#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mne h PRO 3 N 0.00 0.00 -0.28 1.20 0.11 -2.02 0.66 132.00 131.66 1mne h PRO 3 Ca 0.00 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.99 1mne h PRO 3 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1mne h PRO 3 CO 0.00 0.00 -0.32 0.82 -0.21 0.00 0.00 178.00 178.29 1mne h ILE 4 N 0.00 1.28 -0.01 4.15 5.03 -2.00 -3.24 117.51 122.71 1mne h ILE 4 Ca 0.00 -1.44 0.00 0.00 -0.12 0.00 0.00 64.86 63.31 1mne h ILE 4 Cb 0.14 1.41 0.00 0.00 -3.03 0.00 0.00 36.82 35.35 1mne h ILE 4 CO -0.00 0.46 -0.15 1.41 -0.68 0.00 0.00 178.15 179.19 1mne n HIS 5 N -4.07 0.00 -2.80 1.37 8.25 0.34 -4.83 115.22 113.48 1mne n HIS 5 Ca -0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 1mne n HIS 5 Cb 0.47 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.54 1mne n HIS 5 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1mne s ASP 6 N -1.53 6.32 0.00 0.41 2.15 0.20 -4.91 116.67 119.31 1mne s ASP 6 Ca 0.15 -1.22 0.00 0.00 0.43 0.00 0.00 52.55 51.91 1mne s ASP 6 Cb 0.12 -2.45 0.00 0.00 -0.30 0.00 0.00 42.92 40.29 1mne s ASP 6 CO 0.28 -1.41 0.17 0.54 -0.17 0.00 0.00 175.17 174.58 1mne n ARG 7 N 7.79 0.19 0.00 4.34 1.74 -1.26 -1.51 116.66 127.96 1mne n ARG 7 Ca 0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 1mne n ARG 7 Cb 0.47 -1.01 0.00 0.00 -1.02 0.00 0.00 32.46 30.90 1mne n ARG 7 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1mne n THR 8 N -0.36 0.00 -2.50 0.55 -2.24 -1.26 -4.84 114.28 103.62 1mne n THR 8 Ca 0.00 -0.46 -0.33 0.00 -2.27 0.00 0.00 64.05 60.99 1mne n THR 8 Cb 0.01 1.06 -0.03 0.00 -2.10 0.00 0.00 70.33 69.26 1mne n THR 8 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1mne s SER 9 N -0.25 6.42 0.62 3.42 1.04 -0.57 -4.84 113.70 119.54 1mne s SER 9 Ca 0.00 1.81 0.28 0.00 0.48 0.00 0.00 55.95 58.53 1mne s SER 9 Cb 0.00 -2.54 1.51 0.00 0.10 0.00 0.00 66.02 65.08 1mne s SER 9 CO 0.00 -0.73 1.89 0.44 0.98 0.00 0.00 173.24 175.82 1mne h ASP 10 N 1.37 0.00 -0.10 7.02 5.19 -1.93 0.58 116.42 128.54 1mne h ASP 10 Ca -0.49 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 55.88 1mne h ASP 10 Cb 1.21 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.72 1mne h ASP 10 CO 0.59 0.00 -0.09 0.22 -3.12 0.00 0.00 179.24 176.84 1mne h TYR 11 N 0.00 0.29 -0.66 4.55 5.03 -1.91 -1.27 116.97 123.01 1mne h TYR 11 Ca 0.12 -0.08 -0.08 0.00 2.58 0.00 0.00 58.73 61.26 1mne h TYR 11 Cb 0.97 -0.06 -0.03 0.00 1.55 0.00 0.00 36.73 39.17 1mne h TYR 11 CO 0.00 0.65 0.08 0.45 -1.32 0.00 0.00 178.16 178.03 1mne h HIS 12 N -0.16 1.19 -0.13 -3.82 3.86 -0.52 -2.55 115.15 113.02 1mne h HIS 12 Ca 0.02 -0.17 0.01 0.00 -1.16 0.00 0.00 60.37 59.07 1mne h HIS 12 Cb 0.60 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 28.73 1mne h HIS 12 CO 0.08 1.00 0.04 -0.22 0.86 0.00 0.00 177.93 179.69 1mne h LYS 13 N 1.03 0.09 -0.01 2.45 3.64 0.11 -3.12 116.57 120.76 1mne h LYS 13 Ca 0.20 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1mne h LYS 13 Cb 0.47 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1mne h LYS 13 CO 0.02 0.06 -0.59 0.66 -2.27 0.00 0.00 179.45 177.33 1mne n TYR 14 N -5.07 0.00 0.00 1.91 4.01 -0.50 -4.58 117.16 112.94 1mne n TYR 14 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 1mne n TYR 14 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 1mne n TYR 14 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1mne n LEU 15 N -0.61 0.00 -4.33 7.72 4.77 -0.96 -4.76 117.00 118.83 1mne n LEU 15 Ca 0.06 -0.32 -0.25 0.00 -0.03 0.00 0.00 56.01 55.48 1mne n LEU 15 Cb 0.36 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.33 1mne n LEU 15 CO 0.30 0.00 -0.52 -0.54 -1.33 0.00 0.00 177.39 175.29 1mne s LYS 16 N -0.82 1.25 -0.38 3.23 1.02 -1.18 -4.79 119.74 118.08 1mne s LYS 16 Ca 0.00 -1.28 -0.26 0.00 0.02 0.00 0.00 55.97 54.45 1mne s LYS 16 Cb 0.00 -1.52 0.02 0.00 -0.52 0.00 0.00 37.83 35.80 1mne s LYS 16 CO 0.00 0.35 0.95 0.08 -0.92 0.00 0.00 175.35 175.80 1mne s VAL 17 N -1.36 4.55 0.04 3.17 1.01 -1.26 -4.80 120.40 121.75 1mne s VAL 17 Ca 0.11 1.20 -0.36 0.00 0.00 0.00 0.00 61.98 62.93 1mne s VAL 17 Cb -0.09 -4.36 -0.15 0.00 0.00 0.00 0.00 36.38 31.78 1mne s VAL 17 CO 0.06 -0.58 1.54 1.17 0.00 0.00 0.00 175.10 177.30 1mne n LYS 18 N 6.86 1.62 -3.55 2.72 4.81 -1.26 -4.98 118.16 124.37 1mne n LYS 18 Ca 0.08 0.59 -0.37 0.00 -0.87 0.00 0.00 58.31 57.73 1mne n LYS 18 Cb 0.48 -2.30 -0.06 0.00 0.02 0.00 0.00 35.03 33.16 1mne n LYS 18 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1mne s GLN 19 N 1.50 3.95 0.00 1.64 -0.21 -1.26 -5.12 119.66 120.17 1mne s GLN 19 Ca 0.85 0.26 0.00 0.00 0.02 0.00 0.00 55.36 56.49 1mne s GLN 19 Cb -0.84 -3.28 0.00 0.00 1.00 0.00 0.00 33.01 29.89 1mne s GLN 19 CO 0.47 0.56 0.00 0.41 -2.12 0.00 0.00 175.29 174.61 1mne n GLY 20 N 2.32 -0.14 0.12 3.09 0.00 -1.26 -5.00 105.19 104.32 1mne n GLY 20 Ca -0.14 -1.80 0.12 0.00 0.00 0.00 0.00 46.02 44.20 1mne n GLY 20 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1mne h ASP 21 N 0.00 0.00 -4.36 1.61 5.19 -2.06 -3.46 116.42 113.34 1mne h ASP 21 Ca 0.00 -0.07 -0.44 0.00 -0.62 0.00 0.00 57.03 55.90 1mne h ASP 21 Cb 0.00 0.00 -0.24 0.00 0.18 0.00 0.00 39.33 39.27 1mne h ASP 21 CO 0.00 0.04 -0.79 -0.55 -3.12 0.00 0.00 179.24 174.81 1mne s SER 22 N -4.86 1.71 0.00 6.45 0.15 -1.26 -5.03 113.70 110.86 1mne s SER 22 Ca 0.07 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.21 1mne s SER 22 Cb 0.11 -0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 1mne s SER 22 CO 0.68 0.01 0.78 -0.90 1.20 0.00 0.00 173.24 175.01 1mne n ASP 23 N 1.72 1.52 -4.71 5.45 5.75 -1.26 -5.06 116.55 119.96 1mne n ASP 23 Ca -0.19 -1.59 -0.42 0.00 -0.01 0.00 0.00 54.79 52.58 1mne n