.21 1loo s VAL 95 Ca 0.32 0.10 -0.12 0.00 0.00 0.00 0.00 61.98 62.28 1loo s VAL 95 Cb 0.00 -3.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.00 1loo s VAL 95 CO 0.16 0.47 0.23 -0.44 0.00 0.00 0.00 175.10 175.52 1loo s SER 96 N 0.19 6.37 -0.06 3.32 0.01 0.24 -1.07 113.70 122.70 1loo s SER 96 Ca 0.07 0.43 0.01 0.00 1.31 0.00 0.00 55.95 57.77 1loo s SER 96 Cb -0.12 -2.15 0.02 0.00 0.21 0.00 0.00 66.02 63.99 1loo s SER 96 CO -0.01 0.16 -0.07 0.12 0.41 0.00 0.00 173.24 173.85 1loo s PHE 97 N 0.27 1.02 -0.34 2.43 5.36 -0.17 0.88 117.98 127.43 1loo s PHE 97 Ca 0.14 -0.35 -0.10 0.00 -0.96 0.00 0.00 56.93 55.66 1loo s PHE 97 Cb -0.12 -0.84 0.01 0.00 -0.34 0.00 0.00 43.02 41.72 1loo s PHE 97 CO 0.02 -0.25 0.17 0.42 -1.46 0.00 0.00 175.22 174.12 1loo s ILE 98 N 0.96 4.58 1.05 3.12 -1.09 -0.64 -1.33 121.20 127.85 1loo s ILE 98 Ca -0.10 -0.60 -0.14 0.00 -2.23 0.00 0.00 60.65 57.58 1loo s ILE 98 Cb -0.15 -3.42 0.21 0.00 -1.58 0.00 0.00 42.46 37.53 1loo s ILE 98 CO 0.00 -0.05 1.11 -0.83 -1.23 0.00 0.00 174.94 173.94 1loo s GLY 99 N 1.59 1.57 0.43 6.18 0.00 0.55 -1.76 107.32 115.88 1loo s GLY 99 Ca 0.03 -0.56 0.30 0.00 0.00 0.00 0.00 44.72 44.49 1loo s GLY 99 CO 0.06 0.12 1.90 3.45 0.00 0.00 0.00 173.10 178.64 1loo h ASN 100 N -2.05 0.00 0.50 1.64 -1.07 -1.47 -2.87 115.58 110.26 1loo h ASN 100 Ca -0.52 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.85 1loo h ASN 100 Cb 1.32 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.57 1loo h ASN 100 CO 0.52 0.00 -0.10 0.61 0.07 0.00 0.00 177.43 178.53 1loo n GLY 101 N -0.56 -1.12 3.74 9.14 0.00 -0.79 -4.08 105.19 111.53 1loo n GLY 101 Ca -0.00 -0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 1loo n GLY 101 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1loo s VAL 102 N -2.60 5.15 0.01 1.61 1.01 -1.08 -3.69 120.40 120.82 1loo s VAL 102 Ca 0.26 0.94 -0.20 0.00 0.00 0.00 0.00 61.98 62.98 1loo s VAL 102 Cb 0.20 -3.80 -0.06 0.00 0.00 0.00 0.00 36.38 32.72 1loo s VAL 102 CO 0.49 0.36 0.59 0.68 0.00 0.00 0.00 175.10 177.23 1loo s VAL 103 N 0.36 4.89 -0.07 2.92 -7.23 -1.26 -3.74 120.40 116.26 1loo s VAL 103 Ca 0.26 1.24 0.05 0.00 -1.81 0.00 0.00 61.98 61.71 1loo s VAL 103 Cb -0.15 -3.92 -0.00 0.00 0.56 0.00 0.00 36.38 32.86 1loo s VAL 103 CO 0.11 0.44 -0.23 -0.63 -0.31 0.00 0.00 175.10 174.48 1loo s ILE 104 N -0.33 1.89 -0.39 -0.62 1.01 -0.02 -4.87 121.20 117.88 1loo s ILE 104 Ca 0.31 -0.95 -0.12 0.00 0.00 0.00 0.00 60.65 59.88 1loo s ILE 104 Cb -0.18 -1.62 0.04 0.00 0.01 0.00 0.00 42.46 40.70 1loo s ILE 104 CO 0.17 0.53 0.24 -2.28 0.00 0.00 0.00 174.94 173.60 1loo s HIS 105 N 0.08 3.25 0.11 3.97 5.65 -1.26 0.11 115.29 127.20 1loo s HIS 105 Ca -0.09 -0.97 -0.31 0.00 0.25 0.00 0.00 55.06 53.94 1loo s HIS 105 Cb -0.15 -2.57 -0.11 0.00 -1.18 0.00 0.00 32.58 28.57 1loo s HIS 105 CO 0.05 -0.68 1.51 -0.07 -0.65 0.00 0.00 174.74 174.90 1loo h LEU 106 N 8.49 -1.63 -0.27 8.88 -0.00 -1.99 -0.12 115.31 128.67 1loo h LEU 106 Ca -0.25 0.20 0.06 0.00 -0.00 0.00 0.00 57.88 57.88 1loo h LEU 106 Cb 1.10 0.65 -0.06 0.00 -0.00 0.00 0.00 40.66 42.35 1loo h LEU 106 CO 0.70 -0.42 -0.12 1.55 -0.00 0.00 0.00 178.44 180.15 1loo h PRO 107 N -0.49 -0.07 -0.99 1.13 0.13 -1.95 -0.91 132.00 128.86 1loo h PRO 107 Ca 0.04 0.01 0.18 0.00 -0.87 0.00 0.00 66.00 65.36 1loo h PRO 107 Cb 0.60 0.02 -0.10 0.00 0.13 0.00 0.00 31.00 31.65 1loo h PRO 107 CO -0.45 -0.05 0.59 0.78 -0.23 0.00 0.00 178.00 178.64 1loo h GLY 108 N -0.08 1.73 0.86 1.56 0.00 -1.88 0.64 103.07 105.91 1loo h GLY 108 Ca 0.14 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 1loo h GLY 108 CO -0.32 -0.05 -0.31 -2.00 0.00 0.00 0.00 176.54 173.86 1loo h LEU 109 N 0.76 -0.73 -1.18 3.11 5.85 0.29 0.20 115.31 123.60 1loo h LEU 109 Ca 0.56 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 59.21 1loo h LEU 109 Cb 0.85 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.05 1loo h LEU 109 CO -0.38 -0.43 -0.02 -0.26 -0.34 0.00 0.00 178.44 177.01 1loo h PHE 110 N -1.02 0.56 -0.50 1.25 0.04 -0.83 0.35 116.94 116.79 1loo h PHE 110 Ca -0.09 -0.06 -0.03 0.00 2.80 0.00 0.00 57.97 60.59 1loo h PHE 110 Cb 0.70 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.67 1loo h PHE 110 CO -0.01 0.56 0.19 1.49 -0.60 0.00 0.00 178.31 179.94 1loo h GLU 111 N 0.51 0.72 0.04 1.51 4.81 0.38 0.30 114.58 122.85 1loo h GLU 111 Ca 0.11 -0.11 -0.25 0.00 -0.13 0.00 0.00 59.36 58.98 1loo h GLU 111 Cb 0.36 -0.13 0.02 0.00 0.63 0.00 0.00 28.75 29.64 1loo h GLU 111 CO 0.01 0.61 -1.00 1.49 -0.73 0.00 0.00 179.01 179.39 1loo h GLU 112 N 0.71 0.60 -0.25 1.92 4.81 0.21 -2.60 114.58 119.99 1loo h GLU 112 Ca 0.17 -0.70 -0.01 0.00 -0.13 0.00 0.00 59.36 58.69 1loo h GLU 112 Cb 0.16 0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1loo h GLU 112 CO -0.01 1.29 0.12 0.00 -0.73 0.00 0.00 179.01 179.68 1loo h ALA 113 N 0.33 0.32 -0.55 2.92 0.00 0.10 -2.68 119.26 119.69 1loo h ALA 113 Ca -0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1loo h ALA 113 Cb 1.68 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.34 1loo h ALA 113 CO 0.19 -0.13 0.24 0.93 0.00 0.00 0.00 179.25 180.48 1loo h GLU 114 N 0.27 0.81 0.04 0.00 5.08 -0.50 -0.90 114.58 119.39 1loo h GLU 114 Ca 0.09 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1loo h GLU 114 Cb 0.10 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1loo h GLU 114 CO -0.01 0.69 -0.12 -0.22 -1.00 0.00 0.00 179.01 178.35 1loo h LYS 115 N 0.75 -0.22 -0.17 2.33 3.11 -1.37 -1.86 116.57 119.14 1loo h LYS 115 Ca 0.19 0.02 -0.11 0.00 -2.81 0.00 0.00 60.65 57.93 1loo h LYS 115 Cb 0.17 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.44 1loo h LYS 115 CO -0.02 -0.15 -0.37 -0.91 -2.81 0.00 0.00 179.45 175.19 1loo h ASN 116 N -0.23 0.38 -0.43 4.20 2.35 -1.44 -3.12 115.58 117.29 1loo h ASN 116 Ca 0.03 -0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.62 1loo h ASN 116 Cb 0.26 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1loo h ASN 116 CO -0.09 0.73 0.26 -0.08 -1.65 0.00 0.00 177.43 176.59 1loo h GLU 117 N 0.31 0.58 -0.09 0.81 4.81 -0.86 -1.06 114.58 119.07 1loo h GLU 117 Ca 0.03 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1loo h GLU 117 Cb 0.80 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.06 1loo h GLU 117 CO 0.06 0.43 0.00 1.63 -0.73 0.00 0.00 179.01 180.40 1loo n LYS 118 N -4.75 0.65 0.00 1.92 5.02 -0.72 -1.85 118.16 118.43 1loo n LYS 118 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1loo n LYS 118 Cb 0.05 -1.05 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 1loo n LYS 118 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1loo n LYS 119 N -0.40 1.42 0.00 1.97 5.02 -0.46 -5.01 118.16 120.69 1loo n LYS 119 Ca 0.00 -0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.05 1loo n LYS 119 Cb 0.02 -0.69 0.00 0.00 -0.02 0.00 0.00 35.03 34.34 1loo n LYS 119 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1loo n GLY 120 N 0.27 3.77 3.55 0.72 0.00 -0.77 -4.81 105.19 107.92 1loo n GLY 120 Ca 0.00 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 1loo n GLY 120 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1loo n LEU 121 N 0.00 2.57 -4.38 0.99 7.94 -0.84 -4.94 117.00 118.34 1loo n LEU 121 Ca 0.00 -0.06 -0.30 0.00 -1.11 0.00 0.00 56.01 54.55 1loo n LEU 121 Cb 0.00 -1.49 -0.14 0.00 0.53 0.00 0.00 43.42 42.32 1loo n LEU 121 CO 0.00 -1.05 -0.56 -0.75 -1.11 0.00 0.00 177.39 173.92 1loo s LYS 122 N 7.25 1.64 -1.69 1.96 2.36 -1.26 -3.89 119.74 126.11 1loo s LYS 122 Ca 1.03 -1.21 0.00 0.00 -2.55 0.00 0.00 55.97 53.24 1loo s LYS 122 Cb -0.39 -1.96 0.00 0.00 -1.05 0.00 0.00 37.83 34.42 1loo s LYS 122 CO 0.34 0.48 0.00 -0.25 1.55 0.00 0.00 175.35 177.48 1loo n ASP 123 N 1.33 -5.34 -0.21 1.43 10.43 -1.26 -4.88 116.55 118.04 1loo n ASP 123 Ca -0.17 0.11 -0.07 0.00 2.57 0.00 0.00 54.79 57.22 1loo n ASP 123 Cb 0.52 -4.42 0.06 0.00 1.84 0.00 0.00 41.12 39.13 1loo n ASP 123 CO 0.00 0.00 0.00 4.11 -1.07 0.00 0.00 177.20 180.24 1loo h TRP 124 N 0.00 1.13 0.00 1.24 5.08 -1.96 -2.07 115.95 119.37 1loo h TRP 124 Ca -0.43 -0.16 0.00 0.00 1.08 0.00 0.00 58.89 59.38 1loo h TRP 124 Cb 1.30 -0.31 0.00 0.00 -3.00 0.00 0.00 29.16 27.15 1loo h TRP 124 CO 0.50 0.96 0.00 -0.85 -1.28 0.00 0.00 178.44 177.77 1loo n GLU 125 N -4.21 0.06 -0.00 0.12 0.00 -1.26 -0.84 120.64 114.51 1loo n GLU 125 Ca 0.04 0.11 0.06 0.00 0.00 0.00 0.00 57.16 57.36 1loo n GLU 125 Cb 0.30 -1.50 -0.07 0.00 0.00 0.00 0.00 31.44 30.17 1loo n GLU 125 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1loo n LYS 126 N -1.12 2.94 0.00 3.44 5.02 -0.78 -4.48 118.16 123.18 1loo n LYS 126 Ca 0.02 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1loo n LYS 126 Cb 0.01 -1.08 0.00 0.00 -0.02 0.00 0.00 35.03 33.94 1loo n LYS 126 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1loo n ARG 127 N -1.29 2.85 -4.26 1.97 1.85 -0.02 -5.01 116.66 112.75 1loo n ARG 127 Ca 0.02 -1.45 -0.34 0.00 -1.00 0.00 0.00 57.85 55.08 1loo n ARG 127 Cb 0.19 -0.98 -0.13 0.00 -1.05 0.00 0.00 32.46 30.49 1loo n ARG 127 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1loo s LEU 128 N -0.95 3.01 0.04 2.89 2.96 -0.88 0.80 118.68 126.56 1loo s LEU 128 Ca 0.00 -0.28 0.08 0.00 -0.22 0.00 0.00 54.13 53.72 1loo s LEU 128 Cb 0.00 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.92 1loo s LEU 128 CO 0.00 0.08 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.26 1loo s ILE 129 N 0.86 2.42 -0.08 6.68 1.01 0.25 -4.74 121.20 127.60 1loo s ILE 129 Ca -0.01 -1.31 -0.00 0.00 0.00 0.00 0.00 60.65 59.32 1loo s ILE 129 Cb -0.15 -1.98 0.02 0.00 0.01 0.00 0.00 42.46 40.37 1loo s ILE 129 CO 0.01 0.35 -0.05 -0.63 0.00 0.00 0.00 174.94 174.62 1loo s ILE 130 N -0.86 0.73 0.26 2.92 1.01 -0.29 -1.62 121.20 123.36 1loo s ILE 130 Ca 0.13 -0.14 -0.31 0.00 0.00 0.00 0.00 60.65 60.34 1loo s ILE 130 Cb -0.10 -0.79 -0.11 0.00 0.01 0.00 0.00 42.46 41.46 1loo s ILE 130 CO 0.03 0.31 1.63 -0.55 0.00 0.00 0.00 174.94 176.36 1loo s SER 131 N 1.58 6.39 0.00 3.58 0.15 -0.72 -2.04 113.70 122.64 1loo s SER 131 Ca 0.01 2.91 0.26 0.00 0.70 0.00 0.00 55.95 59.83 1loo s SER 131 Cb -0.13 -2.62 1.44 0.00 -1.71 0.00 0.00 66.02 63.00 1loo s SER 131 CO -0.05 -0.92 1.90 -0.90 1.20 0.00 0.00 173.24 174.47 1loo n ASP 132 N 2.73 0.00 -0.70 5.45 5.75 -0.32 -2.79 116.55 126.67 1loo n ASP 132 Ca 0.10 -0.45 0.12 0.00 -0.01 0.00 0.00 54.79 54.56 1loo n ASP 132 Cb 0.37 -0.15 0.35 0.00 -1.03 0.00 0.00 41.12 40.66 1loo n ASP 132 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1loo n ARG 133 N -1.15 1.95 -2.27 0.11 1.74 -1.26 -0.99 116.66 114.79 1loo n ARG 133 Ca 0.16 -1.40 -0.41 0.00 -0.77 0.00 0.00 57.85 55.43 1loo n ARG 133 Cb 0.15 -1.46 -0.03 0.00 -1.02 0.00 0.00 32.46 30.10 1loo n ARG 133 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1loo s ALA 134 N -1.88 3.49 0.57 7.54 0.00 -1.12 -4.84 121.76 125.52 1loo s ALA 134 Ca 0.34 1.06 -0.16 0.00 0.00 0.00 0.00 51.96 53.20 1loo s ALA 134 Cb 0.20 -3.45 -0.05 0.00 0.00 0.00 0.00 23.12 19.82 1loo s ALA 134 CO 0.31 -0.47 1.04 -1.01 0.00 0.00 0.00 175.76 175.62 1loo s HIS 135 N -0.10 3.10 -0.17 0.00 3.76 -1.25 -1.66 115.29 118.97 1loo s HIS 135 Ca 0.54 1.50 -0.06 0.00 -0.15 0.00 0.00 55.06 56.89 1loo s HIS 135 Cb -0.35 -2.96 -0.04 0.00 1.11 0.00 0.00 32.58 30.34 1loo s HIS 135 CO 0.39 -0.93 0.03 -0.51 -0.85 0.00 0.00 174.74 172.87 1loo s LEU 136 N -4.36 3.67 -0.51 0.89 1.43 0.02 -0.84 118.68 118.98 1loo s LEU 136 Ca 0.63 0.04 -0.20 0.00 -1.03 0.00 0.00 54.13 53.56 1loo s LEU 136 Cb -0.15 -1.91 0.05 0.00 0.03 0.00 0.00 46.19 44.21 1loo s LEU 136 CO 0.35 0.19 0.70 -0.69 0.23 0.00 0.00 176.35 177.13 1loo s VAL 137 N 0.27 4.76 0.81 -1.59 1.01 0.29 -4.69 120.40 121.26 1loo s VAL 137 Ca 0.02 -0.30 -0.12 0.00 0.00 0.00 0.00 61.98 61.58 1loo s VAL 137 Cb -0.13 -4.35 0.09 0.00 0.00 0.00 0.00 36.38 31.99 1loo s VAL 137 CO 0.01 -0.87 1.18 -0.36 0.00 0.00 0.00 175.10 175.06 1loo s PHE 138 N 2.94 2.85 0.23 5.22 0.08 -1.26 -4.29 117.98 123.75 1loo s PHE 138 Ca 0.19 0.70 -0.07 0.00 0.12 0.00 0.00 56.93 57.87 1loo s PHE 138 Cb -0.17 -3.52 0.20 0.00 -0.57 0.00 0.00 43.02 38.95 1loo s PHE 138 CO 0.14 -1.82 1.79 -0.44 -0.10 0.00 0.00 175.22 174.79 1loo h ASP 139 N -1.07 1.06 0.69 1.36 3.32 -2.00 -2.65 116.42 117.13 1loo h ASP 139 Ca -0.46 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 56.40 1loo h ASP 139 Cb 1.32 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.59 1loo h ASP 139 CO 0.64 0.94 -0.11 2.19 -1.72 0.00 0.00 179.24 181.18 1loo h PHE 140 N 1.12 0.00 -0.01 4.55 -0.00 -1.94 -2.44 116.94 118.22 1loo h PHE 140 Ca 0.26 0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 58.23 1loo h PHE 140 Cb 0.22 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.17 1loo h PHE 140 CO 0.02 0.11 0.00 0.45 -0.00 0.00 0.00 178.31 178.89 1loo h HIS 141 N 0.00 0.01 -0.39 6.09 3.86 -1.83 0.28 115.15 123.17 1loo h HIS 141 Ca -0.00 -0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.22 1loo h HIS 141 Cb 0.48 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 1loo h HIS 141 CO 0.00 0.17 0.26 1.96 0.86 0.00 0.00 177.93 181.18 1loo h GLN 142 N -0.16 0.46 -0.07 2.45 4.20 -1.48 -0.80 115.11 119.72 1loo h GLN 142 Ca 0.00 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 1loo h GLN 142 Cb 0.17 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1loo h GLN 142 CO -0.00 0.30 -0.15 0.00 -0.67 0.00 0.00 178.83 178.31 1loo h ALA 143 N 1.77 0.11 0.00 3.87 0.00 -0.96 0.44 119.26 124.48 1loo h ALA 143 Ca 0.15 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1loo h ALA 143 Cb 0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1loo h ALA 143 CO -0.03 0.02 -0.05 0.28 0.00 0.00 0.00 179.25 179.46 1loo h VAL 144 N -0.27 0.66 0.01 0.00 2.07 -0.02 -0.82 116.25 117.87 1loo h VAL 144 Ca 0.00 -0.22 -0.24 0.00 0.82 0.00 0.00 66.70 67.06 1loo h VAL 144 Cb 0.74 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 1loo h VAL 144 CO 0.03 0.05 -1.23 -0.78 0.02 0.00 0.00 177.57 175.67 1loo h ASP 145 N 0.00 0.04 0.78 0.57 3.58 -0.98 -2.61 116.42 117.80 1loo h ASP 145 Ca -0.00 -0.06 -0.11 0.00 0.42 0.00 0.00 57.03 57.28 1loo h ASP 145 Cb 0.13 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.15 1loo h ASP 145 CO 0.01 1.05 -0.53 1.23 -2.88 0.00 0.00 179.24 178.12 1loo h GLY 146 N 2.98 0.00 0.73 -0.78 0.00 0.49 -3.21 103.07 103.29 1loo h GLY 146 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.88 1loo h GLY 146 CO 0.12 0.00 -1.90 1.04 0.00 0.00 0.00 176.54 175.80 1loo n LEU 147 N -3.64 2.12 -0.19 3.11 4.32 -0.74 -3.57 117.00 118.42 1loo n LEU 147 Ca -0.01 0.28 0.15 0.00 -0.02 0.00 0.00 56.01 56.41 1loo n LEU 147 Cb 0.59 -0.75 0.49 0.00 -1.62 0.00 0.00 43.42 42.13 1loo n LEU 147 CO 0.40 0.72 1.21 1.56 -1.22 0.00 0.00 177.39 180.06 1loo h GLN 148 N 0.05 0.44 -0.00 3.23 4.20 -1.52 0.27 115.11 121.78 1loo h GLN 148 Ca -0.38 -0.03 -0.20 0.00 0.06 0.00 0.00 58.65 58.10 1loo h GLN 148 Cb 2.03 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 29.70 1loo h GLN 148 CO 0.09 0.29 -0.87 1.49 -0.67 0.00 0.00 178.83 179.16 1loo h GLU 149 N 0.46 0.23 -1.92 1.46 4.57 -1.69 0.60 114.58 118.29 1loo h GLU 149 Ca 0.39 -0.25 -0.34 0.00 -1.18 0.00 0.00 59.36 57.98 1loo h GLU 149 Cb 0.86 0.07 -0.13 0.00 -0.16 0.00 0.00 28.75 29.39 1loo h GLU 149 CO -0.14 0.97 0.14 0.28 -1.18 0.00 0.00 179.01 179.08 1loo n VAL 150 N -3.68 3.03 0.00 0.32 0.31 0.93 -2.55 118.33 116.69 1loo n VAL 150 Ca -0.04 -2.13 0.00 0.00 -0.01 0.00 0.00 64.34 62.16 1loo n VAL 150 Cb 0.80 -1.66 0.00 0.00 -0.91 0.00 0.00 33.84 32.07 1loo n VAL 150 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1loo n GLN 151 N 1.31 0.00 -0.11 5.55 7.27 -1.15 -4.80 117.38 125.44 1loo n GLN 151 Ca 0.40 0.00 -0.13 0.00 0.07 0.00 0.00 57.00 57.35 1loo n GLN 151 Cb 0.66 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 33.30 1loo n GLN 151 CO 0.00 0.00 0.00 -0.09 0.07 0.00 0.00 177.06 177.04 1loo h ARG 152 N 0.00 0.92 -0.44 3.69 1.12 -0.90 -3.38 114.38 115.38 1loo h ARG 152 Ca 0.00 -0.47 -0.25 0.00 -1.11 0.00 0.00 59.98 58.14 1loo h ARG 152 Cb 0.00 0.01 -0.33 0.00 -0.01 0.00 0.00 29.97 29.64 1loo h ARG 152 CO 0.00 1.13 -0.90 0.00 -3.11 0.00 0.00 179.97 177.09 1loo n GLN 153 N -4.06 1.47 0.00 0.20 -0.00 -1.06 -3.89 117.38 110.05 1loo n GLN 153 Ca -0.02 -2.84 0.06 0.00 -0.00 0.00 0.00 57.00 54.20 1loo n GLN 153 Cb 0.54 -0.98 -0.01 0.00 -0.00 0.00 0.00 30.24 29.79 1loo n GLN 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1loo n ALA 154 N -0.65 3.04 -3.17 2.61 0.00 -1.20 -4.34 120.51 116.80 1loo n ALA 154 Ca 0.02 -0.47 -0.22 0.00 0.00 0.00 0.00 53.44 52.77 1loo n ALA 154 Cb 0.82 -0.44 -0.05 0.00 0.00 0.00 0.00 19.45 19.78 1loo n ALA 154 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1loo n GLN 155 N -0.30 0.77 -2.42 0.00 0.00 -1.26 -4.90 117.38 109.27 1loo n GLN 155 Ca 0.05 -3.17 -0.12 0.00 -0.00 0.00 0.00 57.00 53.76 1loo n GLN 155 Cb 0.26 -1.33 0.01 0.00 0.00 0.00 0.00 30.24 29.18 1loo n GLN 155 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1loo n GLU 156 N 1.17 -1.72 -3.57 3.69 -0.58 -1.26 -5.03 120.64 113.34 1loo n GLU 156 Ca 0.21 0.52 -0.20 0.00 -0.42 0.00 0.00 57.16 57.27 1loo n GLU 156 Cb 0.56 -4.59 -0.01 0.00 -0.57 0.00 0.00 31.44 26.84 1loo n GLU 156 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1loo s GLY 157 N -2.65 1.45 0.36 0.62 0.00 -1.26 -5.03 107.32 100.80 1loo s GLY 157 Ca 0.08 -1.31 -0.25 0.00 0.00 0.00 0.00 44.72 43.24 1loo s GLY 157 CO 0.09 -1.25 1.00 0.54 0.00 0.00 0.00 173.10 173.49 1loo s LYS 158 N -4.16 4.39 0.66 2.90 1.02 -1.25 -4.64 119.74 118.65 1loo s LYS 158 Ca 0.42 1.42 -0.03 0.00 0.02 0.00 0.00 55.97 57.80 1loo s LYS 158 Cb -0.09 -2.67 0.07 0.00 -0.52 0.00 0.00 37.83 34.61 1loo s LYS 158 CO 0.32 0.08 0.93 -0.80 -0.92 0.00 0.00 175.35 174.96 1loo s ASN 159 N -1.59 4.82 0.00 2.83 -0.87 -1.26 -4.34 114.94 114.53 1loo s ASN 159 Ca 0.54 0.10 0.00 0.00 -1.57 0.00 0.00 52.86 51.93 1loo s ASN 159 Cb -0.20 -0.76 0.00 0.00 -0.02 0.00 0.00 41.25 40.26 1loo s ASN 159 CO 0.26 -1.52 0.00 -0.38 -2.57 0.00 0.00 177.10 172.88 1loo n ILE 160 N -2.72 0.00 -2.85 0.60 5.41 -1.26 -4.95 119.36 113.59 1loo n ILE 160 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.85 1loo n ILE 160 Cb 0.60 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.53 1loo n ILE 160 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1loo n GLY 161 N 0.11 7.00 3.59 7.39 0.00 -1.26 -4.57 105.19 117.46 1loo n GLY 161 Ca 0.00 -1.87 -0.30 0.00 0.00 0.00 0.00 46.02 43.85 1loo n GLY 161 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1loo s THR 162 N 0.77 1.69 0.37 2.61 -1.32 -1.26 -5.08 115.64 113.43 1loo s THR 162 Ca 0.00 0.00 -0.05 0.00 -1.21 0.00 0.00 61.69 60.43 1loo s THR 162 Cb 0.00 -2.45 0.02 0.00 -1.51 0.00 0.00 72.50 68.56 1loo s THR 162 CO 0.00 0.00 0.57 -0.89 -2.21 0.00 0.00 174.62 172.09 1loo s THR 163 N -2.93 0.00 0.00 5.08 2.01 -1.26 -4.90 115.64 113.64 1loo s THR 163 Ca 0.69 -1.44 0.00 0.00 0.31 0.00 0.00 61.69 61.25 1loo s THR 163 Cb -0.13 -2.78 0.00 0.00 0.01 0.00 0.00 72.50 69.60 1loo s THR 163 CO 0.57 0.00 0.00 0.29 -0.69 0.00 0.00 174.62 174.79 1loo n LYS 164 N -0.59 -0.51 -0.05 4.92 5.02 -1.26 -4.66 118.16 121.03 1loo n LYS 164 Ca -0.01 0.12 0.01 0.00 -2.02 0.00 0.00 58.31 56.41 1loo n LYS 164 Cb 0.61 -4.54 -0.16 0.00 -0.02 0.00 0.00 35.03 30.91 1loo n LYS 164 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1loo n LYS 165 N -1.18 0.67 -1.83 1.97 5.02 -1.26 -4.85 118.16 116.70 1loo n LYS 165 Ca 0.00 -0.11 -0.12 0.00 -2.02 0.00 0.00 58.31 56.06 1loo n LYS 165 Cb 0.12 -1.52 -0.03 0.00 -0.02 0.00 0.00 35.03 33.59 1loo n LYS 165 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1loo n GLY 166 N 1.50 0.52 0.34 0.72 0.00 -1.26 -4.57 105.19 102.44 1loo n GLY 166 Ca -0.18 -0.42 -0.13 0.00 0.00 0.00 0.00 46.02 45.29 1loo n GLY 166 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1loo h ILE 167 N 0.00 0.00 -0.38 -0.61 1.08 -1.94 -2.57 117.51 113.09 1loo h ILE 167 Ca -0.27 -0.34 0.07 0.00 -0.39 0.00 0.00 64.86 63.93 1loo h ILE 167 Cb 1.02 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.68 1loo h ILE 167 CO 0.35 0.00 -0.41 1.23 -0.69 0.00 0.00 178.15 178.63 1loo h GLY 168 N -1.17 -0.52 0.41 5.37 0.00 -1.93 -0.51 103.07 104.72 1loo h GLY 168 Ca -0.08 0.52 0.16 0.00 0.00 0.00 0.00 47.33 47.93 1loo h GLY 168 CO 0.14 -0.19 0.59 -2.55 0.00 0.00 0.00 176.54 174.53 1loo h PRO 169 N -0.33 0.69 -0.18 4.80 0.11 -1.88 0.23 132.00 135.44 1loo h PRO 169 Ca 0.14 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.19 1loo h PRO 169 Cb 0.58 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1loo h PRO 169 CO -0.55 0.46 0.03 1.15 -0.21 0.00 0.00 178.00 178.88 1loo h THR 170 N 0.71 1.22 -0.40 -1.15 2.02 -0.72 -0.82 112.91 113.77 1loo h THR 170 Ca 0.48 -0.70 -0.02 0.00 0.77 0.00 0.00 66.41 66.94 1loo h THR 170 Cb 0.78 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.51 1loo h THR 170 CO -0.24 0.22 0.16 1.88 0.37 0.00 0.00 175.52 177.91 1loo h TYR 171 N 0.10 0.56 -0.52 3.16 0.05 0.18 -0.61 116.97 119.88 1loo h TYR 171 Ca 0.06 -0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 1loo h TYR 171 Cb 0.30 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 37.84 1loo h TYR 171 CO 0.02 0.44 0.18 0.77 -1.05 0.00 0.00 178.16 178.52 1loo h SER 172 N 0.57 0.75 -0.48 3.88 0.02 -0.13 -0.28 113.55 117.87 1loo h SER 172 Ca 0.14 -0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 60.85 1loo h SER 172 Cb 0.11 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.43 1loo h SER 172 CO -0.01 0.75 0.15 0.28 -1.14 0.00 0.00 176.83 176.85 1loo h SER 173 N 0.72 0.75 0.09 3.07 0.02 -0.31 -1.46 113.55 116.42 1loo h SER 173 Ca 0.17 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1loo h SER 173 Cb 0.25 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.60 1loo h SER 173 CO -0.01 0.72 -0.04 0.50 -1.14 0.00 0.00 176.83 176.86 1loo h LYS 174 N 0.78 -0.12 -0.97 3.45 3.64 -0.66 -0.57 116.57 122.12 1loo h LYS 174 Ca 0.18 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.69 1loo h LYS 174 Cb 0.25 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.02 1loo h LYS 174 CO -0.01 0.03 0.61 0.00 -2.27 0.00 0.00 179.45 177.82 1loo h ALA 175 N 0.66 1.60 0.00 5.00 0.00 -0.65 0.18 119.26 126.03 1loo h ALA 175 Ca -0.01 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1loo h ALA 175 Cb 0.20 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1loo h ALA 175 CO 0.02 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.44 1loo n ALA 176 N -2.37 2.46 -3.09 0.00 0.00 -0.59 -4.88 120.51 112.05 1loo n ALA 176 Ca 0.18 -0.14 -0.22 0.00 0.00 0.00 0.00 53.44 53.26 1loo n ALA 176 Cb 0.37 -1.48 0.04 0.00 0.00 0.00 0.00 19.45 18.39 1loo n ALA 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1loo n ARG 177 N -1.26 -5.27 -0.01 0.00 3.00 0.62 -4.86 116.66 108.89 1loo n ARG 177 Ca 0.15 0.89 0.02 0.00 -0.01 0.00 0.00 57.85 58.89 1loo n ARG 177 Cb 0.22 -5.74 -0.04 0.00 0.00 0.00 0.00 32.46 26.90 1loo n ARG 177 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 1loo n THR 178 N -4.57 0.06 -1.07 0.55 5.66 -0.32 -5.04 114.28 109.55 1loo n THR 178 Ca -0.09 -0.14 -0.29 0.00 -3.05 0.00 0.00 64.05 60.47 1loo n THR 178 Cb 0.61 0.18 0.19 0.00 -1.55 0.00 0.00 70.33 69.76 1loo n THR 178 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1loo s GLY 179 N -2.81 1.56 0.11 1.09 0.00 -0.83 -4.88 107.32 101.57 1loo s GLY 179 Ca -0.02 -0.32 0.10 0.00 0.00 0.00 0.00 44.72 44.48 1loo s GLY 179 CO 0.23 0.31 -0.22 1.08 0.00 0.00 0.00 173.10 174.50 1loo s LEU 180 N -6.58 2.51 0.42 0.66 1.43 -1.26 -4.95 118.68 110.90 1loo s LEU 180 Ca 0.66 -0.63 0.07 0.00 -1.03 0.00 0.00 54.13 53.20 1loo s LEU 180 Cb -0.20 -1.40 -0.06 0.00 0.03 0.00 0.00 46.19 44.57 1loo s LEU 180 CO 0.59 0.19 0.12 -0.13 0.23 0.00 0.00 176.35 177.35 1loo s ARG 181 N -1.99 2.14 0.17 1.70 0.52 -1.26 -0.80 118.95 119.42 1loo s ARG 181 Ca 0.16 -1.95 -0.16 0.00 -0.52 0.00 0.00 55.73 53.26 1loo s ARG 181 Cb -0.10 -1.86 0.12 0.00 0.52 0.00 0.00 34.95 33.62 1loo s ARG 181 CO 0.08 -0.11 1.70 0.82 0.02 0.00 0.00 175.30 177.80 1loo h ILE 182 N 1.52 0.69 -0.95 1.52 2.04 -1.37 -1.24 117.51 119.72 1loo h ILE 182 Ca -0.43 -0.03 0.12 0.00 1.00 0.00 0.00 64.86 65.51 1loo h ILE 182 Cb 1.25 0.58 -0.08 0.00 -0.74 0.00 0.00 36.82 37.82 1loo h ILE 182 CO 0.73 0.02 0.57 0.00 0.00 0.00 0.00 178.15 179.48 1loo h ASP 184 N 0.90 1.07 -0.68 0.00 3.32 -1.53 -1.84 116.42 117.65 1loo h ASP 184 Ca 0.47 -0.20 -0.06 0.00 0.02 0.00 0.00 57.03 57.26 1loo h ASP 184 Cb 0.48 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 1loo h ASP 184 CO -0.27 0.99 0.20 0.25 -1.72 0.00 0.00 179.24 178.69 1loo h LEU 185 N 1.09 1.01 -0.02 1.55 6.46 -0.39 -2.79 115.31 122.23 1loo h LEU 185 Ca 0.24 -0.21 0.00 0.00 -0.12 0.00 0.00 57.88 57.78 1loo h LEU 185 Cb 0.31 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 39.97 1loo h LEU 185 