ASP 23 Cb 0.54 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.60 1mne n ASP 23 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1mne s LEU 24 N -0.59 4.38 0.37 -2.12 1.02 -1.26 -4.90 118.68 115.58 1mne s LEU 24 Ca 0.00 2.77 0.17 0.00 0.02 0.00 0.00 54.13 57.08 1mne s LEU 24 Cb 0.00 -3.58 1.09 0.00 0.02 0.00 0.00 46.19 43.71 1mne s LEU 24 CO 0.00 -0.97 1.71 0.15 0.02 0.00 0.00 176.35 177.26 1mne h PHE 25 N 7.68 0.81 -0.75 0.29 3.57 -1.97 -2.23 116.94 124.34 1mne h PHE 25 Ca -0.44 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.18 1mne h PHE 25 Cb 1.21 -0.23 -0.07 0.00 2.79 0.00 0.00 35.95 39.65 1mne h PHE 25 CO 0.72 -0.04 0.41 1.57 -2.23 0.00 0.00 178.31 178.73 1mne h LYS 26 N 0.38 0.68 -0.81 1.11 2.10 -1.99 -2.94 116.57 115.11 1mne h LYS 26 Ca 0.68 -0.04 0.14 0.00 -2.00 0.00 0.00 60.65 59.43 1mne h LYS 26 Cb 1.63 -0.15 -0.14 0.00 -0.90 0.00 0.00 32.23 32.67 1mne h LYS 26 CO -0.45 0.45 -0.28 1.28 -2.00 0.00 0.00 179.45 178.45 1mne n LEU 27 N -4.80 -0.44 -0.02 7.07 4.32 -0.84 0.17 117.00 122.46 1mne n LEU 27 Ca 0.12 1.40 0.05 0.00 -0.02 0.00 0.00 56.01 57.55 1mne n LEU 27 Cb 0.26 -0.36 0.29 0.00 -1.62 0.00 0.00 43.42 41.99 1mne n LEU 27 CO 0.26 -1.28 0.69 0.35 -1.22 0.00 0.00 177.39 176.19 1mne n THR 28 N -5.23 0.01 -2.46 -5.08 -2.24 -1.11 -4.90 114.28 93.28 1mne n THR 28 Ca 0.10 -0.02 -0.41 0.00 -2.27 0.00 0.00 64.05 61.46 1mne n THR 28 Cb 0.35 -0.14 -0.04 0.00 -2.10 0.00 0.00 70.33 68.41 1mne n THR 28 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1mne s VAL 29 N -1.99 3.64 0.09 2.28 1.01 0.45 -4.90 120.40 120.98 1mne s VAL 29 Ca 0.15 1.48 0.00 0.00 0.00 0.00 0.00 61.98 63.62 1mne s VAL 29 Cb 0.07 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1mne s VAL 29 CO 0.12 0.29 -0.03 -0.55 0.00 0.00 0.00 175.10 174.92 1mne s SER 30 N -0.31 0.82 -0.17 3.32 0.15 -1.26 -5.07 113.70 111.18 1mne s SER 30 Ca 0.49 -1.04 0.01 0.00 0.70 0.00 0.00 55.95 56.11 1mne s SER 30 Cb -0.31 0.16 -0.22 0.00 -1.71 0.00 0.00 66.02 63.93 1mne s SER 30 CO 0.38 -0.55 0.15 0.47 1.20 0.00 0.00 173.24 174.89 1mne n ASP 31 N -0.01 1.69 -4.71 5.45 8.00 -1.26 -5.00 116.55 120.72 1mne n ASP 31 Ca -0.12 0.09 -0.39 0.00 0.71 0.00 0.00 54.79 55.08 1mne n ASP 31 Cb 0.61 -0.40 0.04 0.00 -0.02 0.00 0.00 41.12 41.35 1mne n ASP 31 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1mne n LYS 32 N -3.27 1.60 -4.38 -1.24 4.01 -1.26 -5.08 118.16 108.54 1mne n LYS 32 Ca -0.35 0.59 -0.19 0.00 -0.51 0.00 0.00 58.31 57.84 1mne n LYS 32 Cb 1.04 -2.45 -0.15 0.00 -0.51 0.00 0.00 35.03 32.96 1mne n LYS 32 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 1mne s ARG 33 N -2.70 0.79 0.30 1.97 0.52 -1.26 -5.09 118.95 113.47 1mne s ARG 33 Ca 0.70 -0.33 0.05 0.00 -0.52 0.00 0.00 55.73 55.64 1mne s ARG 33 Cb -0.44 -0.76 -0.06 0.00 0.52 0.00 0.00 34.95 34.21 1mne s ARG 33 CO 0.51 0.18 -0.01 0.71 0.02 0.00 0.00 175.30 176.72 1mne s TYR 34 N -0.15 1.97 0.02 -0.53 2.02 -1.26 -1.10 117.35 118.32 1mne s TYR 34 Ca 0.02 -0.81 0.03 0.00 -0.37 0.00 0.00 57.07 55.95 1mne s TYR 34 Cb -0.04 -1.21 -0.02 0.00 -0.40 0.00 0.00 41.96 40.29 1mne s TYR 34 CO -0.00 0.17 -0.10 -1.50 -1.57 0.00 0.00 175.55 172.55 1mne s ILE 35 N -3.12 0.76 -0.14 2.71 -1.16 0.71 -2.29 121.20 118.67 1mne s ILE 35 Ca 0.32 -0.73 -0.22 0.00 -0.51 0.00 0.00 60.65 59.52 1mne s ILE 35 Cb 0.06 -0.70 -0.03 0.00 0.61 0.00 0.00 42.46 42.40 1mne s ILE 35 CO 0.13 -0.01 0.65 0.26 -2.81 0.00 0.00 174.94 173.16 1mne s TRP 36 N -0.68 3.46 0.20 3.50 0.52 0.50 0.20 118.94 126.64 1mne s TRP 36 Ca -0.00 1.06 0.03 0.00 0.02 0.00 0.00 56.10 57.20 1mne s TRP 36 Cb -0.06 -2.79 -0.05 0.00 -1.15 0.00 0.00 33.47 29.42 1mne s TRP 36 CO 0.00 -0.05 -0.00 1.52 0.02 0.00 0.00 176.95 178.44 1mne s TYR 37 N 1.41 1.39 -0.60 -1.98 -0.85 0.40 -4.23 117.35 112.89 1mne s TYR 37 Ca 0.32 -0.97 -0.18 0.00 -0.52 0.00 0.00 57.07 55.72 1mne s TYR 37 Cb -0.16 -0.79 0.12 0.00 0.38 0.00 0.00 41.96 41.50 1mne s TYR 37 CO 0.13 -0.12 0.67 -0.80 -1.52 0.00 0.00 175.55 173.91 1mne s ASN 38 N -3.24 6.22 0.54 -0.18 0.02 -1.26 0.22 114.94 117.26 1mne s ASN 38 Ca 0.26 -1.58 0.27 0.00 -1.02 0.00 0.00 52.86 50.79 1mne s ASN 38 Cb 0.06 -2.28 1.44 0.00 0.02 0.00 0.00 41.25 40.48 1mne s ASN 38 CO 0.06 -1.04 1.97 1.55 0.02 0.00 0.00 177.10 179.66 1mne h PRO 39 N 9.06 0.00 -2.67 -0.60 0.13 -1.89 -3.35 132.00 132.67 1mne h PRO 39 Ca -0.27 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.57 1mne h PRO 39 Cb 1.09 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.87 1mne h PRO 39 CO 1.07 0.00 -0.61 0.34 -0.23 0.00 0.00 178.00 178.58 1mne s ASP 40 N -5.96 1.06 0.59 1.44 3.68 -1.26 -5.03 116.67 111.18 1mne s ASP 40 Ca -0.05 0.03 0.34 0.00 2.13 0.00 0.00 52.55 55.00 1mne s ASP 40 Cb 0.19 0.44 1.85 0.00 -1.45 0.00 0.00 42.92 43.95 1mne s ASP 40 CO 0.71 -0.30 2.21 -0.65 0.13 0.00 0.00 175.17 177.28 1mne h PRO 41 N 8.31 0.00 0.33 4.34 0.11 -1.94 -2.06 132.00 141.09 1mne h PRO 41 Ca -0.16 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.94 1mne h PRO 41 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1mne h PRO 41 CO 0.23 0.04 -0.16 -0.44 -0.21 0.00 0.00 178.00 177.46 1mne h ASP 42 N 0.00 -0.37 -2.06 -2.05 5.19 -1.95 -3.37 116.42 111.80 1mne h ASP 42 Ca -0.00 -0.15 -0.51 0.00 -0.62 0.00 0.00 57.03 55.75 1mne h ASP 42 Cb 0.15 0.10 -0.05 0.00 0.18 0.00 0.00 39.33 39.70 1mne h ASP 42 CO 0.00 0.08 1.24 -1.61 -3.12 0.00 0.00 179.24 175.84 1mne s GLU 43 N -3.79 2.82 0.28 3.56 2.02 -0.77 -4.81 118.70 118.01 1mne s GLU 43 Ca -0.12 0.28 0.24 0.00 0.02 0.00 0.00 54.97 55.39 1mne s GLU 43 Cb 0.01 -4.35 0.41 0.00 0.10 0.00 0.00 34.13 30.29 1mne s GLU 43 CO 0.41 -2.55 1.50 -0.09 0.02 0.00 0.00 175.26 174.55 1mne h ARG 44 N 13.16 0.00 0.00 1.61 2.43 -1.74 -3.28 114.38 126.55 1mne h ARG 44 Ca -0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1mne h ARG 44 Cb 1.