CO -0.01 0.96 -0.03 0.18 -0.62 0.00 0.00 178.44 178.92 1loo n LEU 186 N -4.30 0.05 0.00 2.25 4.32 -0.51 -4.71 117.00 114.10 1loo n LEU 186 Ca 0.05 0.36 0.00 0.00 -0.02 0.00 0.00 56.01 56.40 1loo n LEU 186 Cb 0.23 -0.38 0.00 0.00 -1.62 0.00 0.00 43.42 41.65 1loo n LEU 186 CO 0.41 0.01 0.00 -0.24 -1.22 0.00 0.00 177.39 176.35 1loo n SER 187 N -1.38 0.00 -4.58 -1.43 2.88 -0.72 -4.90 113.62 103.50 1loo n SER 187 Ca 0.10 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.21 1loo n SER 187 Cb 0.29 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.72 1loo n SER 187 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1loo n ASP 188 N 0.00 3.11 0.32 -3.46 2.03 -1.26 -4.82 116.55 112.47 1loo n ASP 188 Ca 0.00 0.18 0.20 0.00 0.52 0.00 0.00 54.79 55.69 1loo n ASP 188 Cb 0.00 -1.53 1.09 0.00 -0.72 0.00 0.00 41.12 39.96 1loo n ASP 188 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 1loo h PHE 189 N 15.12 0.00 -0.16 -0.67 3.57 -1.86 -2.11 116.94 130.82 1loo h PHE 189 Ca -0.39 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.07 1loo h PHE 189 Cb 1.25 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.98 1loo h PHE 189 CO 0.94 0.01 -0.08 -0.44 -2.23 0.00 0.00 178.31 176.51 1loo h ASP 190 N 0.00 0.34 0.48 0.41 3.32 -1.97 -0.82 116.42 118.18 1loo h ASP 190 Ca -0.00 -0.41 -0.08 0.00 0.02 0.00 0.00 57.03 56.55 1loo h ASP 190 Cb 0.04 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1loo h ASP 190 CO 0.00 0.68 -0.39 -0.08 -1.72 0.00 0.00 179.24 177.73 1loo h GLU 191 N 0.00 0.00 -0.13 3.56 4.57 -1.80 -2.66 114.58 118.13 1loo h GLU 191 Ca 0.04 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.17 1loo h GLU 191 Cb 0.55 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1loo h GLU 191 CO 0.02 0.39 -0.08 0.35 -1.18 0.00 0.00 179.01 178.51 1loo h PHE 192 N 0.00 0.33 -0.44 0.92 3.57 -1.26 -2.57 116.94 117.49 1loo h PHE 192 Ca -0.00 -0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.43 1loo h PHE 192 Cb 0.74 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.37 1loo h PHE 192 CO 0.00 0.65 0.26 0.77 -2.23 0.00 0.00 178.31 177.76 1loo h SER 193 N -0.08 0.42 -0.84 0.41 0.02 -1.02 0.26 113.55 112.72 1loo h SER 193 Ca 0.03 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1loo h SER 193 Cb 0.57 -0.08 -0.05 0.00 0.14 0.00 0.00 62.40 62.98 1loo h SER 193 CO 0.02 0.30 0.55 0.00 -1.14 0.00 0.00 176.83 176.57 1loo h ALA 194 N 1.20 1.09 -0.30 3.77 0.00 -1.50 -0.02 119.26 123.50 1loo h ALA 194 Ca 0.18 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 1loo h ALA 194 Cb 0.01 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1loo h ALA 194 CO -0.08 0.44 -0.49 0.00 0.00 0.00 0.00 179.25 179.12 1loo h ARG 195 N 1.11 0.82 -0.03 0.00 3.08 -0.98 -1.90 114.38 116.49 1loo h ARG 195 Ca 0.32 -0.49 -0.00 0.00 0.07 0.00 0.00 59.98 59.89 1loo h ARG 195 Cb -0.07 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1loo h ARG 195 CO -0.09 1.12 0.01 0.35 -1.07 0.00 0.00 179.97 180.30 1loo h PHE 196 N 0.65 0.04 -0.37 3.04 3.57 -0.09 -0.22 116.94 123.56 1loo h PHE 196 Ca 0.03 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.56 1loo h PHE 196 Cb 1.07 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.77 1loo h PHE 196 CO 0.06 0.12 0.17 0.87 -2.23 0.00 0.00 178.31 177.31 1loo h LYS 197 N -0.05 0.35 -0.55 1.11 1.57 -1.01 0.10 116.57 118.08 1loo h LYS 197 Ca 0.01 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.83 1loo h LYS 197 Cb 0.10 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.27 1loo h LYS 197 CO -0.00 0.23 0.25 -0.91 -0.57 0.00 0.00 179.45 178.45 1loo h ASN 198 N 0.36 0.33 0.70 0.86 -0.26 -1.14 0.23 115.58 116.66 1loo h ASN 198 Ca 0.16 0.05 -0.03 0.00 -0.56 0.00 0.00 56.30 55.91 1loo h ASN 198 Cb 0.08 -0.01 0.01 0.00 -1.06 0.00 0.00 38.32 37.33 1loo h ASN 198 CO -0.12 0.22 -0.34 0.25 -1.06 0.00 0.00 177.43 176.39 1loo h LEU 199 N 0.48 -0.79 -1.62 1.61 5.85 -0.23 -0.65 115.31 119.96 1loo h LEU 199 Ca 0.26 0.02 0.07 0.00 0.84 0.00 0.00 57.88 59.07 1loo h LEU 199 Cb 0.22 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1loo h LEU 199 CO -0.21 -0.55 0.37 0.00 -0.34 0.00 0.00 178.44 177.70 1loo h ALA 200 N -0.65 1.93 0.25 1.25 0.00 -0.58 -1.70 119.26 119.76 1loo h ALA 200 Ca -0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1loo h ALA 200 Cb 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1loo h ALA 200 CO 0.16 -0.04 -0.12 1.25 0.00 0.00 0.00 179.25 180.50 1loo h HIS 201 N 0.45 -0.31 -0.82 0.00 -0.00 -0.12 -1.36 115.15 113.00 1loo h HIS 201 Ca 0.25 -0.01 0.08 0.00 -0.00 0.00 0.00 60.37 60.69 1loo h HIS 201 Cb 0.39 0.10 -0.06 0.00 -0.00 0.00 0.00 27.41 27.85 1loo h HIS 201 CO -0.00 -0.13 0.53 1.96 -0.00 0.00 0.00 177.93 180.30 1loo h GLN 202 N -0.43 0.80 -0.33 5.26 4.20 -0.29 -1.54 115.11 122.78 1loo h GLN 202 Ca -0.03 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.50 1loo h GLN 202 Cb 0.32 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1loo h GLN 202 CO 0.06 0.53 -0.31 0.45 -0.67 0.00 0.00 178.83 178.88 1loo h HIS 203 N 0.82 0.83 0.00 2.96 3.86 -1.03 -1.65 115.15 120.95 1loo h HIS 203 Ca 0.37 -0.22 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 1loo h HIS 203 Cb 0.35 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.63 1loo h HIS 203 CO -0.00 0.94 0.00 1.96 0.86 0.00 0.00 177.93 181.69 1loo h GLN 204 N 0.61 0.00 0.00 2.45 4.20 -0.31 0.26 115.11 122.32 1loo h GLN 204 Ca 0.07 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 1loo h GLN 204 Cb 0.83 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.61 1loo h GLN 204 CO 0.07 0.00 -0.00 0.77 -0.67 0.00 0.00 178.83 179.00 1loo h SER 205 N 0.00 -0.00 1.01 1.46 0.02 -0.86 -3.18 113.55 112.01 1loo h SER 205 Ca 0.00 -0.95 -0.04 0.00 -0.84 0.00 0.00 61.79 59.96 1loo h SER 205 Cb 0.55 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 1loo h SER 205 CO 0.00 0.96 -0.20 0.24 -1.14 0.00 0.00 176.83 176.69 1loo h MET 206 N -0.98 0.00 -3.19 3.45 2.86 -1.19 -3.38 114.93 112.50 1loo h MET 206 Ca -0.00 0.00 -0.59 0.00 -2.06 0.00 0.00 59.70 57.05 1loo h MET 206 Cb 0.95 0.00 -0.40 0.00 0.06 0.00 0.00 31.60 32.21 1loo h MET 206 CO 0.00 0.20 -0.77 -0.06 1.06 0.00 0.00 176.91 177.35 1loo s PHE 207 N -3.60 1.53 0.38 -0.22 0.40 0.91 -5.00 117.98 112.38 1loo s PHE 207 Ca 0.01 -1.84 0.18 0.00 -0.60 0.00 0.00 56.93 54.68 1loo s PHE 207 Cb 0.10 -1.58 0.99 0.00 0.51 0.00 0.00 43.02 43.03 1loo s PHE 207 CO 0.63 -0.84 1.92 -1.00 0.70 0.00 0.00 175.22 176.64 1loo h PRO 208 N 7.59 0.00 -0.57 0.24 0.13 -1.74 -2.77 132.00 134.88 1loo h PRO 208 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1loo h PRO 208 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1loo h PRO 208 CO 0.44 0.26 0.00 0.25 -0.23 0.00 0.00 178.00 178.72 1loo n THR 209 N -3.96 0.90 -3.29 1.56 -2.24 -1.26 -4.87 114.28 101.13 1loo n THR 209 Ca -0.02 -0.58 -0.39 0.00 -2.27 0.00 0.00 64.05 60.79 1loo n THR 209 Cb 0.33 -0.06 -0.07 0.00 -2.10 0.00 0.00 70.33 68.43 1loo n THR 209 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1loo s LEU 210 N -1.17 4.19 -0.24 3.22 1.98 -1.04 -5.06 118.68 120.56 1loo s LEU 210 Ca 0.25 0.70 -0.08 0.00 -2.89 0.00 0.00 54.13 52.11 1loo s LEU 210 Cb 0.16 -2.68 -0.04 0.00 0.66 0.00 0.00 46.19 44.30 1loo s LEU 210 CO 0.12 -0.11 0.09 -1.61 -1.89 0.00 0.00 176.35 172.96 1loo s GLU 211 N 1.26 3.78 -0.16 1.98 2.02 -1.26 -4.89 118.70 121.43 1loo s GLU 211 Ca 0.24 -0.42 0.00 0.00 0.02 0.00 0.00 54.97 54.81 1loo s GLU 211 Cb -0.15 -3.37 0.03 0.00 0.10 0.00 0.00 34.13 30.74 1loo s GLU 211 CO 0.10 -0.09 -0.10 0.42 0.02 0.00 0.00 175.26 175.61 1loo s ILE 212 N 1.39 1.36 -1.32 -1.63 1.01 -1.26 -4.94 121.20 115.80 1loo s ILE 212 Ca 0.06 -0.66 -0.14 0.00 0.00 0.00 0.00 60.65 59.91 1loo s ILE 212 Cb -0.15 -1.40 0.11 0.00 0.01 0.00 0.00 42.46 41.03 1loo s ILE 212 CO 0.05 0.28 1.84 -0.67 0.00 0.00 0.00 174.94 176.44 1loo n ASP 213 N 4.81 4.75 0.00 3.58 4.64 -1.26 -4.87 116.55 128.21 1loo n ASP 213 Ca -0.14 -2.96 0.00 0.00 -1.38 0.00 0.00 54.79 50.31 1loo n ASP 213 Cb 0.49 -1.61 0.00 0.00 -1.04 0.00 0.00 41.12 38.95 1loo n ASP 213 CO 0.00 0.00 0.00 0.52 -0.82 0.00 0.00 177.20 176.90 1loo n VAL 214 N 4.82 0.00 0.03 5.18 0.31 -1.26 -0.06 118.33 127.34 1loo n VAL 214 Ca 0.45 1.32 0.17 0.00 -0.01 0.00 0.00 64.34 66.26 1loo n VAL 214 Cb 0.41 -1.89 0.64 0.00 -0.91 0.00 0.00 33.84 32.09 1loo n VAL 214 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1loo h GLU 215 N 0.00 0.08 -0.06 5.55 4.39 -1.98 0.18 114.58 122.74 1loo h GLU 215 Ca 0.00 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1loo h GLU 215 Cb 0.00 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1loo h GLU 215 CO 0.00 0.05 -0.01 0.78 -1.16 0.00 0.00 179.01 178.67 1loo h GLY 216 N 0.08 0.12 0.82 -3.84 0.00 -1.73 -1.90 103.07 96.63 1loo h GLY 216 Ca 0.22 -0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.37 1loo h GLY 216 CO -0.02 0.09 -0.17 1.46 0.00 0.00 0.00 176.54 177.90 1loo h GLN 217 N -0.22 0.47 -0.46 4.80 4.20 0.46 -2.18 115.11 122.18 1loo h GLN 217 Ca 0.02 -0.24 0.06 0.00 0.06 0.00 0.00 58.65 58.55 1loo h GLN 217 Cb 0.39 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 1loo h GLN 217 CO 0.01 0.80 0.31 1.25 -0.67 0.00 0.00 178.83 180.53 1loo h LEU 218 N 0.15 0.31 -0.09 1.46 5.85 -0.75 -0.00 115.31 122.23 1loo h LEU 218 Ca 0.04 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.67 1loo h LEU 218 Cb 0.70 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1loo h LEU 218 CO 0.04 0.20 -0.29 0.50 -0.34 0.00 0.00 178.44 178.55 1loo h LYS 219 N 0.35 0.36 0.00 1.25 3.64 -1.20 -2.75 116.57 118.23 1loo h LYS 219 Ca 0.20 -0.27 -0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1loo h LYS 219 Cb 0.35 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1loo h LYS 219 CO -0.05 0.89 -0.14 0.00 -2.27 0.00 0.00 179.45 177.88 1loo h ARG 220 N -0.09 0.00 -0.00 1.90 3.08 -0.65 -2.92 114.38 115.69 1loo h ARG 220 Ca -0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1loo h ARG 220 Cb 0.91 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.96 1loo h ARG 220 CO 0.06 0.14 -0.00 -0.07 -1.07 0.00 0.00 179.97 179.04 1loo h LEU 221 N 0.00 0.00 -1.66 3.04 3.38 -0.98 -2.06 115.31 117.03 1loo h LEU 221 Ca -0.00 -0.55 0.22 0.00 0.09 0.00 0.00 57.88 57.64 1loo h LEU 221 Cb 0.27 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 1loo h LEU 221 CO 0.02 0.55 0.61 0.50 0.09 0.00 0.00 178.44 180.21 1loo h LYS 222 N -0.55 0.26 -0.30 1.13 3.64 -1.31 1.24 116.57 120.68 1loo h LYS 222 Ca 0.00 -0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.20 1loo h LYS 222 Cb 0.55 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 1loo h LYS 222 CO 0.00 0.17 -0.45 0.78 -2.27 0.00 0.00 179.45 177.68 1loo h GLY 223 N 0.27 0.86 1.16 5.01 0.00 -1.40 -3.12 103.07 105.85 1loo h GLY 223 Ca 0.46 -0.92 -0.13 0.00 0.00 0.00 0.00 47.33 46.74 1loo h GLY 223 CO -0.13 0.83 -0.24 0.74 0.00 0.00 0.00 176.54 177.73 1loo h PHE 224 N 0.63 1.10 -0.31 5.60 0.04 0.19 -3.00 116.94 121.19 1loo h PHE 224 Ca 0.04 -0.27 0.07 0.00 2.80 0.00 0.00 57.97 60.60 1loo h PHE 224 Cb 1.02 -0.25 -0.07 0.00 2.20 0.00 0.00 35.95 38.85 1loo h PHE 224 CO 0.06 1.09 -0.14 0.00 -0.60 0.00 0.00 178.31 178.71 1loo h ALA 225 N 0.89 0.11 -0.30 2.45 0.00 0.37 -0.69 119.26 122.09 1loo h ALA 225 Ca 0.10 0.12 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 1loo h ALA 225 Cb 0.81 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1loo h ALA 225 CO 0.07 -0.53 -0.21 0.93 0.00 0.00 0.00 179.25 179.51 1loo h GLU 226 N -0.09 0.56 -0.18 0.00 4.39 -1.57 0.04 114.58 117.73 1loo h GLU 226 Ca 0.16 -0.20 -0.12 0.00 0.34 0.00 0.00 59.36 59.54 1loo h GLU 226 Cb 0.34 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1loo h GLU 226 CO -0.37 0.74 -0.40 -0.09 -1.16 0.00 0.00 179.01 177.72 1loo h ARG 227 N 0.50 0.41 0.00 2.33 2.43 -1.27 -3.26 114.38 115.52 1loo h ARG 227 Ca 0.08 -0.20 -0.18 0.00 -0.81 0.00 0.00 59.98 58.87 1loo h ARG 227 Cb 0.64 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 1loo h ARG 227 CO 0.05 0.74 -1.54 1.51 -1.51 0.00 0.00 179.97 179.22 1loo n ILE 228 N -4.03 1.14 -0.32 1.20 3.06 -0.32 -4.50 119.36 115.59 1loo n ILE 228 Ca -0.01 -0.70 0.20 0.00 -2.50 0.00 0.00 62.75 59.74 1loo n ILE 228 Cb 0.49 -0.68 0.40 0.00 0.54 0.00 0.00 39.64 40.39 1loo n ILE 228 CO 0.00 0.00 0.00 -0.09 -2.50 0.00 0.00 176.55 173.96 1loo h ARG 229 N 0.00 0.09 0.00 9.51 2.43 -1.02 0.11 114.38 125.50 1loo h ARG 229 Ca -0.19 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 1loo h ARG 229 Cb 1.61 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.14 1loo h ARG 229 CO 0.04 0.06 0.00 -1.00 -1.51 0.00 0.00 179.97 177.56 1loo h PRO 230 N 0.09 0.00 -0.02 0.20 0.13 -1.79 -2.73 132.00 127.89 1loo h PRO 230 Ca 0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.80 1loo h PRO 230 Cb 1.54 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.67 1loo h PRO 230 CO -0.78 0.00 -0.35 -1.33 -0.23 0.00 0.00 178.00 175.31 1loo n MET 231 N -2.39 1.48 -3.33 0.86 2.81 0.02 -4.97 117.12 111.60 1loo n MET 231 Ca 0.00 -1.11 -0.37 0.00 -1.81 0.00 0.00 57.70 54.41 1loo n MET 231 Cb 0.16 -1.42 -0.06 0.00 -0.71 0.00 0.00 33.22 31.19 1loo n MET 231 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1loo s VAL 232 N -2.22 4.82 0.21 2.03 1.01 -1.03 -1.14 120.40 124.08 1loo s VAL 232 Ca 0.19 1.00 -0.11 0.00 0.00 0.00 0.00 61.98 63.05 1loo s VAL 232 Cb 0.17 -3.80 -0.00 0.00 0.00 0.00 0.00 36.38 32.74 1loo s VAL 232 CO 0.48 0.40 0.38 -0.13 0.00 0.00 0.00 175.10 176.23 1loo s ARG 233 N -1.53 1.35 -0.40 2.72 0.52 -0.87 -4.92 118.95 115.83 1loo s ARG 233 Ca 0.33 -1.20 -0.29 0.00 -0.52 0.00 0.00 55.73 54.05 1loo s ARG 233 Cb -0.17 0.43 0.01 0.00 0.52 0.00 0.00 34.95 35.73 1loo s ARG 233 CO 0.19 -0.53 1.46 0.34 0.02 0.00 0.00 175.30 176.78 1loo s ASP 234 N -2.99 6.27 0.37 0.23 2.15 -1.26 -1.17 116.67 120.27 1loo s ASP 234 Ca 0.20 0.88 0.05 0.00 0.43 0.00 0.00 52.55 54.12 1loo s ASP 234 Cb 0.01 -2.54 0.71 0.00 -0.30 0.00 0.00 42.92 40.81 1loo s ASP 234 CO 0.04 -1.47 1.96 1.23 -0.17 0.00 0.00 175.17 176.76 1loo h GLY 235 N 12.41 0.58 0.75 2.66 0.00 -1.89 -1.20 103.07 116.39 1loo h GLY 235 Ca -0.28 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 46.71 1loo h GLY 235 CO 1.08 0.27 -0.13 -2.08 0.00 0.00 0.00 176.54 175.68 1loo h VAL 236 N 0.54 1.34 -0.58 4.60 2.07 -1.90 -2.24 116.25 120.08 1loo h VAL 236 Ca 0.13 -1.26 -0.10 0.00 0.82 0.00 0.00 66.70 66.29 1loo h VAL 236 Cb 0.14 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 1loo h VAL 236 CO -0.01 0.37 -0.04 0.22 0.02 0.00 0.00 177.57 178.13 1loo h TYR 237 N -0.00 1.16 -0.41 1.57 5.03 -1.93 -1.63 116.97 120.76 1loo h TYR 237 Ca 0.03 -0.21 0.02 0.00 2.58 0.00 0.00 58.73 61.14 1loo h TYR 237 Cb 0.64 -0.30 -0.03 0.00 1.55 0.00 0.00 36.73 38.60 1loo h TYR 237 CO 0.08 1.04 0.23 0.35 -1.32 0.00 0.00 178.16 178.54 1loo h PHE 238 N 0.95 0.43 -0.06 -3.82 3.04 -1.17 -1.24 116.94 115.07 1loo h PHE 238 Ca 0.16 0.01 -0.20 0.00 3.98 0.00 0.00 57.97 61.93 1loo h PHE 238 Cb 0.60 -0.14 -0.00 0.00 2.56 0.00 0.00 35.95 38.98 1loo h PHE 238 CO 0.04 0.25 -0.78 1.98 -2.02 0.00 0.00 178.31 177.78 1loo h MET 239 N 0.47 0.43 -0.36 1.11 4.05 -1.34 -2.48 114.93 116.80 1loo h MET 239 Ca 0.17 -0.38 -0.01 0.00 -0.28 0.00 0.00 59.70 59.20 1loo h MET 239 Cb 0.03 0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 30.90 1loo h MET 239 CO -0.09 1.02 0.20 -0.92 0.23 0.00 0.00 176.91 177.36 1loo h TYR 240 N 0.28 0.50 0.11 1.39 3.20 -1.09 -0.37 116.97 120.98 1loo h TYR 240 Ca -0.04 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.82 1loo h TYR 240 Cb 1.38 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 1loo h TYR 240 CO 0.05 0.38 -0.09 0.93 -1.64 0.00 0.00 178.16 177.79 1loo h GLU 241 N 0.46 -0.20 -0.83 1.82 4.39 -1.23 -0.45 114.58 118.54 1loo h GLU 241 Ca 0.13 0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.91 1loo h GLU 241 Cb 0.05 0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.69 1loo h GLU 241 CO -0.02 -0.14 0.54 0.00 -1.16 0.00 0.00 179.01 178.24 1loo h ALA 242 N 0.67 1.61 0.00 3.43 0.00 -1.25 0.03 119.26 123.75 1loo h ALA 242 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1loo h ALA 242 Cb 0.19 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1loo h ALA 242 CO -0.01 0.25 -0.20 -0.07 0.00 0.00 0.00 179.25 179.22 1loo h LEU 243 N 0.89 0.00 -1.67 0.00 3.38 -0.70 -3.35 115.31 113.86 1loo h LEU 243 Ca 0.36 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1loo h LEU 243 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1loo h LEU 243 CO -0.13 0.01 0.00 1.41 0.09 0.00 0.00 178.44 179.81 1loo n HIS 244 N -2.77 0.08 -0.39 1.13 8.25 -0.21 -0.11 115.22 121.19 1loo n HIS 244 Ca 0.04 -0.11 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1loo n HIS 244 Cb 0.50 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.61 1loo n HIS 244 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1loo n GLY 245 N 0.41 1.37 3.76 -1.41 0.00 -0.06 -4.99 105.19 104.28 1loo n GLY 245 Ca 0.06 -1.66 -0.36 0.00 0.00 0.00 0.00 46.02 44.06 1loo n GLY 245 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1loo s PRO 246 N 1.94 3.12 -0.12 1.61 0.04 -1.26 -4.83 135.00 135.49 1loo s PRO 246 Ca 0.00 1.77 -0.41 0.00 0.04 0.00 0.00 61.00 62.40 1loo s PRO 246 Cb 0.00 -1.97 -0.19 0.00 0.04 0.00 0.00 34.50 32.38 1loo s PRO 246 CO 0.00 -1.08 1.28 -0.35 0.04 0.00 0.00 177.00 176.89 1loo n PRO 247 N -1.46 0.24 -4.32 0.56 -0.04 -1.26 -4.95 135.00 123.77 1loo n PRO 247 Ca 0.13 0.09 -0.17 0.00 -0.04 0.00 0.00 63.50 63.51 1loo n PRO 247 Cb 0.50 -1.62 -0.10 0.00 -0.04 0.00 0.00 33.50 32.24 1loo n PRO 247 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1loo s LYS 248 N 0.99 1.30 -0.33 0.54 1.02 -1.26 -5.10 119.74 116.89 1loo s LYS 248 Ca 0.94 -1.63 -0.02 0.00 0.02 0.00 0.00 55.97 55.27 1loo s LYS 248 Cb -1.26 -0.70 0.06 0.00 -0.52 0.00 0.00 37.83 35.41 1loo s LYS 248 CO 0.62 -0.03 0.05 0.15 -0.92 0.00 0.00 175.35 175.22 1loo s LYS 249 N -3.81 2.31 -0.15 1.68 1.02 -1.26 -4.78 119.74 114.75 1loo s LYS 249 Ca 0.26 -1.40 -0.04 0.00 0.02 0.00 0.00 55.97 54.80 1loo s LYS 249 Cb 0.04 -3.29 -0.03 0.00 -0.52 0.00 0.00 37.83 34.03 1loo s LYS 249 CO 0.07 -0.73 -0.01 0.08 -0.92 0.00 0.00 175.35 173.84 1loo s VAL 250 N 1.22 4.17 -0.10 3.17 1.01 -1.26 0.14 120.40 128.76 1loo s VAL 250 Ca -0.01 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.73 1loo s VAL 250 Cb -0.20 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 1loo s VAL 250 CO -0.02 0.50 -0.20 -0.22 0.00 0.00 0.00 175.10 175.17 1loo s LEU 251 N 0.16 2.33 -0.26 3.92 2.96 0.11 -1.40 118.68 126.49 1loo s LEU 251 Ca 0.00 -0.45 -0.01 0.00 -0.22 0.00 0.00 54.13 53.46 1loo s LEU 251 Cb -0.13 -1.48 0.04 0.00 0.50 0.00 0.00 46.19 45.12 1loo s LEU 251 CO 0.02 0.19 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.49 1loo s VAL 252 N 0.18 2.73 -0.49 1.68 1.01 0.11 -0.34 120.40 125.27 1loo s VAL 252 Ca -0.11 -1.24 -0.22 0.00 0.00 0.00 0.00 61.98 60.40 1loo s VAL 252 Cb -0.16 -2.47 0.04 0.00 0.00 0.00 0.00 36.38 33.79 1loo s VAL 252 CO 0.06 0.09 0.77 -1.83 0.00 0.00 0.00 175.10 174.19 1loo s GLU 253 N 1.26 3.29 0.61 2.72 -1.05 -0.46 -2.09 118.70 122.99 1loo s GLU 253 Ca -0.03 -0.39 -0.19 0.00 -0.15 0.00 0.00 54.97 54.22 1loo s GLU 253 Cb -0.18 -4.01 -0.03 0.00 -0.44 0.00 0.00 34.13 29.47 1loo s GLU 253 CO -0.04 -1.24 1.27 0.20 0.95 0.00 0.00 175.26 176.40 1loo s GLY 254 N 2.46 2.82 0.10 -3.83 0.00 0.41 -4.57 107.32 104.72 1loo s GLY 254 Ca 0.25 1.15 -0.12 0.00 0.00 0.00 0.00 44.72 46.01 1loo s GLY 254 CO 0.18 1.58 0.46 0.00 0.00 0.00 0.00 173.10 175.32 1loo s ALA 255 N -1.45 3.67 0.00 3.20 0.00 -1.26 -4.84 121.76 121.08 1loo s ALA 255 Ca 0.79 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1loo s ALA 255 Cb -0.35 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1loo s ALA 255 CO 0.38 0.52 0.00 0.09 0.00 0.00 0.00 175.76 176.75 1loo n ASN 256 N 0.89 0.00 -3.85 0.00 4.13 -1.26 -4.72 115.26 110.45 1loo n ASN 256 Ca -0.07 0.00 -0.08 0.00 1.68 0.00 0.00 54.58 56.11 1loo n ASN 256 Cb 0.52 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.74 1loo n ASN 256 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1loo s ALA 257 N -1.22 -1.09 0.23 5.41 0.00 -1.26 -3.56 121.76 120.26 1loo s ALA 257 Ca 0.00 -0.34 -0.10 0.00 0.00 0.00 0.00 51.96 51.52 1loo s ALA 257 Cb 0.00 0.88 0.35 0.00 0.00 0.00 0.00 23.12 24.35 1loo s ALA 257 CO 0.00 -0.99 1.63 0.00 0.00 0.00 0.00 175.76 176.40 1loo h ALA 258 N 2.05 0.61 0.00 0.00 0.00 -1.14 0.73 119.26 121.50 1loo h ALA 258 Ca -0.21 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1loo h ALA 258 Cb 1.25 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1loo h ALA 258 CO 0.26 -0.42 0.00 1.28 0.00 0.00 0.00 179.25 180.37 1loo n LEU 259 N -5.40 0.00 -0.69 0.00 4.77 -0.41 -1.68 117.00 113.58 1loo n LEU 259 Ca 0.11 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.15 1loo n LEU 259 Cb 0.41 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.65 1loo n LEU 259 CO 0.04 0.00 0.61 0.18 -1.33 0.00 0.00 177.39 176.89 1loo n LEU 260 N -0.91 2.89 -4.73 2.23 4.77 0.23 -1.32 117.00 120.16 1loo n LEU 260 Ca 0.16 -1.82 -0.42 0.00 -0.03 0.00 0.00 56.01 53.90 1loo n LEU 260 Cb 0.08 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 1loo n LEU 260 CO 0.12 0.70 0.95 -0.62 -1.33 0.00 0.00 177.39 177.21 1loo s ASP 261 N -1.01 6.97 0.24 -1.43 -1.08 -0.68 -1.43 116.67 118.25 1loo s ASP 261 Ca 0.25 2.27 -0.05 0.00 -0.52 0.00 0.00 52.55 54.49 1loo s ASP 261 Cb 0.13 -2.60 0.40 0.00 -1.46 0.00 0.00 42.92 39.39 1loo s ASP 261 CO 0.18 -0.49 1.76 -0.29 0.52 0.00 0.00 175.17 176.85 1loo h ILE 262 N 3.97 0.78 0.11 4.11 -0.00 -1.61 1.10 117.51 125.96 1loo h ILE 262 Ca -0.44 -0.19 -0.27 0.00 -0.00 0.00 0.00 64.86 63.96 1loo h ILE 262 Cb 1.21 0.17 -0.01 0.00 -0.00 0.00 0.00 36.82 38.20 1loo h ILE 262 CO 0.79 0.10 -1.41 0.44 -0.00 0.00 0.00 178.15 178.07 1loo h ASP 263 N 0.55 0.35 0.00 2.19 5.19 -1.90 -3.42 116.42 119.39 1loo h ASP 263 Ca 0.38 -0.84 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 1loo h ASP 263 Cb 0.48 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 39.88 1loo h ASP 263 CO -0.32 1.61 -1.07 0.49 -3.12 0.00 0.00 179.24 176.83 1loo n PHE 264 N -3.94 0.00 -1.31 4.55 3.72 -1.16 -4.95 117.46 114.37 1loo n PHE 264 Ca -0.25 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 56.93 1loo n PHE 264 Cb 0.89 -0.07 0.16 0.00 -0.94 0.00 0.00 39.48 39.53 1loo n PHE 264 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1loo n GLY 265 N 1.45 -2.00 2.62 1.37 0.00 0.38 -4.79 105.19 104.21 1loo n GLY 265 Ca 0.03 -1.60 -0.40 0.00 0.00 0.00 0.00 46.02 44.04 1loo n GLY 265 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1loo n THR 266 N -3.75 3.58 -1.57 2.61 -2.24 -0.43 -4.86 114.28 107.62 1loo n THR 266 Ca 0.12 -2.72 -0.43 0.00 -2.27 0.00 0.00 64.05 58.74 1loo n THR 266 Cb 0.42 -2.58 -0.00 0.00 -2.10 0.00 0.00 70.33 66.07 1loo n THR 266 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1loo n TYR 267 N 5.33 0.92 1.69 4.78 9.36 -1.26 -1.10 117.16 136.89 1loo n TYR 267 Ca 0.60 0.65 0.11 0.00 3.32 0.00 0.00 57.90 62.57 1loo n TYR 267 Cb 0.33 -2.20 0.53 0.00 -0.63 0.00 0.00 39.34 37.38 1loo n TYR 267 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1loo n PRO 268 N 0.51 1.31 -2.14 2.98 -0.04 -1.26 -4.52 135.00 131.85 1loo n PRO 268 Ca 0.10 -0.47 -0.42 0.00 -0.04 0.00 0.00 63.50 62.67 1loo n PRO 268 Cb 0.35 -1.37 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 1loo n PRO 268 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1loo n PHE 269 N -0.34 3.54 -3.97 0.54 3.72 -0.25 -4.71 117.46 115.99 1loo n PHE 269 Ca 0.16 -2.92 -0.09 0.00 -0.05 0.00 0.00 57.45 54.54 1loo n PHE 269 Cb 0.19 -2.31 -0.04 0.00 -0.94 0.00 0.00 39.48 36.38 1loo n PHE 269 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1loo s VAL 270 N 2.13 0.00 0.89 -4.37 -7.23 -1.26 -4.35 120.40 106.21 1loo s VAL 270 Ca 0.45 -1.33 -0.11 0.00 -1.81 0.00 0.00 61.98 59.18 1loo s VAL 270 Cb 0.10 -2.29 0.20 0.00 0.56 0.00 0.00 36.38 34.94 1loo s VAL 270 CO -0.03 0.00 1.22 0.35 -0.31 0.00 0.00 175.10 176.33 1loo n THR 271 N -0.43 0.00 0.51 5.32 -2.24 -0.52 -4.67 114.28 112.26 1loo n THR 271 Ca -0.02 -1.19 0.09 0.00 -2.27 0.00 0.00 64.05 60.65 1loo n THR 271 Cb 0.61 -1.29 0.24 0.00 -2.10 0.00 0.00 70.33 67.79 1loo n THR 271 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1loo n SER 272 N -3.52 2.62 -4.23 3.42 7.64 -1.26 -3.78 113.62 114.51 1loo n SER 272 Ca 0.17 -1.96 -0.14 0.00 1.01 0.00 0.00 58.87 57.95 1loo n SER 272 Cb 0.58 -0.29 -0.10 0.00 -1.01 0.00 0.00 64.21 63.39 1loo n SER 272 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1loo s SER 273 N -1.14 1.64 -0.01 6.43 1.04 -1.26 -4.89 113.70 115.52 1loo s SER 273 Ca 0.34 -0.99 -0.30 0.00 0.48 0.00 0.00 55.95 55.48 1loo s SER 273 Cb 0.18 0.01 -0.06 