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1mne h ARG 44 CO 1.24 0.00 -0.69 -0.25 -1.51 0.00 0.00 179.97 178.77 1mne n ASP 45 N -2.62 0.63 -4.68 -3.80 10.43 -1.26 -4.81 116.55 110.44 1mne n ASP 45 Ca 0.04 -0.03 -0.38 0.00 2.57 0.00 0.00 54.79 56.98 1mne n ASP 45 Cb 0.49 0.32 -0.07 0.00 1.84 0.00 0.00 41.12 43.70 1mne n ASP 45 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 1mne s SER 46 N -3.90 6.53 0.07 -2.24 0.01 -1.24 -4.67 113.70 108.27 1mne s SER 46 Ca 0.07 0.63 0.04 0.00 1.31 0.00 0.00 55.95 58.00 1mne s SER 46 Cb 0.14 -2.26 -0.03 0.00 0.21 0.00 0.00 66.02 64.09 1mne s SER 46 CO 0.73 -0.08 -0.12 -0.31 0.41 0.00 0.00 173.24 173.87 1mne s TYR 47 N 1.22 1.05 0.21 2.43 2.02 -1.26 -4.24 117.35 118.78 1mne s TYR 47 Ca 0.22 -0.50 0.11 0.00 -0.37 0.00 0.00 57.07 56.53 1mne s TYR 47 Cb -0.15 -0.59 -0.05 0.00 -0.40 0.00 0.00 41.96 40.77 1mne s TYR 47 CO 0.09 0.01 -0.21 -1.21 -1.57 0.00 0.00 175.55 172.66 1mne s GLU 48 N -1.85 1.50 0.18 -0.62 0.41 0.59 -4.89 118.70 114.03 1mne s GLU 48 Ca -0.03 -1.57 -0.25 0.00 -0.41 0.00 0.00 54.97 52.71 1mne s GLU 48 Cb -0.09 -1.69 -0.08 0.00 -1.78 0.00 0.00 34.13 30.49 1mne s GLU 48 CO 0.01 0.35 0.79 0.00 -0.49 0.00 0.00 175.26 175.92 1mne s GLY 50 N -1.23 0.36 -0.41 0.00 0.00 0.55 -4.51 107.32 102.08 1mne s GLY 50 Ca 0.37 -0.08 -0.24 0.00 0.00 0.00 0.00 44.72 44.78 1mne s GLY 50 CO 0.26 0.25 0.82 1.85 0.00 0.00 0.00 173.10 176.27 1mne s GLU 51 N 0.58 3.61 0.31 2.90 2.12 -1.20 0.25 118.70 127.27 1mne s GLU 51 Ca -0.07 0.16 -0.29 0.00 0.36 0.00 0.00 54.97 55.14 1mne s GLU 51 Cb -0.10 -3.87 -0.13 0.00 0.26 0.00 0.00 34.13 30.29 1mne s GLU 51 CO -0.00 -1.01 1.30 -0.89 -0.54 0.00 0.00 175.26 174.12 1mne n ILE 52 N 6.02 1.73 -0.01 -3.70 5.41 -0.26 -0.86 119.36 127.69 1mne n ILE 52 Ca 0.04 -0.43 -0.01 0.00 1.00 0.00 0.00 62.75 63.34 1mne n ILE 52 Cb 0.48 -1.50 -0.02 0.00 -0.71 0.00 0.00 39.64 37.89 1mne n ILE 52 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1mne n VAL 53 N 0.74 0.15 -3.61 1.39 0.31 0.38 -4.62 118.33 113.07 1mne n VAL 53 Ca 0.07 -0.08 -0.06 0.00 -0.01 0.00 0.00 64.34 64.26 1mne n VAL 53 Cb 0.35 -0.86 -0.02 0.00 -0.91 0.00 0.00 33.84 32.40 1mne n VAL 53 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1mne s SER 54 N -3.52 -0.26 0.01 4.52 1.04 -1.18 -5.03 113.70 109.29 1mne s SER 54 Ca -0.02 -0.17 0.01 0.00 0.48 0.00 0.00 55.95 56.25 1mne s SER 54 Cb 0.01 0.40 -0.01 0.00 0.10 0.00 0.00 66.02 66.51 1mne s SER 54 CO 0.08 -0.69 -0.03 -1.83 0.98 0.00 0.00 173.24 171.76 1mne s GLU 55 N -3.10 0.24 0.00 4.02 -1.05 -1.26 0.26 118.70 117.81 1mne s GLU 55 Ca 0.09 -0.33 0.00 0.00 -0.15 0.00 0.00 54.97 54.58 1mne s GLU 55 Cb -0.01 -0.07 0.00 0.00 -0.44 0.00 0.00 34.13 33.61 1mne s GLU 55 CO -0.04 0.01 0.00 0.25 0.95 0.00 0.00 175.26 176.43 1mne n THR 56 N 2.37 0.00 0.23 1.83 -2.24 -1.04 -5.00 114.28 110.43 1mne n THR 56 Ca -0.17 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.69 1mne n THR 56 Cb 0.57 -1.06 0.56 0.00 -2.10 0.00 0.00 70.33 68.30 1mne n THR 56 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1mne h SER 57 N 0.00 0.00 0.00 3.42 0.02 -2.02 -3.35 113.55 111.62 1mne h SER 57 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1mne h SER 57 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1mne h SER 57 CO 0.00 0.21 0.00 -0.90 -1.14 0.00 0.00 176.83 175.00 1mne n ASP 58 N -3.86 0.41 -4.10 3.07 3.85 -1.26 -5.05 116.55 109.62 1mne n ASP 58 Ca -0.02 -1.12 -0.10 0.00 -0.71 0.00 0.00 54.79 52.84 1mne n ASP 58 Cb 0.31 0.00 -0.08 0.00 -1.35 0.00 0.00 41.12 40.00 1mne n ASP 58 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 1mne s SER 59 N -0.12 0.03 0.29 -1.12 1.04 -1.26 -1.68 113.70 110.89 1mne s SER 59 Ca 0.00 -1.15 0.08 0.00 0.48 0.00 0.00 55.95 55.36 1mne s SER 59 Cb 0.00 0.48 -0.06 0.00 0.10 0.00 0.00 66.02 66.54 1mne s SER 59 CO 0.00 -0.98 -0.09 -0.36 0.98 0.00 0.00 173.24 172.78 1mne s PHE 60 N -4.09 2.11 -0.03 5.02 0.40 0.22 -2.51 117.98 119.11 1mne s PHE 60 Ca 0.30 -0.58 0.02 0.00 -0.60 0.00 0.00 56.93 56.07 1mne s PHE 60 Cb 0.03 -1.15 0.01 0.00 0.51 0.00 0.00 43.02 42.42 1mne s PHE 60 CO 0.10 0.43 -0.07 0.99 0.70 0.00 0.00 175.22 177.38 1mne s THR 61 N -2.82 0.63 0.30 0.64 2.01 0.14 0.82 115.64 117.36 1mne s THR 61 Ca 0.30 -0.25 0.04 0.00 0.31 0.00 0.00 61.69 62.09 1mne s THR 61 Cb 0.02 -0.59 -0.02 0.00 0.01 0.00 0.00 72.50 71.93 1mne s THR 61 CO 0.13 0.21 0.15 2.22 -0.69 0.00 0.00 174.62 176.65 1mne n PHE 62 N 3.50 -0.15 -3.97 4.92 1.16 0.01 -0.47 117.46 122.47 1mne n PHE 62 Ca -0.20 -2.14 -0.33 0.00 -1.87 0.00 0.00 57.45 52.91 1mne n PHE 62 Cb 0.54 0.08 -0.14 0.00 -1.61 0.00 0.00 39.48 38.34 1mne n PHE 62 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 1mne s LYS 63 N -3.18 1.91 1.03 3.97 1.02 -0.04 -0.73 119.74 123.71 1mne s LYS 63 Ca 0.22 -1.65 -0.18 0.00 0.02 0.00 0.00 55.97 54.38 1mne s LYS 63 Cb 0.01 -3.20 -0.01 0.00 -0.52 0.00 0.00 37.83 34.11 1mne s LYS 63 CO 0.15 -0.83 -0.26 0.25 -0.92 0.00 0.00 175.35 173.74 1mne n THR 64 N 4.42 0.00 -0.31 2.17 -2.24 -0.78 -3.26 114.28 114.27 1mne n THR 64 Ca -0.04 -0.25 0.03 0.00 -2.27 0.00 0.00 64.05 61.52 1mne n THR 64 Cb 0.42 -0.41 0.17 0.00 -2.10 0.00 0.00 70.33 68.41 1mne n THR 64 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1mne h VAL 65 N -1.56 0.95 0.00 2.28 3.04 -1.88 -2.63 116.25 116.45 1mne h VAL 65 Ca -0.46 -0.31 0.00 0.00 -1.01 0.00 0.00 66.70 64.92 1mne h VAL 65 Cb 1.33 -0.