0.00 0.10 0.00 0.00 66.02 66.25 1loo s SER 273 CO 0.24 -0.35 1.47 0.20 0.98 0.00 0.00 173.24 175.78 1loo s ASN 274 N -3.06 6.79 -0.15 7.02 0.02 -1.26 -2.75 114.94 121.55 1loo s ASN 274 Ca 0.14 2.16 0.16 0.00 -1.02 0.00 0.00 52.86 54.30 1loo s ASN 274 Cb 0.02 -2.56 0.58 0.00 0.02 0.00 0.00 41.25 39.32 1loo s ASN 274 CO -0.00 -0.78 1.49 0.00 0.02 0.00 0.00 177.10 177.83 1loo n THR 276 N 0.14 0.00 -0.27 0.00 -2.24 -1.26 -4.31 114.28 106.34 1loo n THR 276 Ca 0.22 -1.83 0.07 0.00 -2.27 0.00 0.00 64.05 60.24 1loo n THR 276 Cb 0.88 -0.02 0.30 0.00 -2.10 0.00 0.00 70.33 69.39 1loo n THR 276 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1loo h VAL 277 N 0.74 0.98 -0.32 2.28 3.04 -1.87 -1.20 116.25 119.90 1loo h VAL 277 Ca -0.30 -0.30 0.06 0.00 -1.01 0.00 0.00 66.70 65.15 1loo h VAL 277 Cb 1.05 0.03 -0.02 0.00 -2.01 0.00 0.00 31.29 30.34 1loo h VAL 277 CO 0.47 0.16 0.22 1.23 -1.01 0.00 0.00 177.57 178.64 1loo h GLY 278 N 0.87 0.22 2.00 3.17 0.00 -1.96 -0.15 103.07 107.22 1loo h GLY 278 Ca 0.40 -0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.66 1loo h GLY 278 CO -0.16 0.05 -0.01 -1.33 0.00 0.00 0.00 176.54 175.09 1loo h GLY 279 N 0.18 0.00 0.67 4.60 0.00 -1.48 -1.44 103.07 105.60 1loo h GLY 279 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.43 1loo h GLY 279 CO -0.02 0.00 -0.09 -2.08 0.00 0.00 0.00 176.54 174.34 1loo h VAL 280 N 0.00 1.36 -0.12 4.60 2.07 -1.11 0.16 116.25 123.22 1loo h VAL 280 Ca -0.00 -1.24 -0.00 0.00 0.82 0.00 0.00 66.70 66.28 1loo h VAL 280 Cb 0.18 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1loo h VAL 280 CO 0.00 0.35 0.06 0.00 0.02 0.00 0.00 177.57 178.00 1loo h THR 282 N 0.07 0.43 0.00 0.00 1.35 -1.43 0.30 112.91 113.62 1loo h THR 282 Ca 0.04 -1.37 -0.06 0.00 -0.55 0.00 0.00 66.41 64.47 1loo h THR 282 Cb 0.11 2.02 -0.01 0.00 -1.73 0.00 0.00 68.15 68.54 1loo h THR 282 CO -0.01 0.22 -0.95 1.23 -0.25 0.00 0.00 175.52 175.76 1loo h GLY 283 N 3.09 0.00 0.00 5.82 0.00 -0.58 -3.39 103.07 108.01 1loo h GLY 283 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1loo h GLY 283 CO 0.03 0.00 -0.88 1.04 0.00 0.00 0.00 176.54 176.73 1loo n LEU 284 N -2.85 0.06 -1.06 3.11 4.77 -0.49 -1.29 117.00 119.25 1loo n LEU 284 Ca -0.02 -0.16 -0.06 0.00 -0.03 0.00 0.00 56.01 55.75 1loo n LEU 284 Cb 0.65 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.75 1loo n LEU 284 CO 0.40 0.02 0.02 0.61 -1.33 0.00 0.00 177.39 177.11 1loo n GLY 285 N 1.90 0.46 3.43 -0.72 0.00 0.10 -4.64 105.19 105.72 1loo n GLY 285 Ca -0.00 -0.52 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 1loo n GLY 285 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1loo s ILE 286 N -2.83 2.55 0.70 -0.61 -4.36 -1.12 -4.93 121.20 110.59 1loo s ILE 286 Ca 0.10 -1.45 -0.11 0.00 -0.26 0.00 0.00 60.65 58.93 1loo s ILE 286 Cb -0.04 -2.10 0.01 0.00 1.25 0.00 0.00 42.46 41.57 1loo s ILE 286 CO 0.13 0.22 1.06 -2.16 0.24 0.00 0.00 174.94 174.43 1loo s PRO 287 N -1.74 2.92 0.38 0.37 0.04 -1.26 -4.43 135.00 131.27 1loo s PRO 287 Ca 0.15 0.87 0.12 0.00 0.04 0.00 0.00 61.00 62.17 1loo s PRO 287 Cb -0.10 -1.99 0.91 0.00 0.04 0.00 0.00 34.50 33.35 1loo s PRO 287 CO 0.06 -1.09 1.87 -1.00 0.04 0.00 0.00 177.00 176.89 1loo h PRO 288 N -0.71 0.57 0.00 0.56 0.13 -1.98 -0.42 132.00 130.16 1loo h PRO 288 Ca -0.44 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1loo h PRO 288 Cb 1.22 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1loo h PRO 288 CO 0.58 0.38 0.00 0.00 -0.23 0.00 0.00 178.00 178.73 1loo n GLN 289 N -4.55 0.16 -0.36 0.86 0.00 -1.26 -1.26 117.38 110.97 1loo n GLN 289 Ca 0.17 0.51 0.07 0.00 0.00 0.00 0.00 57.00 57.75 1loo n GLN 289 Cb 0.53 -1.88 0.23 0.00 0.00 0.00 0.00 30.24 29.13 1loo n GLN 289 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1loo n ASN 290 N -2.18 3.11 -4.49 2.61 4.13 -0.17 -4.78 115.26 113.49 1loo n ASN 290 Ca 0.01 -2.19 -0.37 0.00 1.68 0.00 0.00 54.58 53.70 1loo n ASN 290 Cb 0.14 -0.42 -0.12 0.00 -1.54 0.00 0.00 39.78 37.84 1loo n ASN 290 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1loo s ILE 291 N -1.60 4.66 0.00 2.41 -1.09 -0.39 0.01 121.20 125.20 1loo s ILE 291 Ca 0.34 -0.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.70 1loo s ILE 291 Cb 0.20 -3.20 0.00 0.00 -1.58 0.00 0.00 42.46 37.88 1loo s ILE 291 CO 0.19 0.30 0.00 0.61 -1.23 0.00 0.00 174.94 174.81 1loo n GLY 292 N 4.97 0.35 3.73 6.18 0.00 0.11 -4.80 105.19 115.73 1loo n GLY 292 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1loo n GLY 292 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1loo s ASP 293 N -0.70 6.94 -0.27 1.61 -0.00 -1.22 -4.91 116.67 118.11 1loo s ASP 293 Ca 0.00 2.32 0.01 0.00 -0.00 0.00 0.00 52.55 54.88 1loo s ASP 293 Cb 0.00 -2.60 0.07 0.00 -0.00 0.00 0.00 42.92 40.39 1loo s ASP 293 CO 0.00 -0.52 -0.02 -0.69 -0.00 0.00 0.00 175.17 173.94 1loo s VAL 294 N 0.35 1.67 -0.18 -1.27 1.01 -1.26 0.58 120.40 121.30 1loo s VAL 294 Ca 0.58 -1.51 -0.15 0.00 0.00 0.00 0.00 61.98 60.89 1loo s VAL 294 Cb -0.35 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 1loo s VAL 294 CO 0.36 -0.27 0.34 -0.31 0.00 0.00 0.00 175.10 175.22 1loo s TYR 295 N 1.29 3.42 -0.27 5.22 2.02 0.18 -0.82 117.35 128.39 1loo s TYR 295 Ca -0.01 0.59 -0.16 0.00 -0.37 0.00 0.00 57.07 57.13 1loo s TYR 295 Cb -0.19 -2.42 -0.03 0.00 -0.40 0.00 0.00 41.96 38.92 1loo s TYR 295 CO -0.09 0.12 0.41 0.20 -1.57 0.00 0.00 175.55 174.63 1loo s GLY 296 N 0.75 1.87 -0.40 0.71 0.00 -0.58 -1.20 107.32 108.48 1loo s GLY 296 Ca 0.17 -0.77 -0.21 0.00 0.00 0.00 0.00 44.72 43.91 1loo s GLY 296 CO 0.06 1.06 0.69 0.14 0.00 0.00 0.00 173.10 175.05 1loo s VAL 297 N 2.14 4.80 -0.23 1.40 1.01 -0.06 -1.00 120.40 128.46 1loo s VAL 297 Ca 0.17 0.48 -0.02 0.00 0.00 0.00 0.00 61.98 62.60 1loo s VAL 297 Cb -0.16 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.05 1loo s VAL 297 CO 0.10 -0.49 -0.06 -0.69 0.00 0.00 0.00 175.10 173.96 1loo s VAL 298 N 2.92 3.00 0.34 2.92 1.01 0.12 -2.13 120.40 128.57 1loo s VAL 298 Ca 0.26 -0.81 -0.27 0.00 0.00 0.00 0.00 61.98 61.17 1loo s VAL 298 Cb -0.14 -2.44 -0.09 0.00 0.00 0.00 0.00 36.38 33.71 1loo s VAL 298 CO 0.18 0.31 1.04 -0.75 0.00 0.00 0.00 175.10 175.89 1loo s LYS 299 N 1.38 4.43 0.09 2.72 2.20 -1.26 -0.52 119.74 128.78 1loo s LYS 299 Ca 0.03 1.59 0.06 0.00 -0.36 0.00 0.00 55.97 57.28 1loo s LYS 299 Cb -0.15 -2.85 0.32 0.00 -1.51 0.00 0.00 37.83 33.63 1loo s LYS 299 CO -0.05 0.08 1.16 0.00 -0.36 0.00 0.00 175.35 176.18 1loo n ALA 300 N 0.55 0.98 -2.73 3.13 0.00 0.12 -4.64 120.51 117.92 1loo n ALA 300 Ca 0.02 0.05 -0.12 0.00 0.00 0.00 0.00 53.44 53.39 1loo n ALA 300 Cb 0.48 -1.05 -0.07 0.00 0.00 0.00 0.00 19.45 18.81 1loo n ALA 300 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1loo s TYR 301 N -3.12 0.91 -0.10 0.00 1.13 -1.26 -4.38 117.35 110.52 1loo s TYR 301 Ca -0.01 -1.16 -0.04 0.00 -1.41 0.00 0.00 57.07 54.46 1loo s TYR 301 Cb 0.02 -0.19 -0.04 0.00 -1.10 0.00 0.00 41.96 40.65 1loo s TYR 301 CO 0.05 -0.91 0.05 0.99 -2.51 0.00 0.00 175.55 173.22 1loo s THR 302 N -3.75 4.74 0.11 -3.49 2.01 -0.66 -4.80 115.64 109.80 1loo s THR 302 Ca 0.31 -0.08 0.04 0.00 0.31 0.00 0.00 61.69 62.27 1loo s THR 302 Cb 0.02 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 1loo s THR 302 CO 0.14 0.60 -0.10 0.42 -0.69 0.00 0.00 174.62 174.99 1loo s THR 303 N -0.83 1.01 -0.08 -0.82 -4.23 -1.26 -0.56 115.64 108.86 1loo s THR 303 Ca 0.13 -1.79 -0.19 0.00 -1.18 0.00 0.00 61.69 58.65 1loo s THR 303 Cb -0.12 -1.54 0.04 0.00 1.34 0.00 0.00 72.50 72.23 1loo s THR 303 CO 0.03 -0.63 0.46 -0.60 -0.54 0.00 0.00 174.62 173.33 1loo s ARG 304 N -3.15 0.72 -0.18 3.99 3.52 -0.62 -4.34 118.95 118.89 1loo s ARG 304 Ca 0.09 0.22 -0.06 0.00 -0.13 0.00 0.00 55.73 55.86 1loo s ARG 304 Cb -0.01 0.34 -0.03 0.00 -1.56 0.00 0.00 34.95 33.69 1loo s ARG 304 CO -0.00 -0.18 0.01 0.08 -0.81 0.00 0.00 175.30 174.41 1loo s VAL 305 N -0.73 4.23 0.00 7.11 1.01 -1.26 -0.83 120.40 129.92 1loo s VAL 305 Ca -0.08 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.67 1loo s VAL 305 Cb -0.03 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.45 1loo s VAL 305 CO 0.04 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.20 1loo n GLY 306 N 3.85 -3.06 3.78 4.51 0.00 -1.26 -4.97 105.19 108.04 1loo n GLY 306 Ca -0.17 -1.76 -0.31 0.00 0.00 0.00 0.00 46.02 43.78 1loo n GLY 306 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1loo s ILE 307 N -0.96 3.45 0.00 -0.61 -4.36 -1.26 -4.95 121.20 112.51 1loo s ILE 307 Ca 0.00 0.47 0.00 0.00 -0.26 0.00 0.00 60.65 60.86 1loo s ILE 307 Cb 0.00 -3.08 0.00 0.00 1.25 0.00 0.00 42.46 40.63 1loo s ILE 307 CO 0.00 -0.62 0.00 0.61 0.24 0.00 0.00 174.94 175.17 1loo n GLY 308 N -1.60 3.99 3.77 6.27 0.00 -1.26 -5.00 105.19 111.36 1loo n GLY 308 Ca 0.08 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 44.06 1loo n GLY 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1loo s ALA 309 N -2.16 3.59 -0.43 4.61 0.00 -1.26 -4.97 121.76 121.13 1loo s ALA 309 Ca 0.00 1.47 0.05 0.00 0.00 0.00 0.00 51.96 53.48 1loo s ALA 309 Cb 0.00 -3.58 0.17 0.00 0.00 0.00 0.00 23.12 19.71 1loo s ALA 309 CO 0.00 -0.91 0.44 0.12 0.00 0.00 0.00 175.76 175.41 1loo s PHE 310 N -0.84 0.18 0.27 0.00 2.19 -1.26 -5.00 117.98 113.52 1loo s PHE 310 Ca 0.54 -1.65 -0.09 0.00 0.33 0.00 0.00 56.93 56.06 1loo s PHE 310 Cb -0.45 -0.52 0.43 0.00 -1.31 0.00 0.00 43.02 41.17 1loo s PHE 310 CO 0.56 -0.97 1.57 -1.35 1.83 0.00 0.00 175.22 176.87 1loo h PRO 311 N 5.69 -0.00 -0.51 10.12 0.11 -1.93 -1.45 132.00 144.02 1loo h PRO 311 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1loo h PRO 311 Cb 0.98 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1loo h PRO 311 CO 0.25 -0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.29 1loo n THR 312 N -5.60 0.69 -1.61 -1.15 -2.24 -1.26 -4.83 114.28 98.28 1loo n THR 312 Ca 0.15 -0.69 -0.45 0.00 -2.27 0.00 0.00 64.05 60.78 1loo n THR 312 Cb 0.48 0.36 -0.02 0.00 -2.10 0.00 0.00 70.33 69.04 1loo n THR 312 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1loo n GLU 313 N 1.02 1.45 -3.91 -0.78 2.13 -0.55 -2.27 120.64 117.73 1loo n GLU 313 Ca 0.17 0.51 -0.31 0.00 0.66 0.00 0.00 57.16 58.19 1loo n GLU 313 Cb 0.44 -1.96 -0.13 0.00 0.27 0.00 0.00 31.44 30.06 1loo n GLU 313 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 1loo s GLN 314 N -1.18 2.08 -1.25 5.31 -1.52 0.40 -4.90 119.66 118.60 1loo s GLN 314 Ca 0.63 -2.60 -0.12 0.00 -1.95 0.00 0.00 55.36 51.32 1loo s GLN 314 Cb -0.72 -3.40 0.16 0.00 -0.22 0.00 0.00 33.01 28.84 1loo s GLN 314 CO 0.57 -1.12 1.67 -0.89 -0.25 0.00 0.00 175.29 175.27 1loo n ILE 315 N 3.20 4.27 -2.51 1.08 5.41 -1.26 -3.20 119.36 126.35 1loo n ILE 315 Ca 0.06 -4.52 0.00 0.00 1.00 0.00 0.00 62.75 59.28 1loo n ILE 315 Cb 0.33 -2.41 0.00 0.00 -0.71 0.00 0.00 39.64 36.85 1loo n ILE 315 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1loo n ASN 316 N 4.90 0.00 0.18 4.38 0.23 -1.26 -5.01 115.26 118.68 1loo n ASN 316 Ca 0.39 -0.23 0.04 0.00 -0.53 0.00 0.00 54.58 54.25 1loo n ASN 316 Cb 0.40 0.00 0.47 0.00 -2.08 0.00 0.00 39.78 38.57 1loo n ASN 316 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1loo h GLU 317 N 0.00 0.10 -0.01 -3.83 9.09 -1.99 -2.05 114.58 115.88 1loo h GLU 317 Ca 0.00 -0.02 -0.00 0.00 0.05 0.00 0.00 59.36 59.39 1loo h GLU 317 Cb 0.00 -0.02 -0.00 0.00 -1.65 0.00 0.00 28.75 27.08 1loo h GLU 317 CO 0.00 0.24 -0.00 0.82 0.05 0.00 0.00 179.01 180.12 1loo h ILE 318 N 0.10 1.26 -0.71 -1.06 1.08 -1.96 -1.67 117.51 114.55 1loo h ILE 318 Ca 0.02 -0.77 0.01 0.00 -0.39 0.00 0.00 64.86 63.73 1loo h ILE 318 Cb 0.31 1.76 -0.04 0.00 -3.07 0.00 0.00 36.82 35.78 1loo h ILE 318 CO 0.02 0.20 0.47 1.23 -0.69 0.00 0.00 178.15 179.38 1loo h GLY 319 N -0.30 1.00 1.03 5.37 0.00 -1.47 0.25 103.07 108.95 1loo h GLY 319 Ca 0.00 -0.37 -0.07 0.00 0.00 0.00 0.00 47.33 46.89 1loo h GLY 319 CO 0.00 0.36 0.10 -0.55 0.00 0.00 0.00 176.54 176.45 1loo h ASP 320 N 0.96 0.92 -0.53 0.19 3.32 -1.29 0.11 116.42 120.10 1loo h ASP 320 Ca 0.26 -0.26 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 1loo h ASP 320 Cb -0.10 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.19 1loo h ASP 320 CO -0.06 0.95 0.14 0.25 -1.72 0.00 0.00 179.24 178.80 1loo h LEU 321 N 0.87 0.80 -0.54 1.55 5.85 -0.30 0.14 115.31 123.67 1loo h LEU 321 Ca 0.18 -0.23 -0.15 0.00 0.84 0.00 0.00 57.88 58.52 1loo h LEU 321 Cb 0.41 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1loo h LEU 321 CO 0.01 0.82 -0.42 -0.07 -0.34 0.00 0.00 178.44 178.44 1loo h LEU 322 N 0.74 0.76 -0.64 2.25 3.38 -0.84 -0.58 115.31 120.39 1loo h LEU 322 Ca 0.17 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 1loo h LEU 322 Cb 0.32 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1loo h LEU 322 CO 0.00 1.08 0.25 -0.61 0.09 0.00 0.00 178.44 179.25 1loo h GLN 323 N 0.58 0.96 0.01 1.13 4.15 -0.44 -1.13 115.11 120.37 1loo h GLN 323 Ca 0.04 -0.18 -0.00 0.00 0.77 0.00 0.00 58.65 59.28 1loo h GLN 323 Cb 0.96 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.50 1loo h GLN 323 CO 0.09 0.82 -0.01 -0.91 -1.93 0.00 0.00 178.83 176.89 1loo h ASN 324 N 0.90 -0.01 0.33 -0.69 -0.26 -0.60 -0.65 115.58 114.60 1loo h ASN 324 Ca 0.21 -0.79 -0.04 0.00 -0.56 0.00 0.00 56.30 55.13 1loo h ASN 324 Cb 0.22 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.48 1loo h ASN 324 CO -0.02 0.82 -0.19 0.03 -1.06 0.00 0.00 177.43 177.02 1loo h ARG 325 N -0.90 0.00 -0.02 0.81 3.08 -1.17 -2.23 114.38 113.95 1loo h ARG 325 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1loo h ARG 325 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1loo h ARG 325 CO 0.00 0.19 -0.11 0.41 -1.07 0.00 0.00 179.97 179.39 1loo n GLY 326 N -0.71 0.40 3.87 0.04 0.00 -0.43 -4.88 105.19 103.49 1loo n GLY 326 Ca -0.02 -0.59 -0.25 0.00 0.00 0.00 0.00 46.02 45.16 1loo n GLY 326 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1loo n HIS 327 N 0.60 -1.84 -2.73 1.61 8.25 -0.84 -4.85 115.22 115.43 1loo n HIS 327 Ca 0.14 0.81 -0.43 0.00 -0.26 0.00 0.00 57.72 57.98 1loo n HIS 327 Cb 0.49 -3.97 -0.01 0.00 1.12 0.00 0.00 29.99 27.61 1loo n HIS 327 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1loo s GLU 328 N -6.36 3.90 -0.01 -0.41 0.41 -0.30 -4.90 118.70 111.03 1loo s GLU 328 Ca 0.13 -1.99 -0.19 0.00 -0.41 0.00 0.00 54.97 52.51 1loo s GLU 328 Cb -0.07 -5.29 0.04 0.00 -1.78 0.00 0.00 34.13 27.03 1loo s GLU 328 CO 0.85 -2.04 0.42 1.67 -0.49 0.00 0.00 175.26 175.67 1loo s TRP 329 N 3.38 -0.31 0.14 1.61 -2.14 -1.26 -0.71 118.94 119.65 1loo s TRP 329 Ca 0.47 0.44 -0.34 0.00 2.66 0.00 0.00 56.10 59.33 1loo s TRP 329 Cb 0.00 0.20 -0.13 0.00 -3.10 0.00 0.00 33.47 30.44 1loo s TRP 329 CO 0.00 -0.49 1.62 0.41 -2.66 0.00 0.00 176.95 175.84 1loo n GLY 330 N 0.97 1.20 0.37 3.67 0.00 0.66 -4.85 105.19 107.21 1loo n GLY 330 Ca -0.20 0.67 0.07 0.00 0.00 0.00 0.00 46.02 46.56 1loo n GLY 330 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1loo h VAL 331 N 3.82 0.93 0.00 1.61 3.04 -1.95 0.90 116.25 124.60 1loo h VAL 331 Ca -0.45 -0.34 0.00 0.00 -1.01 0.00 0.00 66.70 64.90 1loo h VAL 331 Cb 1.25 -0.13 0.00 0.00 -2.01 0.00 0.00 31.29 30.40 1loo h VAL 331 CO 0.90 0.18 -0.55 0.35 -1.01 0.00 0.00 177.57 177.44 1loo n THR 332 N -4.59 1.33 0.23 3.17 -2.24 -1.26 -4.56 114.28 106.35 1loo n THR 332 Ca 0.18 0.23 0.10 0.00 -2.27 0.00 0.00 64.05 62.29 1loo n THR 332 Cb 0.35 -2.32 0.50 0.00 -2.10 0.00 0.00 70.33 66.75 1loo n THR 332 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1loo h THR 333 N -0.93 0.57 0.00 4.28 1.35 -1.97 -3.47 112.91 112.74 1loo h THR 333 Ca 0.00 -1.05 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 1loo h THR 333 Cb 0.55 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1loo h THR 333 CO 0.00 0.21 0.00 0.61 -0.25 0.00 0.00 175.52 176.09 1loo n GLY 334 N 0.03 0.72 3.72 5.82 0.00 0.31 -4.95 105.19 110.84 1loo n GLY 334 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1loo n GLY 334 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1loo s ARG 335 N -0.21 4.20 0.45 1.61 0.52 -1.26 -4.44 118.95 119.82 1loo s ARG 335 Ca 0.00 2.40 -0.23 0.00 -0.52 0.00 0.00 55.73 57.37 1loo s ARG 335 Cb 0.00 -3.13 -0.08 0.00 0.52 0.00 0.00 34.95 32.27 1loo s ARG 335 CO 0.00 -0.60 1.17 0.15 0.02 0.00 0.00 175.30 176.04 1loo s LYS 336 N 0.81 3.81 0.09 3.54 1.02 -1.26 -0.25 119.74 127.50 1loo s LYS 336 Ca 0.69 1.80 -0.04 0.00 0.02 0.00 0.00 55.97 58.44 1loo s LYS 336 Cb -0.44 -2.46 -0.05 0.00 -0.52 0.00 0.00 37.83 34.35 1loo s LYS 336 CO 0.34 -0.52 0.31 1.03 -0.92 0.00 0.00 175.35 175.60 1loo s ARG 337 N -2.61 3.57 0.30 1.68 0.52 0.11 -4.88 118.95 117.64 1loo s ARG 337 Ca 0.62 -0.16 -0.29 0.00 -0.52 0.00 0.00 55.73 55.38 1loo s ARG 337 Cb -0.29 -2.96 -0.10 0.00 0.52 0.00 0.00 34.95 32.12 1loo s ARG 337 CO 0.36 0.55 1.23 1.03 0.02 0.00 0.00 175.30 178.49 1loo s ARG 338 N -2.37 4.47 0.07 3.54 0.52 -0.01 -4.86 118.95 120.31 1loo s ARG 338 Ca 0.36 2.04 0.09 0.00 -0.52 0.00 0.00 55.73 57.69 1loo s ARG 338 Cb -0.13 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 32.18 1loo s ARG 338 CO 0.23 -0.04 -0.23 0.00 0.02 0.00 0.00 175.30 175.28 1loo s GLY 340 N -1.43 0.81 0.74 0.00 0.00 0.27 -0.45 107.32 107.26 1loo s GLY 340 Ca 0.09 -1.05 -0.11 0.00 0.00 0.00 0.00 44.72 43.66 1loo s GLY 340 CO 0.03 -0.58 1.08 -0.98 0.00 0.00 0.00 173.10 172.65 1loo s TRP 341 N -2.59 2.83 0.38 1.90 0.52 -0.96 -1.65 118.94 119.37 1loo s TRP 341 Ca 0.21 1.49 -0.27 0.00 0.02 0.00 0.00 56.10 57.55 1loo s TRP 341 Cb -0.03 -2.97 -0.11 0.00 -1.15 0.00 0.00 33.47 29.21 1loo s TRP 341 CO 0.15 -1.54 1.30 -0.11 0.02 0.00 0.00 176.95 176.77 1loo n LEU 342 N -3.34 3.92 -3.90 2.99 7.94 -1.26 -3.69 117.00 119.66 1loo n LEU 342 Ca 0.08 1.16 -0.30 0.00 -1.11 0.00 0.00 56.01 55.84 1loo n LEU 342 Cb 0.53 -1.51 -0.15 0.00 0.53 0.00 0.00 43.42 42.82 1loo n LEU 342 CO 0.55 -0.49 -0.37 -0.62 -1.11 0.00 0.00 177.39 175.35 1loo s ASP 343 N -0.40 4.17 0.57 1.96 -1.08 -1.26 -0.90 116.67 119.73 1loo s ASP 343 Ca 0.58 -1.60 0.35 0.00 -0.52 0.00 0.00 52.55 51.36 1loo s ASP 343 Cb -0.53 -1.22 1.61 0.00 -1.46 0.00 0.00 42.92 41.32 1loo s ASP 343 CO 0.60 -0.33 2.08 -0.07 0.52 0.00 0.00 175.17 177.97 1loo h LEU 344 N 7.89 0.00 -0.69 -1.34 3.38 -1.29 -2.68 115.31 120.58 1loo h LEU 344 Ca -0.12 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1loo h LEU 344 Cb 1.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1loo h LEU 344 CO 0.46 0.03 -0.25 0.24 0.09 0.00 0.00 178.44 179.02 1loo h MET 345 N 0.00 0.75 -0.20 1.13 2.86 -1.82 0.41 114.93 118.07 1loo h MET 345 Ca -0.00 -0.31 -0.05 0.00 -2.06 0.00 0.00 59.70 57.28 1loo h MET 345 Cb 0.38 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1loo h MET 345 CO 0.00 0.92 -0.06 0.82 1.06 0.00 0.00 176.91 179.65 1loo h ILE 346 N 0.65 1.29 -0.23 -1.22 2.04 -1.88 -2.45 117.51 115.72 1loo h ILE 346 Ca 0.09 -1.07 0.01 0.00 1.00 0.00 0.00 64.86 64.89 1loo h ILE 346 Cb 0.76 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.41 1loo h ILE 346 CO 0.06 0.32 0.13 -0.07 0.00 0.00 0.00 178.15 178.59 1loo h LEU 347 N 0.10 0.20 -0.57 1.44 4.07 -1.27 -0.55 115.31 118.73 1loo h LEU 347 Ca 0.05 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.95 1loo h LEU 347 Cb 0.52 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 42.20 1loo h LEU 347 CO 0.02 0.15 0.13 0.03 -1.08 0.00 0.00 178.44 177.70 1loo h ARG 348 N 0.26 0.92 -0.20 1.13 3.08 -0.97 -2.05 114.38 116.55 1loo h ARG 348 Ca 0.09 -0.22 0.04 0.00 0.07 0.00 0.00 59.98 59.95 1loo h ARG 348 Cb 0.00 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 1loo h ARG 348 CO -0.05 0.86 -0.04 -0.92 -1.07 0.00 0.00 179.97 178.75 1loo h TYR 349 N 0.82 -0.09 -0.49 3.04 3.20 -1.20 0.24 116.97 122.50 1loo h TYR 349 Ca 0.18 0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.15 1loo h TYR 349 Cb 0.36 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 1loo h TYR 349 CO 0.03 -0.08 0.33 0.00 -1.64 0.00 0.00 178.16 176.80 1loo h ALA 350 N 1.19 2.05 0.08 1.82 0.00 -0.83 -1.69 119.26 121.89 1loo h ALA 350 Ca 0.10 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.73 1loo h ALA 350 Cb 0.14 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.88 1loo h ALA 350 CO -0.20 -0.15 -1.14 1.25 0.00 0.00 0.00 179.25 179.01 1loo h HIS 351 N 0.31 0.72 -0.63 0.00 -0.00 -0.47 0.35 115.15 115.43 1loo h HIS 351 Ca 0.22 -0.45 0.08 0.00 -0.00 0.00 0.00 60.37 60.22 1loo h HIS 351 Cb 0.47 -0.06 -0.06 0.00 -0.00 0.00 0.00 27.41 27.76 1loo h HIS 351 CO -0.00 1.30 0.30 0.52 -0.00 0.00 0.00 177.93 180.05 1loo h MET 352 N 0.20 0.53 -0.01 5.26 2.07 -0.10 0.44 114.93 123.31 1loo h MET 352 Ca -0.13 -0.03 -0.23 0.00 -2.07 0.00 0.00 59.70 57.24 1loo h MET 352 Cb 1.81 -0.12 0.02 0.00 -1.87 0.00 0.00 31.60 31.44 1loo h MET 352 CO 0.20 0.35 -0.87 0.28 1.07 0.00 0.00 176.91 177.94 1loo h VAL 353 N 0.54 1.33 0.00 -2.22 2.07 -1.40 -3.38 116.25 113.19 1loo h VAL 353 Ca 0.30 -2.16 0.00 0.00 0.82 0.00 0.00 66.70 65.66 1loo h VAL 353 Cb 0.29 2.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.48 1loo h VAL 353 CO -0.24 0.66 -1.53 0.59 0.02 0.00 0.00 177.57 177.07 1loo n ASN 354 N -3.99 0.38 -3.60 0.57 3.02 0.11 -4.70 115.26 107.05 1loo n ASN 354 Ca -0.11 -0.10 -0.20 0.00 -0.03 0.00 0.00 54.58 54.14 1loo n ASN 354 Cb 0.80 1.39 0.05 0.00 -0.61 0.00 0.00 39.78 41.41 1loo n ASN 354 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1loo n GLY 355 N 1.30 -0.39 3.68 7.41 0.00 0.15 -4.81 105.19 112.53 1loo n GLY 355 Ca -0.01 0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1loo n GLY 355 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1loo n PHE 356 N -4.17 2.04 -0.02 1.61 0.99 -1.26 -4.80 117.46 111.86 1loo n PHE 356 Ca -0.28 0.56 0.09 0.00 -0.00 0.00 0.00 57.45 57.81 1loo n PHE 356 Cb 0.67 -2.37 -0.16 0.00 -1.00 0.00 0.00 39.48 36.62 1loo n PHE 356 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1loo n THR 357 N 0.12 0.20 -3.48 4.37 -2.24 -0.00 -4.96 114.28 108.27 1loo n THR 357 Ca 0.06 -0.54 -0.12 0.00 -2.27 0.00 0.00 64.05 61.18 1loo n THR 357 Cb 0.37 -0.07 -0.03 0.00 -2.10 0.00 0.00 70.33 68.49 1loo n THR 357 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1loo s ALA 358 N -3.39 -1.43 0.23 6.98 0.00 -1.23 -4.57 121.76 118.35 1loo s ALA 358 Ca -0.08 0.39 0.10 0.00 0.00 0.00 0.00 51.96 52.38 1loo s ALA 358 Cb 0.13 0.79 -0.04 0.00 0.00 0.00 0.00 23.12 24.00 1loo s ALA 358 CO 0.89 -0.72 -0.14 -0.51 0.00 0.00 0.00 175.76 175.29 1loo s LEU 359 N -2.68 2.79 -0.35 0.00 1.43 0.68 -1.52 118.68 119.03 1loo s LEU 359 Ca 0.01 -0.78 0.02 0.00 -1.03 0.00 0.00 54.13 52.35 1loo s LEU 359 Cb -0.00 -1.41 0.11 0.00 0.03 0.00 0.00 46.19 44.92 1loo s LEU 359 CO -0.12 0.07 0.10 0.00 0.23 0.00 0.00 176.35 176.63 1loo s ALA 360 N -2.05 2.39 -0.40 4.21 0.00 -0.17 -0.36 121.76 125.38 1loo s ALA 360 Ca 0.27 -2.30 -0.24 0.00 0.00 0.00 0.00 51.96 49.69 1loo s ALA 360 Cb -0.07 -1.86 0.02 0.00 0.00 0.00 0.00 23.12 21.21 1loo s ALA 360 CO 0.15 -1.74 0.83 -1.17 0.00 0.00 0.00 175.76 173.83 1loo s LEU 361 N 1.02 4.12 0.27 0.00 2.96 -0.32 -0.71 118.68 126.01 1loo s LEU 361 Ca 0.12 0.23 0.08 0.00 -0.22 0.00 0.00 54.13 54.34 1loo s LEU 361 Cb -0.19 -3.07 -0.04 0.00 0.50 0.00 0.00 46.19 43.39 1loo s LEU 361 CO -0.13 -0.85 0.14 0.42 -1.32 0.00 0.00 176.35 174.62 1loo s THR 362 N 3.31 4.05 -1.65 3.68 -4.23 0.32 0.24 115.64 121.36 1loo s THR 362 Ca 0.33 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 1loo s THR 362 Cb -0.12 -3.21 0.00 0.00 1.34 0.00 0.00 72.50 70.50 1loo s THR 362 CO 0.20 -0.34 0.00 0.29 -0.54 0.00 0.00 174.62 174.23 1loo n LYS 363 N -1.11 -1.39 -0.16 3.99 5.02 -1.12 0.10 118.16 123.49 1loo n LYS 363 Ca -0.07 0.95 0.08 0.00 -2.02 0.00 0.00 58.31 57.25 1loo n LYS 363 Cb 0.58 -5.39 0.40 0.00 -0.02 0.00 0.00 35.03 30.60 1loo n LYS 363 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1loo h LEU 364 N 0.00 0.58 -2.15 -0.35 5.85 -1.64 -1.10 115.31 116.50 1loo h LEU 364 Ca -0.41 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.33 1loo h LEU 364 Cb 1.28 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 1loo h LEU 364 CO 0.52 0.36 0.03 -2.24 -0.34 0.00 0.00 178.44 176.77 1loo h ASP 365 N 0.65 0.00 -0.20 1.25 3.04 -1.85 -1.31 116.42 118.00 1loo h ASP 365 Ca 0.31 0.00 0.05 0.00 -3.24 0.00 0.00 57.03 54.16 1loo h ASP 365 Cb 0.38 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.66 1loo h ASP 365 CO -0.11 0.00 0.14 0.40 -2.04 0.00 0.00 179.24 177.63 1loo h ILE 366 N 0.00 0.92 -0.01 4.15 5.03 -1.53 -1.22 117.51 124.85 1loo h ILE 366 Ca 0.02 -0.01 0.00 0.00 -0.12 0.00 0.00 64.86 64.75 1loo h ILE 366 Cb 0.08 0.88 0.00 0.00 -3.03 0.00 0.00 36.82 34.75 1loo h ILE 366 CO -0.00 0.01 -0.09 0.18 -0.68 0.00 0.00 178.15 177.57 1loo n LEU 367 N -4.49 0.95 -0.20 1.44 4.77 -0.49 -4.27 117.00 114.71 1loo n LEU 367 Ca 0.02 -0.26 0.30 0.00 -0.03 0.00 0.00 56.01 56.04 1loo n LEU 367 Cb 0.26 -0.07 0.72 0.00 -2.33 0.00 0.00 