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.59 1mne h VAL 65 CO 0.32 0.16 0.00 0.47 -1.01 0.00 0.00 177.57 177.51 1mne n ASP 66 N -4.68 0.46 0.00 3.17 10.43 -1.26 -4.92 116.55 119.75 1mne n ASP 66 Ca 0.14 0.57 0.00 0.00 2.57 0.00 0.00 54.79 58.07 1mne n ASP 66 Cb 0.26 -0.68 0.00 0.00 1.84 0.00 0.00 41.12 42.54 1mne n ASP 66 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1mne n GLY 67 N 0.88 3.47 3.62 0.44 0.00 -0.99 -5.03 105.19 107.59 1mne n GLY 67 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1mne n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mne n GLN 68 N -1.94 0.05 -4.08 1.61 10.64 -1.26 -4.73 117.38 117.67 1mne n GLN 68 Ca 0.00 0.09 -0.24 0.00 -1.83 0.00 0.00 57.00 55.01 1mne n GLN 68 Cb 0.00 -2.28 -0.05 0.00 -0.86 0.00 0.00 30.24 27.06 1mne n GLN 68 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1mne s ASP 69 N -2.09 5.64 0.22 2.61 -0.00 -1.26 -1.87 116.67 119.92 1mne s ASP 69 Ca 0.69 -0.13 -0.12 0.00 -0.00 0.00 0.00 52.55 53.00 1mne s ASP 69 Cb -0.28 -1.49 -0.00 0.00 -0.00 0.00 0.00 42.92 41.14 1mne s ASP 69 CO 0.55 0.02 0.42 -0.13 -0.00 0.00 0.00 175.17 176.03 1mne s ARG 70 N -3.41 1.43 -0.00 8.23 3.00 0.09 -4.89 118.95 123.40 1mne s ARG 70 Ca 0.32 -1.23 0.05 0.00 0.00 0.00 0.00 55.73 54.87 1mne s ARG 70 Cb -0.09 0.44 -0.01 0.00 0.00 0.00 0.00 34.95 35.29 1mne s ARG 70 CO 0.25 -0.58 -0.15 -0.65 0.00 0.00 0.00 175.30 174.17 1mne s GLN 71 N -4.00 1.14 0.02 3.54 -0.21 -1.26 -0.80 119.66 118.08 1mne s GLN 71 Ca 0.21 -0.58 0.01 0.00 0.02 0.00 0.00 55.36 55.02 1mne s GLN 71 Cb 0.01 -1.12 -0.01 0.00 1.00 0.00 0.00 33.01 32.88 1mne s GLN 71 CO 0.06 0.30 -0.04 0.54 -2.12 0.00 0.00 175.29 174.04 1mne s VAL 72 N -0.45 0.24 0.16 1.09 0.11 0.24 -4.95 120.40 116.84 1mne s VAL 72 Ca 0.05 -0.61 -0.30 0.00 -2.93 0.00 0.00 61.98 58.19 1mne s VAL 72 Cb -0.06 -0.30 -0.07 0.00 -1.53 0.00 0.00 36.38 34.42 1mne s VAL 72 CO -0.00 -0.25 1.03 -0.75 -3.33 0.00 0.00 175.10 171.80 1mne s LYS 73 N -0.91 4.67 0.40 1.54 2.47 -1.26 0.73 119.74 127.38 1mne s LYS 73 Ca -0.08 1.60 0.09 0.00 -1.56 0.00 0.00 55.97 56.02 1mne s LYS 73 Cb -0.06 -3.31 0.88 0.00 -1.46 0.00 0.00 37.83 33.88 1mne s LYS 73 CO -0.00 0.18 2.00 0.87 0.16 0.00 0.00 175.35 178.56 1mne h LYS 74 N 5.13 0.55 0.00 4.03 1.57 -1.62 -1.56 116.57 124.67 1mne h LYS 74 Ca -0.44 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1mne h LYS 74 Cb 1.21 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1mne h LYS 74 CO 0.71 0.36 0.00 -0.25 -0.57 0.00 0.00 179.45 179.71 1mne n ASP 75 N -4.47 0.00 -0.09 0.86 9.92 -1.26 -1.94 116.55 119.55 1mne n ASP 75 Ca 0.08 -0.02 0.02 0.00 -0.53 0.00 0.00 54.79 54.34 1mne n ASP 75 Cb 0.23 -0.30 0.00 0.00 -0.64 0.00 0.00 41.12 40.42 1mne n ASP 75 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1mne n ASP 76 N -1.30 0.91 -4.80 -2.24 8.00 -0.67 -5.06 116.55 111.39 1mne n ASP 76 Ca 0.11 -0.95 -0.37 0.00 0.71 0.00 0.00 54.79 54.28 1mne n ASP 76 Cb 0.20 0.34 -0.06 0.00 -0.02 0.00 0.00 41.12 41.58 1mne n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mne s ALA 77 N -0.64 3.42 -0.86 2.24 0.00 -0.70 -4.89 121.76 120.33 1mne s ALA 77 Ca 0.03 0.24 -0.12 0.00 0.00 0.00 0.00 51.96 52.11 1mne s ALA 77 Cb 0.03 -2.88 0.22 0.00 0.00 0.00 0.00 23.12 20.50 1mne s ALA 77 CO 0.07 0.31 0.79 -0.80 0.00 0.00 0.00 175.76 176.14 1mne s ASN 78 N -1.45 6.72 0.36 0.00 0.01 -1.26 -5.03 114.94 114.29 1mne s ASN 78 Ca 0.40 -2.87 -0.27 0.00 -0.71 0.00 0.00 52.86 49.42 1mne s ASN 78 Cb -0.19 -2.18 -0.09 0.00 0.41 0.00 0.00 41.25 39.20 1mne s ASN 78 CO 0.23 -0.50 1.24 -1.10 -1.51 0.00 0.00 177.10 175.45 1mne s GLN 79 N -0.11 4.21 0.15 -0.60 -0.21 -1.26 0.19 119.66 122.04 1mne s GLN 79 Ca 0.20 2.04 -0.28 0.00 0.02 0.00 0.00 55.36 57.33 1mne s GLN 79 Cb -0.11 -2.89 -0.07 0.00 1.00 0.00 0.00 33.01 30.94 1mne s GLN 79 CO -0.08 -0.25 0.89 0.50 -2.12 0.00 0.00 175.29 174.23 1mne s ARG 80 N -2.00 4.70 0.62 2.91 3.52 -0.97 -4.72 118.95 123.00 1mne s ARG 80 Ca 0.53 1.35 -0.16 0.00 -0.13 0.00 0.00 55.73 57.31 1mne s ARG 80 Cb -0.36 -3.32 -0.02 0.00 -1.56 0.00 0.00 34.95 29.69 1mne s ARG 80 CO 0.46 0.39 1.10 -0.80 -0.81 0.00 0.00 175.30 175.65 1mne s ASN 81 N -0.62 5.41 0.27 -2.12 0.01 -1.26 -4.76 114.94 111.87 1mne s ASN 81 Ca 0.42 2.00 -0.30 0.00 -0.71 0.00 0.00 52.86 54.27 1mne s ASN 81 Cb -0.24 -2.55 -0.10 0.00 0.41 0.00 0.00 41.25 38.76 1mne s ASN 81 CO 0.29 -1.43 1.47 -2.84 -1.51 0.00 0.00 177.10 173.09 1mne s PRO 82 N -3.89 4.23 0.54 -0.60 0.02 -1.26 -4.84 135.00 129.20 1mne s PRO 82 Ca 0.68 2.38 0.48 0.00 0.02 0.00 0.00 61.00 64.55 1mne s PRO 82 Cb -0.20 -3.08 1.64 0.00 0.02 0.00 0.00 34.50 32.87 1mne s PRO 82 CO 0.37 -0.47 1.49 -0.89 -0.33 0.00 0.00 177.00 177.17 1mne n ILE 83 N 2.17 0.00 -0.08 2.83 5.41 -1.26 -0.09 119.36 128.34 1mne n ILE 83 Ca 0.07 1.43 0.24 0.00 1.00 0.00 0.00 62.75 65.49 1mne n ILE 83 Cb 0.40 -2.39 0.71 0.00 -0.71 0.00 0.00 39.64 37.65 1mne n ILE 83 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1mne h LYS 84 N 0.00 0.00 0.00 0.38 3.64 -1.90 0.16 116.57 118.84 1mne h LYS 84 Ca 0.89 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.27 1mne h LYS 84 Cb 3.63 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 35.45 1mne h LYS 84 CO -0.01 0.00 -0.12 1.19 -2.27 0.00 0.00 179.45 178.24 1mne n PHE 85 N -4.27 0.12 -2.03 1.91 3.01 0.87 -4.78 117.46 112.30 1mne n PHE 85 Ca 0.14 0.04 -0.43 0.00 1.01 0.00 0.00 57.45 58.21 1mne n PHE 85 Cb 0.78 -0.51 -0.03 0.00 -0.01 0.00 0.00 39.48 39.71 1mne n PHE 85 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1mne s ASP 86 N -3.21 6.52 0.00 4.37 -0.00 0.55 -2.47 116.67 122.43 1mne s ASP 86 Ca 0.13 2.01 0.00 0.00 -0.00 0.00 0.00 52.55 54.69 1mne s ASP 86 Cb 0.18 -2.53 0.00 0.00 -0.00 0.00 0.00 42.92 40.57 1mne s ASP 86 CO 0.58 -1.08 0.00 0.61 -0.00 0.00 0.00 175.17 175.28 1mne n GLY 87 N 4.37 0.55 3.57 0.21 0.00 -1.26 -5.06 105.19 107.57 1mne n GLY 87 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 1mne n GLY 87 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1mne n VAL 88 N -1.42 2.13 0.64 1.61 0.24 -1.03 -4.87 118.33 115.63 1mne n VAL 88 Ca 0.00 -0.50 0.09 0.00 -2.04 0.00 0.00 64.34 61.89 1mne n VAL 88 Cb 0.00 -0.95 0.39 0.00 -1.47 0.00 0.00 33.84 31.81 1mne n VAL 88 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1mne n GLU 89 N 0.47 0.02 -3.86 7.34 1.02 -1.26 -4.65 120.64 119.72 1mne n GLU 89 Ca 0.10 0.18 -0.15 0.00 -0.02 0.00 0.00 57.16 57.28 1mne n GLU 89 Cb 0.36 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 30.13 1mne n GLU 89 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1mne s ASP 90 N -2.97 0.17 0.59 1.62 3.68 -1.25 -0.74 116.67 117.76 1mne s ASP 90 Ca 0.09 0.01 0.34 0.00 2.13 0.00 0.00 52.55 55.12 1mne s ASP 90 Cb 0.12 -0.09 1.83 0.00 -1.45 0.00 0.00 42.92 43.33 1mne s ASP 90 CO 0.33 -0.08 2.20 0.24 0.13 0.00 0.00 175.17 177.99 1mne h MET 91 N 6.91 0.00 0.00 4.34 2.86 0.38 -2.38 114.93 127.05 1mne h MET 91 Ca -0.39 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.24 1mne h MET 91 Cb 1.15 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.81 1mne h MET 91 CO 0.49 0.04 -0.05 0.77 1.06 0.00 0.00 176.91 179.22 1mne h SER 92 N 0.00 0.00 0.79 1.22 0.02 -1.93 -0.31 113.55 113.34 1mne h SER 92 Ca -0.00 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1mne h SER 92 Cb 0.18 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1mne h SER 92 CO 0.01 0.05 -0.19 -0.33 -1.14 0.00 0.00 176.83 175.23 1mne h GLU 93 N 0.00 0.00 -7.04 3.45 5.08 -1.74 -3.39 114.58 110.93 1mne h GLU 93 Ca -0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 1mne h GLU 93 Cb 0.22 0.00 0.09 0.00 0.50 0.00 0.00 28.75 29.56 1mne h GLU 93 CO 0.01 0.19 0.51 -0.51 -1.00 0.00 0.00 179.01 178.21 1mne s LEU 94 N -6.85 3.87 -0.21 1.33 1.43 -0.13 -4.94 118.68 113.18 1mne s LEU 94 Ca -0.00 2.43 -0.09 0.00 -1.03 0.00 0.00 54.13 55.43 1mne s LEU 94 Cb 0.11 -4.36 -0.19 0.00 0.03 0.00 0.00 46.19 41.77 1mne s LEU 94 CO 0.62 -1.27 0.04 -0.24 0.23 0.00 0.00 176.35 175.72 1mne n SER 95 N -0.96 2.00 -4.47 2.29 2.88 -1.26 -4.65 113.62 109.45 1mne n SER 95 Ca 0.10 0.20 -0.43 0.00 -1.33 0.00 0.00 58.87 57.40 1mne n SER 95 Cb 0.48 -0.77 -0.07 0.00 -0.75 0.00 0.00 64.21 63.11 1mne n SER 95 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1mne s TYR 96 N -2.49 3.06 -0.69 0.66 4.12 -1.26 -2.05 117.35 118.70 1mne s TYR 96 Ca -0.30 -0.40 -0.09 0.00 0.02 0.00 0.00 57.07 56.30 1mne s TYR 96 Cb 0.09 -3.42 0.18 0.00 -1.52 0.00 0.00 41.96 37.29 1mne s TYR 96 CO 0.63 -0.96 0.57 -0.51 0.02 0.00 0.00 175.55 175.30 1mne s LEU 97 N 2.64 5.95 0.33 -1.29 1.02 -1.26 -4.83 118.68 121.24 1mne s LEU 97 Ca 0.17 -2.65 0.03 0.00 0.02 0.00 0.00 54.13 51.70 1mne s LEU 97 Cb -0.18 -2.03 -0.05 0.00 0.02 0.00 0.00 46.19 43.95 1mne s LEU 97 CO 0.14 -0.50 0.09 0.54 0.02 0.00 0.00 176.35 176.63 1mne s ASN 98 N 1.61 2.22 0.04 2.29 2.20 -1.26 -4.93 114.94 117.11 1mne s ASN 98 Ca 0.16 -1.46 -0.23 0.00 -0.94 0.00 0.00 52.86 50.39 1mne s ASN 98 Cb -0.17 0.13 -0.13 0.00 -2.00 0.00 0.00 41.25 39.08 1mne s ASN 98 CO -0.05 -0.72 1.34 -0.33 -2.94 0.00 0.00 177.10 174.40 1mne h GLU 99 N 2.09 -0.79 -1.04 3.55 5.08 -1.99 -1.65 114.58 119.83 1mne h GLU 99 Ca -0.39 0.05 0.28 0.00 -1.00 0.00 0.00 59.36 58.31 1mne h GLU 99 Cb 1.25 0.18 -0.12 0.00 0.50 0.00 0.00 28.75 30.56 1mne h GLU 99 CO 0.64 -0.52 0.63 -1.00 -1.00 0.00 0.00 179.01 177.76 1mne h PRO 100 N -0.82 0.42 -0.75 2.33 0.13 -1.97 0.15 132.00 131.50 1mne h PRO 100 Ca -0.08 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1mne h PRO 100 Cb 0.63 -0.10 -0.04 0.00 0.13 0.00 0.00 31.00 31.63 1mne h PRO 100 CO 0.13 0.28 0.46 0.00 -0.23 0.00 0.00 178.00 178.64 1mne h ALA 101 N 1.71 0.95 -0.18 -0.56 0.00 -1.86 0.56 119.26 119.88 1mne h ALA 101 Ca 0.66 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 55.31 1mne h ALA 101 Cb 1.51 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 19.00 1mne h ALA 101 CO -0.45 0.42 -0.59 0.28 0.00 0.00 0.00 179.25 178.91 1mne h VAL 102 N 1.02 1.30 -0.04 0.00 2.07 0.21 -2.53 116.25 118.29 1mne h VAL 102 Ca 0.27 -1.82 0.02 0.00 0.82 0.00 0.00 66.70 66.00 1mne h VAL 102 Cb -0.05 1.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 1mne h VAL 102 CO -0.05 0.57 -0.12 0.15 0.02 0.00 0.00 177.57 178.14 1mne h PHE 103 N 0.44 -0.30 -0.42 1.57 3.57 -0.44 -2.50 116.94 118.86 1mne h PHE 103 Ca -0.02 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.57 1mne h PHE 103 Cb 1.22 0.14 -0.07 0.00 2.79 0.00 0.00 35.95 40.03 1mne h PHE 103 CO 0.09 -0.18 -0.01 1.25 -2.23 0.00 0.00 178.31 177.23 1mne h HIS 104 N -0.18 -0.05 -0.89 0.41 2.76 0.16 0.46 115.15 117.81 1mne h HIS 104 Ca 0.05 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.32 1mne h HIS 104 Cb 0.26 0.09 -0.06 0.00 1.55 0.00 0.00 27.41 29.24 1mne h HIS 104 CO -0.19 -0.10 0.56 -0.97 -1.30 0.00 0.00 177.93 175.92 1mne h ASN 105 N 0.09 0.88 -0.42 3.26 -0.00 -1.12 0.50 115.58 118.78 1mne h ASN 105 Ca 0.21 0.01 0.05 0.00 -0.00 0.00 0.00 56.30 56.57 1mne h ASN 105 Cb 0.30 -0.17 -0.04 0.00 -0.00 0.00 0.00 38.32 38.40 1mne h ASN 105 CO -0.36 0.56 0.16 0.25 -0.00 0.00 0.00 177.43 178.05 1mne h LEU 106 N 1.01 0.18 0.34 0.34 5.85 -0.91 -0.72 115.31 121.41 1mne h LEU 106 Ca 0.38 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 59.13 1mne h LEU 106 Cb 0.16 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1mne h LEU 106 CO -0.17 0.14 -0.16 -0.09 -0.34 0.00 0.00 178.44 177.82 1mne h ARG 107 N 0.33 -0.44 -0.88 1.25 2.43 0.13 0.70 114.38 117.91 1mne h ARG 107 Ca 0.19 0.03 0.24 