43.42 42.00 1loo n LEU 367 CO 0.35 0.17 1.28 0.44 -1.33 0.00 0.00 177.39 178.29 1loo h ASP 368 N 1.35 0.00 0.97 -1.43 5.19 -1.29 -2.39 116.42 118.82 1loo h ASP 368 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1loo h ASP 368 Cb 0.40 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.91 1loo h ASP 368 CO 0.00 0.00 -0.65 0.58 -3.12 0.00 0.00 179.24 176.05 1loo h VAL 369 N 0.00 0.00 -3.94 -1.35 2.07 -1.80 -1.98 116.25 109.24 1loo h VAL 369 Ca 0.45 -0.61 -0.46 0.00 0.82 0.00 0.00 66.70 66.90 1loo h VAL 369 Cb 1.97 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.92 1loo h VAL 369 CO -0.00 0.00 0.30 -0.76 0.02 0.00 0.00 177.57 177.12 1loo s LEU 370 N -4.55 4.09 -0.01 2.57 1.43 -0.90 -4.87 118.68 116.44 1loo s LEU 370 Ca 0.05 1.66 -0.05 0.00 -1.03 0.00 0.00 54.13 54.76 1loo s LEU 370 Cb 0.12 -4.28 -0.29 0.00 0.03 0.00 0.00 46.19 41.77 1loo s LEU 370 CO 0.73 -0.24 0.82 0.28 0.23 0.00 0.00 176.35 178.17 1loo h SER 371 N 2.38 0.46 -4.25 2.29 0.02 -1.91 -3.34 113.55 109.19 1loo h SER 371 Ca -0.48 -0.64 -0.18 0.00 -0.84 0.00 0.00 61.79 59.65 1loo h SER 371 Cb 1.18 -0.15 -0.24 0.00 0.14 0.00 0.00 62.40 63.33 1loo h SER 371 CO 0.63 1.53 -0.58 -1.83 -1.14 0.00 0.00 176.83 175.45 1loo s GLU 372 N -2.61 0.25 -0.05 3.45 -1.05 -1.26 -0.00 118.70 117.43 1loo s GLU 372 Ca -0.11 -0.09 0.06 0.00 -0.15 0.00 0.00 54.97 54.68 1loo s GLU 372 Cb 0.06 0.11 -0.01 0.00 -0.44 0.00 0.00 34.13 33.85 1loo s GLU 372 CO 0.86 -0.05 -0.24 0.42 0.95 0.00 0.00 175.26 177.20 1loo s ILE 373 N -0.53 1.93 0.03 1.83 1.01 0.20 -4.82 121.20 120.84 1loo s ILE 373 Ca -0.06 -1.00 -0.01 0.00 0.00 0.00 0.00 60.65 59.58 1loo s ILE 373 Cb -0.04 -1.63 -0.04 0.00 0.01 0.00 0.00 42.46 40.77 1loo s ILE 373 CO 0.00 0.54 0.17 -0.54 0.00 0.00 0.00 174.94 175.11 1loo s LYS 374 N -0.21 3.34 -0.06 2.79 1.02 -1.26 0.27 119.74 125.63 1loo s LYS 374 Ca -0.01 -0.42 -0.02 0.00 0.02 0.00 0.00 55.97 55.54 1loo s LYS 374 Cb -0.13 -3.01 0.03 0.00 -0.52 0.00 0.00 37.83 34.21 1loo s LYS 374 CO 0.03 0.64 0.04 0.08 -0.92 0.00 0.00 175.35 175.21 1loo s VAL 375 N -1.39 0.11 0.03 3.17 1.01 -1.03 -4.04 120.40 118.26 1loo s VAL 375 Ca 0.30 0.26 -0.30 0.00 0.00 0.00 0.00 61.98 62.24 1loo s VAL 375 Cb -0.13 -0.34 -0.06 0.00 0.00 0.00 0.00 36.38 35.85 1loo s VAL 375 CO 0.22 0.19 1.46 -0.83 0.00 0.00 0.00 175.10 176.15 1loo s GLY 376 N 2.08 1.79 -0.03 4.51 0.00 -0.08 -1.63 107.32 113.96 1loo s GLY 376 Ca 0.05 0.99 0.14 0.00 0.00 0.00 0.00 44.72 45.90 1loo s GLY 376 CO -0.04 2.59 0.29 0.29 0.00 0.00 0.00 173.10 176.23 1loo n ILE 377 N 4.60 0.09 -3.68 0.90 -5.35 0.82 -0.80 119.36 115.93 1loo n ILE 377 Ca 0.14 -0.35 -0.07 0.00 -0.27 0.00 0.00 62.75 62.19 1loo n ILE 377 Cb 0.43 0.09 -0.02 0.00 -1.74 0.00 0.00 39.64 38.40 1loo n ILE 377 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1loo s SER 378 N -3.77 -0.30 -0.04 7.28 1.04 -1.21 -4.61 113.70 112.09 1loo s SER 378 Ca -0.05 -0.33 0.03 0.00 0.48 0.00 0.00 55.95 56.08 1loo s SER 378 Cb 0.09 0.56 -0.03 0.00 0.10 0.00 0.00 66.02 66.74 1loo s SER 378 CO 0.60 -1.00 -0.13 -0.31 0.98 0.00 0.00 173.24 173.37 1loo s TYR 379 N -3.54 2.74 -0.01 5.02 2.02 -1.26 -1.31 117.35 121.00 1loo s TYR 379 Ca 0.09 -0.13 0.04 0.00 -0.37 0.00 0.00 57.07 56.69 1loo s TYR 379 Cb -0.03 -1.63 -0.03 0.00 -0.40 0.00 0.00 41.96 39.88 1loo s TYR 379 CO -0.01 0.22 -0.11 0.21 -1.57 0.00 0.00 175.55 174.30 1loo s LYS 380 N -0.84 2.48 -0.11 -0.62 2.20 0.11 -1.46 119.74 121.50 1loo s LYS 380 Ca 0.12 -0.74 -0.01 0.00 -0.36 0.00 0.00 55.97 54.99 1loo s LYS 380 Cb -0.11 -2.43 0.03 0.00 -1.51 0.00 0.00 37.83 33.82 1loo s LYS 380 CO 0.01 0.61 -0.04 -1.17 -0.36 0.00 0.00 175.35 174.40 1loo s LEU 381 N -1.16 1.06 -1.48 5.43 2.96 0.46 -0.66 118.68 125.28 1loo s LEU 381 Ca 0.15 -0.31 -0.08 0.00 -0.22 0.00 0.00 54.13 53.67 1loo s LEU 381 Cb -0.11 -0.72 0.06 0.00 0.50 0.00 0.00 46.19 45.92 1loo s LEU 381 CO 0.04 -0.16 0.74 0.59 -1.32 0.00 0.00 176.35 176.24 1loo n ASN 382 N 5.00 -2.55 0.00 3.68 5.03 -1.26 -1.20 115.26 123.97 1loo n ASN 382 Ca -0.11 -0.89 0.00 0.00 0.87 0.00 0.00 54.58 54.46 1loo n ASN 382 Cb 0.50 -3.51 0.00 0.00 -1.02 0.00 0.00 39.78 35.75 1loo n ASN 382 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1loo n GLY 383 N -1.69 2.73 3.89 7.41 0.00 -1.26 -5.02 105.19 111.25 1loo n GLY 383 Ca -0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 1loo n GLY 383 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1loo s LYS 384 N -0.00 3.60 -0.17 1.61 -0.14 -0.34 -5.00 119.74 119.30 1loo s LYS 384 Ca 0.00 -0.08 -0.29 0.00 -1.36 0.00 0.00 55.97 54.24 1loo s LYS 384 Cb 0.00 -3.03 -0.00 0.00 -1.68 0.00 0.00 37.83 33.11 1loo s LYS 384 CO 0.00 0.61 1.10 0.50 -0.76 0.00 0.00 175.35 176.80 1loo s ARG 385 N -1.96 4.30 -0.13 1.68 3.52 -1.26 0.17 118.95 125.27 1loo s ARG 385 Ca 0.31 1.47 -0.07 0.00 -0.13 0.00 0.00 55.73 57.30 1loo s ARG 385 Cb -0.13 -3.64 -0.04 0.00 -1.56 0.00 0.00 34.95 29.58 1loo s ARG 385 CO 0.18 -0.56 0.13 0.96 -0.81 0.00 0.00 175.30 175.21 1loo s ILE 386 N 2.89 5.46 -2.12 4.11 -4.36 -0.54 -4.93 121.20 121.71 1loo s ILE 386 Ca 0.49 0.19 0.15 0.00 -0.26 0.00 0.00 60.65 61.22 1loo s ILE 386 Cb -0.18 -3.40 0.37 0.00 1.25 0.00 0.00 42.46 40.50 1loo s ILE 386 CO 0.12 0.59 1.41 -0.81 0.24 0.00 0.00 174.94 176.49 1loo n PRO 387 N 2.26 1.66 -4.37 0.37 -0.04 -1.26 -4.35 135.00 129.27 1loo n PRO 387 Ca -0.19 -1.01 -0.19 0.00 -0.04 0.00 0.00 63.50 62.07 1loo n PRO 387 Cb 0.54 -1.31 -0.10 0.00 -0.04 0.00 0.00 33.50 32.59 1loo n PRO 387 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1loo s TYR 388 N -1.71 1.72 -0.37 0.54 1.13 -1.26 -5.09 117.35 112.32 1loo s TYR 388 Ca 0.26 -0.76 -0.20 0.00 -1.41 0.00 0.00 57.07 54.96 1loo s TYR 388 Cb 0.14 -0.96 0.00 0.00 -1.10 0.00 0.00 41.96 40.04 1loo s TYR 388 CO 0.20 0.16 0.60 0.12 -2.51 0.00 0.00 175.55 174.12 1loo s PHE 389 N -3.17 3.15 0.18 -3.49 5.36 -1.26 -4.96 117.98 113.78 1loo s PHE 389 Ca 0.27 0.25 -0.33 0.00 -0.96 0.00 0.00 56.93 56.16 1loo s PHE 389 Cb 0.04 -3.11 -0.14 0.00 -0.34 0.00 0.00 43.02 39.47 1loo s PHE 389 CO 0.09 -0.64 1.40 -2.30 -1.46 0.00 0.00 175.22 172.32 1loo n PRO 390 N 5.99 1.78 -0.01 10.12 -0.02 -1.26 -4.95 135.00 146.65 1loo n PRO 390 Ca -0.02 0.64 -0.16 0.00 -2.02 0.00 0.00 63.50 61.93 1loo n PRO 390 Cb 0.49 -2.29 -0.11 0.00 -0.02 0.00 0.00 33.50 31.56 1loo n PRO 390 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1loo h ALA 391 N 4.58 0.06 -2.52 3.55 0.00 -1.96 -3.45 119.26 119.52 1loo h ALA 391 Ca -0.45 -0.51 -0.49 0.00 0.00 0.00 0.00 54.91 53.46 1loo h ALA 391 Cb 1.29 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1loo h ALA 391 CO 0.79 0.21 0.26 1.21 0.00 0.00 0.00 179.25 181.71 1loo s ASN 392 N -6.50 7.28 0.08 0.00 3.84 -1.26 -4.57 114.94 113.79 1loo s ASN 392 Ca -0.15 1.70 -0.26 0.00 0.21 0.00 0.00 52.86 54.36 1loo s ASN 392 Cb 0.02 -2.53 -0.16 0.00 -0.55 0.00 0.00 41.25 38.03 1loo s ASN 392 CO 0.78 0.00 1.67 1.56 -2.79 0.00 0.00 177.10 178.32 1loo h GLN 393 N 3.41 -0.25 -0.84 0.43 1.08 -1.89 -1.66 115.11 115.39 1loo h GLN 393 Ca -0.47 0.02 0.18 0.00 -1.45 0.00 0.00 58.65 56.92 1loo h GLN 393 Cb 1.19 0.06 -0.11 0.00 -0.05 0.00 0.00 27.48 28.57 1loo h GLN 393 CO 0.65 -0.14 0.36 0.93 -0.95 0.00 0.00 178.83 179.68 1loo h GLU 394 N -0.29 0.44 -0.06 1.46 3.07 -1.97 0.24 114.58 117.48 1loo h GLU 394 Ca -0.03 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.78 1loo h GLU 394 Cb 0.22 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.03 1loo h GLU 394 CO 0.04 0.29 -0.08 0.82 -1.40 0.00 0.00 179.01 178.69 1loo h ILE 395 N 0.46 1.39 -0.26 3.13 1.08 -1.95 -3.03 117.51 118.33 1loo h ILE 395 Ca 0.49 -1.30 0.07 0.00 -0.39 0.00 0.00 64.86 63.72 1loo h ILE 395 Cb 0.82 2.12 -0.01 0.00 -3.07 0.00 0.00 36.82 36.69 1loo h ILE 395 CO -0.46 0.36 0.18 0.25 -0.69 0.00 0.00 178.15 177.80 1loo h LEU 396 N -0.30 0.04 -0.77 1.44 5.85 -0.42 0.18 115.31 121.32 1loo h LEU 396 Ca 0.01 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1loo h LEU 396 Cb 0.62 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.64 1loo h LEU 396 CO 0.02 0.03 -0.06 -0.61 -0.34 0.00 0.00 178.44 177.47 1loo h GLN 397 N 0.05 0.00 0.00 1.25 5.75 -0.48 -3.23 115.11 118.44 1loo h GLN 397 Ca 0.12 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.62 1loo h GLN 397 Cb 0.43 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.98 1loo h GLN 397 CO -0.01 0.06 -0.79 1.63 -2.65 0.00 0.00 178.83 177.08 1loo n LYS 398 N -3.14 0.12 -1.85 1.69 5.02 0.60 -4.97 118.16 115.63 1loo n LYS 398 Ca 0.02 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.95 1loo n LYS 398 Cb 0.43 -1.55 0.05 0.00 -0.02 0.00 0.00 35.03 33.95 1loo n LYS 398 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1loo s VAL 399 N -3.08 2.26 -0.20 -0.18 -7.23 -1.05 -4.83 120.40 106.09 1loo s VAL 399 Ca 0.08 0.17 -0.06 0.00 -1.81 0.00 0.00 61.98 60.36 1loo s VAL 399 Cb 0.16 -3.07 -0.03 0.00 0.56 0.00 0.00 36.38 34.00 1loo s VAL 399 CO 0.77 -0.03 0.02 -0.70 -0.31 0.00 0.00 175.10 174.85 1loo s GLU 400 N -3.28 3.70 0.09 4.82 2.12 0.17 -4.91 118.70 121.40 1loo s GLU 400 Ca 0.79 -0.48 -0.23 0.00 0.36 0.00 0.00 54.97 55.41 1loo s GLU 400 Cb -0.35 -3.13 -0.07 0.00 0.26 0.00 0.00 34.13 30.84 1loo s GLU 400 CO 0.38 0.06 0.70 0.08 -0.54 0.00 0.00 175.26 175.94 1loo s VAL 401 N 0.90 4.63 -0.25 3.70 1.01 -1.26 0.07 120.40 129.21 1loo s VAL 401 Ca 0.02 1.50 -0.08 0.00 0.00 0.00 0.00 61.98 63.42 1loo s VAL 401 Cb -0.14 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 1loo s VAL 401 CO 0.02 0.47 0.08 -0.70 0.00 0.00 0.00 175.10 174.97 1loo s GLU 402 N -0.71 3.70 0.29 2.72 2.12 -0.43 -4.95 118.70 121.44 1loo s GLU 402 Ca 0.34 -0.46 0.07 0.00 0.36 0.00 0.00 54.97 55.28 1loo s GLU 402 Cb -0.21 -3.34 -0.03 0.00 0.26 0.00 0.00 34.13 30.82 1loo s GLU 402 CO 0.22 -0.15 0.33 0.71 -0.54 0.00 0.00 175.26 175.83 1loo s TYR 403 N 1.53 3.14 -0.23 5.30 2.02 -1.26 -0.13 117.35 127.72 1loo s TYR 403 Ca 0.06 -0.16 -0.01 0.00 -0.37 0.00 0.00 57.07 56.58 1loo s TYR 403 Cb -0.15 -1.69 0.07 0.00 -0.40 0.00 0.00 41.96 39.79 1loo s TYR 403 CO 0.04 0.29 0.02 -2.00 -1.57 0.00 0.00 175.55 172.33 1loo s GLU 404 N -4.00 0.96 -0.05 -0.62 2.56 -0.65 -4.86 118.70 112.05 1loo s GLU 404 Ca 0.38 -0.73 -0.28 0.00 0.00 0.00 0.00 54.97 54.34 1loo s GLU 404 Cb -0.08 -2.25 -0.03 0.00 2.00 0.00 0.00 34.13 33.78 1loo s GLU 404 CO 0.28 -0.69 0.93 0.99 -0.56 0.00 0.00 175.26 176.21 1loo s THR 405 N 1.66 4.88 0.07 -1.70 2.01 -1.26 -2.46 115.64 118.84 1loo s THR 405 Ca -0.00 1.93 0.09 0.00 0.31 0.00 0.00 61.69 64.01 1loo s THR 405 Cb -0.18 -4.26 -0.03 0.00 0.01 0.00 0.00 72.50 68.04 1loo s THR 405 CO -0.10 0.12 -0.24 -0.76 -0.69 0.00 0.00 174.62 172.95 1loo s LEU 406 N 1.32 2.36 0.39 4.42 1.43 0.14 -4.95 118.68 123.79 1loo s LEU 406 Ca 0.48 -0.58 -0.25 0.00 -1.03 0.00 0.00 54.13 52.75 1loo s LEU 406 Cb -0.19 -1.35 -0.09 0.00 0.03 0.00 0.00 46.19 44.58 1loo s LEU 406 CO 0.23 0.24 1.10 -2.16 0.23 0.00 0.00 176.35 175.98 1loo s PRO 407 N -1.52 4.14 0.62 1.29 0.04 -1.26 0.61 135.00 138.92 1loo s PRO 407 Ca 0.13 1.65 -0.03 0.00 0.04 0.00 0.00 61.00 62.80 1loo s PRO 407 Cb -0.10 -2.63 0.04 0.00 0.04 0.00 0.00 34.50 31.85 1loo s PRO 407 CO 0.04 -0.19 0.89 0.20 0.04 0.00 0.00 177.00 177.98 1loo s GLY 408 N -1.36 1.73 0.15 0.56 0.00 0.99 -4.70 107.32 104.70 1loo s GLY 408 Ca 0.57 -1.07 0.23 0.00 0.00 0.00 0.00 44.72 44.44 1loo s GLY 408 CO 0.33 -0.74 1.00 -2.67 0.00 0.00 0.00 173.10 171.02 1loo n TRP 409 N -2.62 0.72 -3.99 1.90 2.14 -1.26 -4.84 117.44 109.49 1loo n TRP 409 Ca 0.07 0.21 -0.32 0.00 2.07 0.00 0.00 57.50 59.53 1loo n TRP 409 Cb 0.60 -0.81 -0.01 0.00 -0.81 0.00 0.00 31.31 30.28 1loo n TRP 409 CO 0.00 0.00 0.00 1.63 2.07 0.00 0.00 177.69 181.39 1loo n LYS 410 N -2.47 -1.77 -3.59 -2.67 5.02 -1.18 -4.95 118.16 106.54 1loo n LYS 410 Ca 0.00 0.29 -0.13 0.00 -2.02 0.00 0.00 58.31 56.44 1loo n LYS 410 Cb 0.53 -3.85 -0.05 0.00 -0.02 0.00 0.00 35.03 31.63 1loo n LYS 410 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1loo s ALA 411 N -3.86 -1.24 -0.28 7.82 0.00 -0.75 -4.99 121.76 118.47 1loo s ALA 411 Ca 0.20 0.48 -0.29 0.00 0.00 0.00 0.00 51.96 52.35 1loo s ALA 411 Cb -0.09 0.42 0.01 0.00 0.00 0.00 0.00 23.12 23.46 1loo s ALA 411 CO 0.92 -0.52 1.10 0.34 0.00 0.00 0.00 175.76 177.61 1loo s ASP 412 N -2.08 6.96 0.00 0.00 3.68 -1.26 -4.57 116.67 119.39 1loo s ASP 412 Ca -0.04 1.22 0.17 0.00 2.13 0.00 0.00 52.55 56.03 1loo s ASP 412 Cb -0.00 -2.54 0.07 0.00 -1.45 0.00 0.00 42.92 38.99 1loo s ASP 412 CO -0.03 -0.83 0.98 0.35 0.13 0.00 0.00 175.17 175.77 1loo n THR 413 N 5.70 0.00 -0.01 1.71 -2.24 -1.26 -4.58 114.28 113.60 1loo n THR 413 Ca 0.12 -0.41 0.23 0.00 -2.27 0.00 0.00 64.05 61.72 1loo n THR 413 Cb 0.47 1.29 0.72 0.00 -2.10 0.00 0.00 70.33 70.70 1loo n THR 413 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1loo h THR 414 N 2.70 0.43 0.00 4.28 1.35 -1.91 0.31 112.91 120.08 1loo h THR 414 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1loo h THR 414 Cb 0.66 0.59 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 1loo h THR 414 CO 0.00 0.00 -0.55 0.61 -0.25 0.00 0.00 175.52 175.33 1loo n GLY 415 N -1.58 -1.35 3.71 5.82 0.00 -1.26 -4.82 105.19 105.70 1loo n GLY 415 Ca 0.12 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1loo n GLY 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1loo n ALA 416 N -1.68 1.36 -0.80 4.61 0.00 0.10 -4.91 120.51 119.18 1loo n ALA 416 Ca 0.04 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1loo n ALA 416 Cb 0.39 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.57 1loo n ALA 416 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1loo n ARG 417 N 0.13 0.17 -3.45 0.00 5.12 -1.26 -4.75 116.66 112.62 1loo n ARG 417 Ca 0.06 -0.38 -0.12 0.00 -1.93 0.00 0.00 57.85 55.48 1loo n ARG 417 Cb 0.39 -0.60 -0.02 0.00 -1.16 0.00 0.00 32.46 31.07 1loo n ARG 417 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 1loo s LYS 418 N -0.09 1.25 0.28 5.56 -2.85 -1.26 -4.77 119.74 117.86 1loo s LYS 418 Ca 0.00 -0.46 0.03 0.00 -1.00 0.00 0.00 55.97 54.54 1loo s LYS 418 Cb 0.00 0.57 0.65 0.00 -2.06 0.00 0.00 37.83 36.99 1loo s LYS 418 CO 0.00 -0.53 1.76 2.35 0.10 0.00 0.00 175.35 179.02 1loo h TRP 419 N 2.09 0.87 0.00 1.78 2.91 -1.96 -0.62 115.95 121.01 1loo h TRP 419 Ca -0.34 0.04 -0.01 0.00 1.13 0.00 0.00 58.89 59.71 1loo h TRP 419 Cb 1.30 -0.24 -0.00 0.00 -0.51 0.00 0.00 29.16 29.70 1loo h TRP 419 CO 0.25 0.16 -0.04 0.93 -1.03 0.00 0.00 178.44 178.71 1loo h GLU 420 N 0.64 0.00 0.00 2.65 3.07 -2.01 -2.59 114.58 116.34 1loo h GLU 420 Ca 0.53 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 59.20 1loo h GLU 420 Cb 0.83 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.72 1loo h GLU 420 CO -0.40 0.04 -0.85 -0.44 -1.40 0.00 0.00 179.01 175.96 1loo h ASP 421 N 0.00 0.19 -3.92 1.42 3.32 -1.52 -3.45 116.42 112.47 1loo h ASP 421 Ca -0.00 -0.15 -0.53 0.00 0.02 0.00 0.00 57.03 56.37 1loo h ASP 421 Cb 0.28 -0.06 0.08 0.00 0.22 0.00 0.00 39.33 39.85 1loo h ASP 421 CO 0.01 0.95 0.65 -0.76 -1.72 0.00 0.00 179.24 178.37 1loo s LEU 422 N -7.38 4.32 0.64 1.55 1.43 -0.98 -4.93 118.68 113.33 1loo s LEU 422 Ca -0.02 2.75 -0.14 0.00 -1.03 0.00 0.00 54.13 55.69 1loo s LEU 422 Cb 0.10 -3.75 -0.01 0.00 0.03 0.00 0.00 46.19 42.56 1loo s LEU 422 CO 0.82 -0.73 1.06 -2.16 0.23 0.00 0.00 176.35 175.57 1loo s PRO 423 N -2.03 3.09 0.29 1.29 0.04 -1.26 -4.78 135.00 131.64 1loo s PRO 423 Ca 0.53 1.14 0.04 0.00 0.04 0.00 0.00 61.00 62.75 1loo s PRO 423 Cb -0.40 -2.00 0.76 0.00 0.04 0.00 0.00 34.50 32.89 1loo s PRO 423 CO 0.53 -0.99 1.67 -1.00 0.04 0.00 0.00 177.00 177.25 1loo h PRO 424 N -0.06 0.28 0.00 0.56 0.13 -1.97 0.12 132.00 131.06 1loo h PRO 424 Ca -0.46 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.61 1loo h PRO 424 Cb 1.22 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1loo h PRO 424 CO 0.57 0.19 -0.24 1.96 -0.23 0.00 0.00 178.00 180.24 1loo h GLN 425 N 0.29 0.00 0.16 0.86 7.50 -1.90 -1.97 115.11 120.04 1loo h GLN 425 Ca 0.57 0.00 -0.29 0.00 0.50 0.00 0.00 58.65 59.43 1loo h GLN 425 Cb 1.16 0.00 0.02 0.00 0.05 0.00 0.00 27.48 28.70 1loo h GLN 425 CO -0.60 0.24 -1.29 0.00 -1.50 0.00 0.00 178.83 175.68 1loo h ALA 426 N 1.76 0.02 -0.64 3.87 0.00 -1.37 -2.03 119.26 120.88 1loo h ALA 426 Ca -0.00 -0.85 -0.07 0.00 0.00 0.00 0.00 54.91 53.99 1loo h ALA 426 Cb 0.84 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1loo h ALA 426 CO 0.03 0.83 0.11 1.96 0.00 0.00 0.00 179.25 182.18 1loo h GLN 427 N 0.14 1.03 -0.40 0.00 4.20 -1.09 -2.15 115.11 116.84 1loo h GLN 427 Ca -0.18 -0.26 -0.08 0.00 0.06 0.00 0.00 58.65 58.20 1loo h GLN 427 Cb 1.99 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 29.62 1loo h GLN 427 CO 0.23 0.94 -0.07 0.77 -0.67 0.00 0.00 178.83 180.03 1loo h SER 428 N 0.97 0.65 -0.72 1.46 0.02 -1.34 -1.06 113.55 113.54 1loo h SER 428 Ca 0.20 -0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 1loo h SER 428 Cb 0.41 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 1loo h SER 428 CO 0.01 0.77 0.35 0.22 -1.14 0.00 0.00 176.83 177.03 1loo h TYR 429 N 0.62 1.04 -0.11 3.45 3.20 -0.77 0.14 116.97 124.53 1loo h TYR 429 Ca 0.12 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 1loo h TYR 429 Cb 0.49 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.44 1loo h TYR 429 CO 0.02 0.77 0.03 0.28 -1.64 0.00 0.00 178.16 177.62 1loo h VAL 430 N 1.01 1.19 -0.89 1.81 2.07 -0.97 -2.63 116.25 117.83 1loo h VAL 430 Ca 0.25 -0.58 0.02 0.00 0.82 0.00 0.00 66.70 67.21 1loo h VAL 430 Cb 0.12 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.21 1loo h VAL 430 CO -0.03 0.17 0.59 0.03 0.02 0.00 0.00 177.57 178.34 1loo h ARG 431 N -0.02 1.13 -0.85 1.57 3.08 -0.87 -1.45 114.38 116.97 1loo h ARG 431 Ca 0.03 -0.07 0.07 0.00 0.07 0.00 0.00 59.98 60.09 1loo h ARG 431 Cb 0.24 -0.25 -0.06 0.00 0.08 0.00 0.00 29.97 29.97 1loo h ARG 431 CO -0.00 0.75 0.51 0.35 -1.07 0.00 0.00 179.97 180.51 1loo h PHE 432 N 1.16 0.94 -0.06 3.04 3.57 -0.47 0.16 116.94 125.29 1loo h PHE 432 Ca 0.34 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.86 1loo h PHE 432 Cb -0.06 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.38 1loo h PHE 432 CO -0.00 0.45 -0.01 0.28 -2.23 0.00 0.00 178.31 176.80 1loo h VAL 433 N 0.91 1.29 0.32 1.41 2.07 -0.95 -2.52 116.25 118.78 1loo h VAL 433 Ca 0.38 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.99 1loo h VAL 433 Cb 0.23 1.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 1loo h VAL 433 CO -0.20 0.25 -0.33 -0.33 0.02 0.00 0.00 177.57 176.99 1loo h GLU 434 N -0.22 -0.65 -0.19 1.57 5.08 -0.78 -2.12 114.58 117.26 1loo h GLU 434 Ca 0.02 0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 1loo h GLU 434 Cb 0.40 0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.75 1loo h GLU 434 CO 0.01 -0.44 -0.13 -0.91 -1.00 0.00 0.00 179.01 176.54 1loo h ASN 435 N -0.68 -0.42 0.94 1.42 2.35 -0.74 0.62 115.58 119.07 1loo h ASN 435 Ca -0.02 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1loo h ASN 435 Cb 0.62 0.22 0.00 0.00 0.05 0.00 0.00 38.32 39.21 1loo h ASN 435 CO -0.06 -0.17 0.00 1.41 -1.65 0.00 0.00 177.43 176.96 1loo n HIS 436 N -5.29 0.66 -0.01 1.19 8.25 -0.95 -2.91 115.22 116.16 1loo n HIS 436 Ca -0.02 0.23 0.07 0.00 -0.26 0.00 0.00 57.72 57.75 1loo n HIS 436 Cb 0.20 -0.87 -0.14 0.00 1.12 0.00 0.00 29.99 30.31 1loo n HIS 436 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1loo n MET 437 N -2.07 0.59 -1.18 -0.41 2.81 -0.80 -4.90 117.12 111.15 1loo n MET 437 Ca 0.04 -0.15 -0.06 0.00 -1.81 0.00 0.00 57.70 55.72 1loo n MET 437 Cb 0.29 -1.42 -0.03 0.00 -0.71 0.00 0.00 33.22 31.36 1loo n MET 437 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1loo n GLY 438 N 1.55 0.86 2.94 3.03 0.00 0.21 -4.98 105.19 108.79 1loo n GLY 438 Ca -0.05 -0.62 -0.25 0.00 0.00 0.00 0.00 46.02 45.09 1loo n GLY 438 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1loo s VAL 439 N -2.19 0.98 0.55 1.61 1.01 -1.06 -5.03 120.40 116.27 1loo s VAL 439 Ca 0.00 -0.32 -0.21 0.00 0.00 0.00 0.00 61.98 61.45 1loo s VAL 439 Cb 0.00 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.36 1loo s VAL 439 CO 0.00 0.34 1.34 0.00 0.00 0.00 0.00 175.10 176.78 1loo s ALA 440 N 1.28 2.79 -0.25 5.51 0.00 -1.26 -4.32 121.76 125.51 1loo s ALA 440 Ca -0.03 1.30 -0.15 0.00 0.00 0.00 0.00 51.96 53.07 1loo s ALA 440 Cb -0.14 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 1loo s ALA 440 CO -0.03 -1.35 0.39 0.08 0.00 0.00 0.00 175.76 174.85 1loo s VAL 441 N -1.33 5.17 -0.13 0.00 1.01 -1.26 -0.23 120.40 123.64 1loo s VAL 441 Ca 0.72 0.62 0.17 0.00 0.00 0.00 0.00 61.98 63.49 1loo s VAL 441 Cb -0.39 -3.71 -0.24 0.00 0.00 0.00 0.00 36.38 32.04 1loo s VAL 441 CO 0.46 0.18 0.38 1.17 0.00 0.00 0.00 175.10 177.29 1loo n LYS 442 N 5.11 0.66 -4.24 2.72 4.81 0.51 -4.59 118.16 123.14 1loo n LYS 442 Ca -0.08 0.09 -0.17 0.00 -0.87 0.00 0.00 58.31 57.28 1loo n LYS 442 Cb 0.51 -1.64 -0.13 0.00 0.02 0.00 0.00 35.03 33.78 1loo n LYS 442 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 1loo s TRP 443 N -2.68 0.81 -0.16 5.64 0.51 -1.02 -0.46 118.94 121.58 1loo s TRP 443 Ca -0.07 -0.28 0.00 0.00 -2.12 0.00 0.00 56.10 53.63 1loo s TRP 443 Cb 0.08 -0.50 0.03 0.00 -0.81 0.00 0.00 33.47 32.27 1loo s TRP 443 CO 0.83 -0.02 -0.10 0.08 -0.51 0.00 0.00 176.95 177.24 1loo s VAL 444 N -0.66 1.38 -0.20 4.03 1.01 0.11 -1.18 120.40 124.90 1loo s VAL 444 Ca -0.01 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.10 1loo s VAL 444 Cb -0.06 -1.42 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 1loo s VAL 444 CO 0.00 0.28 0.56 -0.83 0.00 0.00 0.00 175.10 175.11 1loo s GLY 445 N 1.54 2.08 -0.18 4.51 0.00 0.14 -0.29 107.32 115.12 1loo s GLY 445 Ca 0.02 -0.35 0.14 0.00 0.00 0.00 0.00 44.72 44.54 1loo s GLY 445 CO -0.09 1.15 1.19 3.33 0.00 0.00 0.00 173.10 178.68 1loo n VAL 446 N 4.56 2.03 0.00 1.40 0.24 0.45 -1.90 118.33 125.12 1loo n VAL 446 Ca -0.04 -2.82 0.00 0.00 -2.04 0.00 0.00 64.34 59.44 1loo n VAL 446 Cb 0.50 -0.21 0.00 0.00 -1.47 0.00 0.00 33.84 32.67 1loo n VAL 446 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1loo n GLY 447 N -1.19 -0.76 0.13 7.63 0.00 -1.21 -4.13 105.19 105.67 1loo n GLY 447 Ca 0.17 -1.20 -0.22 0.00 0.00 0.00 0.00 46.02 44.77 1loo n GLY 447 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1loo h LYS 448 N 0.00 0.43 -7.01 1.61 1.57 -1.98 -3.45 116.57 107.74 1loo h LYS 448 Ca 0.00 -0.72 -0.55 0.00 -1.87 0.00 0.00 60.65 57.51 1loo h LYS 448 Cb 0.00 0.26 0.14 0.00 0.08 0.00 0.00 32.23 32.71 1loo h LYS 448 CO 0.00 1.34 0.61 -1.13 -0.57 0.00 0.00 179.45 179.70 1loo n SER 449 N -3.93 2.80 0.32 0.86 3.41 -1.26 -4.86 113.62 110.96 1loo n SER 449 Ca -0.15 1.01 0.19 0.00 -0.26 0.00 0.00 58.87 59.67 1loo n SER 449 Cb 0.96 -1.58 1.07 0.00 -0.26 0.00 0.00 64.21 64.40 1loo n SER 449 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 1loo h ARG 450 N 1.65 0.00 0.00 4.33 0.11 -1.98 0.85 114.38 119.34 1loo h ARG 450 Ca -0.51 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.49 1loo h ARG 450 Cb 1.30 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.36 1loo h ARG 450 CO 0.58 0.00 -0.41 0.93 0.10 0.00 0.00 179.97 181.17 1loo h GLU 451 N 0.00 0.00 -2.06 0.08 3.07 -1.96 -3.27 114.58 110.44 1loo h GLU 451 Ca 0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.82 1loo h GLU 451 Cb 0.05 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.95 1loo h GLU 451 CO -0.00 0.41 -0.06 0.43 -1.40 0.00 0.00 179.01 178.39 1loo n SER 452 N -3.65 4.20 -3.97 1.42 7.64 0.29 -4.73 113.62 114.83 1loo n SER 452 Ca -0.01 -2.16 -0.22 0.00 1.01 0.00 0.00 58.87 57.49 1loo n SER 452 Cb 0.51 -0.96 -0.16 0.00 -1.01 0.00 0.00 64.21 62.59 1loo n SER 452 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1loo s MET 453 N 0.70 1.26 -0.18 1.43 0.00 -1.24 -0.41 119.30 120.86 1loo s MET 453 Ca 0.15 -0.28 -0.04 0.00 0.00 0.00 0.00 55.69 55.51 1loo s MET 453 Cb 0.07 -1.11 -0.03 0.00 0.00 0.00 0.00 34.83 33.76 1loo s MET 453 CO 0.00 0.00 -0.02 0.42 0.00 0.00 0.00 175.02 175.42 1loo s ILE 454 N 0.67 3.92 -0.29 10.11 1.01 0.60 -4.92 121.20 132.30 1loo s ILE 454 Ca -0.12 -0.34 -0.11 0.00 0.00 0.00 0.00 60.65 60.08 1loo s ILE 454 Cb -0.14 -2.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.54 1loo s ILE 454 CO 0.02 0.46 0.20 -1.58 0.00 0.00 0.00 174.94 174.05 1loo s GLN 455 N 0.65 3.86 0.22 2.79 0.74 -1.26 0.04 119.66 126.71 1loo s GLN 455 Ca -0.01 -0.38 0.25 0.00 0.05 0.00 0.00 55.36 55.26 1loo s GLN 455 Cb -0.14 -3.69 0.52 0.00 1.10 0.00 0.00 33.01 30.80 1loo s GLN 455 CO 0.02 -0.23 1.55 -0.07 -0.55 0.00 0.00 175.29 176.01 1loo h LEU 456 N 8.40 0.00 0.00 3.68 3.38 -1.02 -3.46 115.31 126.29 1loo h LEU 456 Ca -0.34 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1loo h LEU 456 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1loo h LEU 456 CO 0.57 0.03 0.00 2.22 0.09 0.00 0.00 178.44 181.35