0.00 -0.81 0.00 0.00 59.98 59.63 1mne h ARG 107 Cb 0.16 0.10 -0.14 0.00 -0.42 0.00 0.00 29.97 29.67 1mne h ARG 107 CO -0.18 -0.23 0.24 0.28 -1.51 0.00 0.00 179.97 178.57 1mne h VAL 108 N -0.56 0.32 -0.11 0.20 2.07 -0.75 0.67 116.25 118.09 1mne h VAL 108 Ca -0.05 -0.07 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 1mne h VAL 108 Cb 0.41 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1mne h VAL 108 CO 0.08 0.04 -0.06 0.03 0.02 0.00 0.00 177.57 177.67 1mne h ARG 109 N 0.21 0.23 -0.29 1.57 3.08 -0.54 -3.11 114.38 115.53 1mne h ARG 109 Ca 0.55 -0.10 0.08 0.00 0.07 0.00 0.00 59.98 60.58 1mne h ARG 109 Cb 1.12 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 1mne h ARG 109 CO -0.65 0.59 0.21 -0.92 -1.07 0.00 0.00 179.97 178.13 1mne h TYR 110 N -0.14 0.03 0.00 3.04 3.20 0.44 0.13 116.97 123.67 1mne h TYR 110 Ca 0.02 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1mne h TYR 110 Cb 0.53 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.79 1mne h TYR 110 CO 0.07 0.02 -0.05 -0.91 -1.64 0.00 0.00 178.16 175.65 1mne h ASN 111 N 0.03 0.00 -0.59 -2.11 2.35 0.19 0.12 115.58 115.57 1mne h ASN 111 Ca 0.14 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.70 1mne h ASN 111 Cb 0.51 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.77 1mne h ASN 111 CO -0.01 0.05 0.18 0.00 -1.65 0.00 0.00 177.43 176.00 1mne n GLN 112 N -3.65 3.14 -0.83 0.81 6.02 0.28 -4.88 117.38 118.26 1mne n GLN 112 Ca -0.02 -3.06 0.00 0.00 -0.01 0.00 0.00 57.00 53.91 1mne n GLN 112 Cb 0.15 -2.07 0.00 0.00 1.02 0.00 0.00 30.24 29.34 1mne n GLN 112 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1mne n ASP 113 N -0.47 -3.67 -4.55 1.08 10.43 0.40 -4.89 116.55 114.89 1mne n ASP 113 Ca 0.37 0.00 -0.38 0.00 2.57 0.00 0.00 54.79 57.34 1mne n ASP 113 Cb 1.24 -2.92 -0.03 0.00 1.84 0.00 0.00 41.12 41.26 1mne n ASP 113 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1mne s LEU 114 N 0.00 3.25 0.00 0.64 1.43 -0.23 -4.85 118.68 118.93 1mne s LEU 114 Ca 0.00 -0.36 0.30 0.00 -1.03 0.00 0.00 54.13 53.04 1mne s LEU 114 Cb 0.00 -2.55 1.50 0.00 0.03 0.00 0.00 46.19 45.16 1mne s LEU 114 CO 0.00 -2.09 2.00 2.30 0.23 0.00 0.00 176.35 178.78 1mne n ILE 115 N 6.93 0.00 -4.58 -0.59 -5.35 -1.26 -3.33 119.36 111.18 1mne n ILE 115 Ca 0.18 -0.11 -0.24 0.00 -0.27 0.00 0.00 62.75 62.31 1mne n ILE 115 Cb 0.50 -0.04 -0.16 0.00 -1.74 0.00 0.00 39.64 38.20 1mne n ILE 115 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1mne s TYR 116 N -2.03 1.42 -0.07 4.28 4.12 -1.26 -1.29 117.35 122.52 1mne s TYR 116 Ca 0.43 -0.49 -0.09 0.00 0.02 0.00 0.00 57.07 56.93 1mne s TYR 116 Cb 0.21 -1.03 0.02 0.00 -1.52 0.00 0.00 41.96 39.65 1mne s TYR 116 CO 0.36 -0.25 0.24 0.99 0.02 0.00 0.00 175.55 176.92 1mne s THR 117 N 0.56 0.02 0.20 -0.71 2.01 -0.30 -4.70 115.64 112.72 1mne s THR 117 Ca -0.12 -0.16 -0.17 0.00 0.31 0.00 0.00 61.69 61.55 1mne s THR 117 Cb -0.15 -0.40 -0.08 0.00 0.01 0.00 0.00 72.50 71.88 1mne s THR 117 CO 0.03 -0.09 0.65 -0.31 -0.69 0.00 0.00 174.62 174.21 1mne s TYR 118 N -0.28 3.60 -0.36 4.92 2.02 0.08 0.27 117.35 127.60 1mne s TYR 118 Ca -0.04 1.22 -0.00 0.00 -0.37 0.00 0.00 57.07 57.88 1mne s TYR 118 Cb -0.03 -2.50 0.13 0.00 -0.40 0.00 0.00 41.96 39.16 1mne s TYR 118 CO 0.01 0.35 0.19 0.45 -1.57 0.00 0.00 175.55 174.98 1mne s SER 119 N -1.76 3.43 1.26 2.29 0.15 0.37 0.10 113.70 119.54 1mne s SER 119 Ca 0.42 -2.08 0.00 0.00 0.70 0.00 0.00 55.95 54.99 1mne s SER 119 Cb -0.15 -0.65 0.00 0.00 -1.71 0.00 0.00 66.02 63.51 1mne s SER 119 CO 0.20 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 174.91 1mne n GLY 120 N 4.22 1.87 0.23 9.45 0.00 -1.26 0.98 105.19 120.67 1mne n GLY 120 Ca 0.06 0.44 0.12 0.00 0.00 0.00 0.00 46.02 46.63 1mne n GLY 120 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1mne h LEU 121 N 0.00 0.00-10.15 0.99 3.38 -1.96 -3.45 115.31 104.12 1mne h LEU 121 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 1mne h LEU 121 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1mne h LEU 121 CO 0.00 0.12 0.07 -0.36 0.09 0.00 0.00 178.44 178.36 1mne s PHE 122 N -3.41 3.47 -0.37 1.13 0.40 0.28 -4.42 117.98 115.07 1mne s PHE 122 Ca 0.03 0.97 -0.09 0.00 -0.60 0.00 0.00 56.93 57.24 1mne s PHE 122 Cb 0.08 -2.38 0.04 0.00 0.51 0.00 0.00 43.02 41.26 1mne s PHE 122 CO 0.64 -0.07 0.18 -1.17 0.70 0.00 0.00 175.22 175.50 1mne s LEU 123 N -3.83 4.63 0.04 -0.37 2.96 -1.15 0.14 118.68 121.09 1mne s LEU 123 Ca 0.50 -1.09 -0.15 0.00 -0.22 0.00 0.00 54.13 53.17 1mne s LEU 123 Cb -0.10 -1.97 -0.06 0.00 0.50 0.00 0.00 46.19 44.56 1mne s LEU 123 CO 0.32 -0.38 0.44 -0.69 -1.32 0.00 0.00 176.35 174.72 1mne s VAL 124 N 1.49 4.98 -0.19 1.68 1.01 0.77 -2.08 120.40 128.06 1mne s VAL 124 Ca 0.01 0.83 -0.03 0.00 0.00 0.00 0.00 61.98 62.79 1mne s VAL 124 Cb -0.20 -3.73 0.06 0.00 0.00 0.00 0.00 36.38 32.52 1mne s VAL 124 CO 0.05 0.50 0.06 0.00 0.00 0.00 0.00 175.10 175.71 1mne s ALA 125 N -1.17 0.82 -0.16 5.51 0.00 -0.40 -1.15 121.76 125.21 1mne s ALA 125 Ca 0.27 -0.62 -0.17 0.00 0.00 0.00 0.00 51.96 51.44 1mne s ALA 125 Cb -0.16 -1.16 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 1mne s ALA 125 CO 0.15 -1.21 0.45 0.08 0.00 0.00 0.00 175.76 175.23 1mne s VAL 126 N 1.95 5.19 0.32 0.00 1.01 -0.41 -0.02 120.40 128.43 1mne s VAL 126 Ca 0.01 0.86 -0.29 0.00 0.00 0.00 0.00 61.98 62.55 1mne s VAL 126 Cb -0.17 -3.78 -0.11 0.00 0.00 0.00 0.00 36.38 32.32 1mne s VAL 126 CO -0.10 0.28 1.54 0.21 0.00 0.00 0.00 175.10 177.03 1mne s ASN 127 N 0.81 6.40 -0.01 3.32 3.84 -0.10 -4.75 114.94 124.45 1mne s ASN 127 Ca 0.23 2.95 0.21 0.00 0.21 0.00 0.00 52.86 56.46 1mne s ASN 127 Cb -0.15 -2.64 -0.27 0.00 -0.55 0.00 0.00 41.25 37.64 1mne s ASN 127 CO 0.09 -0.87 0.54 -0.81 -2.79 0.00 0.00 177.10 173.26 1mne n PRO 128 N 1.59 0.65 -2.07 0.43 -0.04 -1.26 -4.48 135.00 129.83 1mne n PRO 128 Ca 0.05 -0.11 -0.11 0.00 -0.04 0.00 0.00 63.50 63.30 1mne n PRO 128 Cb 0.38 -1.58 -0.01 0.00 -0.04 0.00 0.00 33.50 32.25 1mne n PRO 128 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1mne n PHE 129 N -2.41 -0.43 -3.62 0.54 0.99 -1.26 -4.31 117.46 106.96 1mne n PHE 129 Ca -0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 57.45 57.34 1mne n PHE 129 Cb 0.65 -2.45 -0.01 0.00 -1.00 0.00 0.00 39.48 36.66 1mne n PHE 129 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.76 175.17 1mne s LYS 130 N -4.28 0.74 -0.26 -1.08 -2.85 -1.26 -4.51 119.74 106.23 1mne s LYS 130 Ca 0.00 -0.35 -0.25 0.00 -1.00 0.00 0.00 55.97 54.37 1mne s LYS 130 Cb 0.00 0.29 -0.00 0.00 -2.06 0.00 0.00 37.83 36.06 1mne s LYS 130 CO 0.00 -0.33 0.87 1.03 0.10 0.00 0.00 175.35 177.02 1mne s ARG 131 N -2.88 4.15 -0.14 1.78 1.81 -1.26 -5.02 118.95 117.39 1mne s ARG 131 Ca 0.10 0.95 0.01 0.00 -1.72 0.00 0.00 55.73 55.07 1mne s ARG 131 Cb 0.00 -3.66 -0.00 0.00 -0.45 0.00 0.00 34.95 30.83 1mne s ARG 131 CO -0.04 -0.58 -0.16 0.42 -0.68 0.00 0.00 175.30 174.26 1mne s ILE 132 N 2.96 2.68 -1.45 1.52 1.01 -1.26 -5.03 121.20 121.63 1mne s ILE 132 Ca 0.36 -0.78 -0.14 0.00 0.00 0.00 0.00 60.65 60.10 1mne s ILE 132 Cb -0.15 -2.12 0.05 0.00 0.01 0.00 0.00 42.46 40.25 1mne s ILE 132 CO 0.08 0.52 2.21 -0.81 0.00 0.00 0.00 174.94 176.94 1mne n PRO 133 N 3.85 2.92 -0.24 2.79 -0.04 -1.26 -4.35 135.00 138.68 1mne n PRO 133 Ca -0.19 -2.67 0.08 0.00 -0.04 0.00 0.00 63.50 60.68 1mne n PRO 133 Cb 0.52 -3.26 0.13 0.00 -0.04 0.00 0.00 33.50 30.86 1mne n PRO 133 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1mne n ILE 134 N 4.94 1.68 -2.17 0.52 -5.35 -1.26 -4.73 119.36 112.99 1mne n ILE 134 Ca 0.51 -2.13 -0.08 0.00 -0.27 0.00 0.00 62.75 60.78 1mne n ILE 134 Cb 0.39 -0.12 0.07 0.00 -1.74 0.00 0.00 39.64 38.23 1mne n ILE 134 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1mne n TYR 135 N -1.18 1.40 -2.88 4.28 4.01 -1.26 -4.88 117.16 116.65 1mne n TYR 135 Ca 0.14 -1.80 -0.22 0.00 -0.16 0.00 0.00 57.90 55.86 1mne n TYR 135 Cb 0.67 -0.27 0.02 0.00 -0.31 0.00 0.00 39.34 39.45 1mne n TYR 135 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1mne s THR 136 N -3.49 3.42 0.38 -0.72 -4.23 -1.26 -4.87 115.64 104.88 1mne s THR 136 Ca 0.40 -0.62 0.06 0.00 -1.18 0.00 0.00 61.69 60.35 1mne s THR 136 Cb 0.38 -3.26 0.27 0.00 1.34 0.00 0.00 72.50 71.23 1mne s THR 136 CO -0.03 -0.17 2.02 -0.61 -0.54 0.00 0.00 174.62 175.28 1mne h GLN 137 N 0.31 0.67 0.29 3.99 5.75 -1.97 2.31 115.11 126.45 1mne h GLN 137 Ca -0.44 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.00 1mne h GLN 137 Cb 1.27 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 29.67 1mne h GLN 137 CO 0.54 0.44 -0.14 0.93 -2.65 0.00 0.00 178.83 177.96 1mne h GLU 138 N 0.69 -0.37 -0.99 1.69 3.07 -1.99 0.51 114.58 117.18 1mne h GLU 138 Ca 0.22 0.03 0.10 0.00 -0.50 0.00 0.00 59.36 59.20 1mne h GLU 138 Cb 0.03 0.08 -0.08 0.00 -0.84 0.00 0.00 28.75 27.95 1mne h GLU 138 CO -0.06 -0.24 0.63 0.52 -1.40 0.00 0.00 179.01 178.46 1mne h MET 139 N -0.39 1.01 0.16 2.33 2.86 -0.34 0.15 114.93 120.71 1mne h MET 139 Ca -0.04 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1mne h MET 139 Cb 0.30 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1mne h MET 139 CO 0.07 0.67 -0.08 0.28 1.06 0.00 0.00 176.91 178.91 1mne h VAL 140 N 1.04 0.87 0.00 -2.22 2.07 0.44 -2.68 116.25 115.78 1mne h VAL 140 Ca 0.47 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.84 1mne h VAL 140 Cb 0.38 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1mne h VAL 140 CO -0.22 0.04 0.00 0.47 0.02 0.00 0.00 177.57 177.87 1mne n ASP 141 N -5.15 0.03 0.10 0.57 9.92 0.09 -1.83 116.55 120.29 1mne n ASP 141 Ca -0.09 0.51 0.12 0.00 -0.53 0.00 0.00 54.79 54.80 1mne n ASP 141 Cb 0.14 -0.52 0.08 0.00 -0.64 0.00 0.00 41.12 40.18 1mne n ASP 141 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 1mne h ILE 142 N 0.00 0.00 0.00 0.53 2.04 -1.11 -3.33 117.51 115.64 1mne h ILE 142 Ca 0.00 -0.83 -0.18 0.00 1.00 0.00 0.00 64.86 64.85 1mne h ILE 142 Cb 0.15 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1mne h ILE 142 CO 0.00 0.00 -1.43 -0.26 0.00 0.00 0.00 178.15 176.46 1mne h PHE 143 N 0.00 0.00 -0.40 1.37 -1.00 -1.35 -3.44 116.94 112.12 1mne h PHE 143 Ca 0.00 0.00 -0.57 0.00 2.81 0.00 0.00 57.97 60.21 1mne h PHE 143 Cb 0.91 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.42 1mne h PHE 143 CO 0.00 0.63 1.60 1.63 -1.61 0.00 0.00 178.31 180.56 1mne n LYS 144 N -2.91 0.31 -0.39 1.51 5.02 -1.20 -0.90 118.16 119.59 1mne n LYS 144 Ca -0.10 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1mne n LYS 144 Cb 0.86 -1.93 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 1mne n LYS 144 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mne n GLY 145 N 6.64 0.95 3.84 0.72 0.00 -1.26 -5.04 105.19 111.03 1mne n GLY 145 Ca 0.56 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.26 1mne n GLY 145 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mne s ARG 146 N -0.48 3.99 0.64 1.61 1.81 -0.08 -5.04 118.95 121.40 1mne s ARG 146 Ca 0.00 0.92 -0.11 0.00 -1.72 0.00 0.00 55.73 54.82 1mne s ARG 146 Cb 0.00 -2.19 -0.03 0.00 -0.45 0.00 0.00 34.95 32.28 1mne s ARG 146 CO 0.00 -0.16 1.04 1.03 -0.68 0.00 0.00 175.30 176.53 1mne s ARG 147 N -3.78 3.46 0.58 3.54 0.52 -1.26 -4.77 118.95 117.23 1mne s ARG 147 Ca 0.58 0.70 0.28 0.00 -0.52 0.00 0.00 55.73 56.77 1mne s ARG 147 Cb -0.10 -2.07 1.70 0.00 0.52 0.00 0.00 34.95 35.01 1mne s ARG 147 CO 0.26 -0.66 2.19 -0.09 0.02 0.00 0.00 175.30 177.02 1mne h ARG 148 N -0.39 0.00 0.00 3.54 2.43 -1.93 -1.38 114.38 116.66 1mne h ARG 148 Ca -0.44 0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 58.50 1mne h ARG 148 Cb 1.20 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.71 1mne h ARG 148 CO 0.62 0.00 -1.45 -2.95 -1.51 0.00 0.00 179.97 174.68 1mne h ASN 149 N 0.00 0.00 -0.82 -3.80 7.08 -1.98 -3.27 115.58 112.79 1mne h ASN 149 Ca 0.03 0.00 0.05 0.00 -3.08 0.00 0.00 56.30 53.31 1mne h ASN 149 Cb 0.18 0.00 -0.06 0.00 -2.08 0.00 0.00 38.32 36.36 1mne h ASN 149 CO -0.00 0.81 0.50 -0.33 -2.08 0.00 0.00 177.43 176.34 1mne h GLU 150 N 0.00 0.91 -5.55 4.14 5.08 -1.64 -3.45 114.58 114.07 1mne h GLU 150 Ca -0.19 -0.05 -0.50 0.00 -1.00 0.00 0.00 59.36 57.61 1mne h GLU 150 Cb 1.79 -0.20 -0.14 0.00 0.50 0.00 0.00 28.75 30.70 1mne h GLU 150 CO 0.07 0.60 -0.68 0.14 -1.00 0.00 0.00 179.01 178.14 1mne s VAL 151 N -6.08 1.70 0.75 3.13 -7.23 -0.95 -4.97 120.40 106.76 1mne s VAL 151 Ca -0.13 -2.14 -0.15 0.00 -1.81 0.00 0.00 61.98 57.75 1mne s VAL 151 Cb 0.18 -2.42 0.05 0.00 0.56 0.00 0.00 36.38 34.74 1mne s VAL 151 CO 0.78 -0.32 1.23 0.00 -0.31 0.00 0.00 175.10 176.48 1mne s ALA 152 N -2.97 2.03 0.57 1.32 0.00 -1.26 -4.88 121.76 116.56 1mne s ALA 152 Ca 0.29 0.95 -0.20 0.00 0.00 0.00 0.00 51.96 53.00 1mne s ALA 152 Cb 0.03 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.60 1mne s ALA 152 CO 0.12 -2.03 1.27 -2.14 0.00 0.00 0.00 175.76 172.98 1mne s PRO 153 N -3.89 3.07 0.00 0.00 0.02 -1.26 -4.82 135.00 128.12 1mne s PRO 153 Ca 0.76 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.79 1mne s PRO 153 Cb -0.31 -2.10 0.00 0.00 0.02 0.00 0.00 34.50 32.11 1mne s PRO 153 CO 0.47 -1.18 0.00 1.58 -0.33 0.00 0.00 177.00 177.54 1mne n HIS 154 N -1.29 0.00 -0.13 6.54 -0.00 -1.26 -4.84 115.22 114.24 1mne n HIS 154 Ca 0.12 0.00 0.16 0.00 0.46 0.00 0.00 57.72 58.46 1mne n HIS 154 Cb 0.47 0.00 0.53 0.00 -0.12 0.00 0.00 29.99 30.88 1mne n HIS 154 CO 0.00 0.00 0.00 0.97 0.46 0.00 0.00 176.34 177.77 1mne h ILE 155 N 0.00 0.80 -0.93 3.57 6.09 -1.98 0.91 117.51 125.97 1mne h ILE 155 Ca 0.00 -0.12 0.02 0.00 -1.37 0.00 0.00 64.86 63.39 1mne h ILE 155 Cb 0.00 0.42 -0.05 0.00 0.47 0.00 0.00 36.82 37.66 1mne h ILE 155 CO 0.00 0.06 0.62 -0.26 -3.07 0.00 0.00 178.15 175.50 1mne h PHE 156 N 0.35 1.16 0.03 2.19 0.05 -1.94 -2.68 116.94 116.10 1mne h PHE 156 Ca 0.34 0.03 -0.00 0.00 3.82 0.00 0.00 57.97 62.15 1mne h PHE 156 Cb 0.83 -0.39 0.00 0.00 2.00 0.00 0.00 35.95 38.39 1mne h PHE 156 CO -0.00 0.71 -0.02 0.00 -0.18 0.00 0.00 178.31 178.82 1mne h ALA 157 N 1.36 -0.04 -0.00 2.45 0.00 -1.15 -1.02 119.26 120.84 1mne h ALA 157 Ca 0.35 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1mne h ALA 157 Cb -0.10 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1mne h ALA 157 CO -0.09 -0.42 -0.02 0.97 0.00 0.00 0.00 179.25 179.69 1mne h ILE 158 N -0.26 1.02 0.00 0.00 6.09 -1.31 0.13 117.51 123.18 1mne h ILE 158 Ca -0.00 -0.10 -0.17 0.00 -1.37 0.00 0.00 64.86 63.22 1mne h ILE 158 Cb 0.24 1.05 -0.02 0.00 0.47 0.00 0.00 36.82 38.55 1mne h ILE 158 CO 0.01 0.03 -0.79 0.28 -3.07 0.00 0.00 178.15 174.60 1mne h SER 159 N 0.01 0.00 -0.36 2.19 0.02 -1.34 -2.37 113.55 111.69 1mne h SER 159 Ca 0.00 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 1mne h SER 159 Cb 0.05 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 1mne h SER 159 CO 0.00 0.79 -0.32 -0.78 -1.14 0.00 0.00 176.83 175.39 1mne h ASP 160 N 0.00 0.91 -0.86 3.07 1.82 0.58 -2.17 116.42 119.77 1mne h ASP 160 Ca -0.01 -0.45 0.08 0.00 -0.39 0.00 0.00 57.03 56.25 1mne h ASP 160 Cb 1.51 -0.25 -0.07 0.00 0.68 0.00 0.00 39.33 41.20 1mne h ASP 160 CO 0.10 1.17 0.52 0.58 -1.61 0.00 0.00 179.24 180.00 1mne h VAL 161 N 0.65 0.99 0.29 2.25 2.07 -1.13 0.78 116.25 122.15 1mne h VAL 161 Ca 0.06 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1mne h VAL 161 Cb 0.90 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1mne h VAL 161 CO 0.08 0.17 -0.14 0.00 0.02 0.00 0.00 177.57 177.70 1mne h ALA 162 N 1.43 -0.39 -0.28 1.67 0.00 -1.36 -1.29 119.26 119.04 1mne h ALA 162 Ca 0.39 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.25 1mne h ALA 162 Cb 0.26 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1mne h ALA 162 CO -0.20 -0.72 0.08 -0.92 0.00 0.00 0.00 179.25 177.49 1mne h TYR 163 N -0.39 0.15 -0.25 0.00 3.20 -0.51 -0.41 116.97 118.76 1mne h TYR 163 Ca -0.04 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1mne h TYR 163 Cb 0.30 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 1mne h TYR 163 CO -0.06 0.06 0.11 0.00 -1.64 0.00 0.00 178.16 176.63 1mne h ARG 164 N 0.20 0.37 -1.00 1.82 2.47 -0.84 -1.28 114.38 116.12 1mne h ARG 164 Ca 0.13 -0.06 0.21 0.00 -1.26 0.00 0.00 59.98 59.00 1mne h ARG 164 Cb 0.11 -0.06 -0.11 0.00 -1.65 0.00 0.00 29.97 28.25 1mne h ARG 164 CO -0.14 0.39 0.60 0.77 0.56 0.00 0.00 179.97 182.15 1mne h SER 165 N 0.26 0.73 -0.45 7.04 0.02 -0.90 0.62 113.55 120.87 1mne h SER 165 Ca 0.08 0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 61.13 1mne h SER 165 Cb 0.15 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 1mne h SER 165 CO -0.01 0.20 0.22 -0.03 -1.14 0.00 0.00 176.83 176.07 1mne h MET 166 N 0.68 0.65 -0.27 3.45 1.85 0.09 0.14 114.93 121.52 1mne h MET 166 Ca 0.60 -0.09 -0.06 0.00 -0.61 0.00 0.00 59.70 59.54 1mne h MET 166 Cb 1.03 -0.12 -0.01 0.00 0.43 0.00 0.00 31.60 32.93 1mne h MET 166 CO -0.42 0.55 -0.07 -0.07 -0.40 0.00 0.00 176.91 176.50 1mne h LEU 167 N 0.59 0.53 -0.01 3.39 3.38 -0.79 0.88 115.31 123.27 1mne h LEU 167 Ca 0.16 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1mne h LEU 167 Cb 0.11 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1mne h LEU 167 CO -0.02 0.77 0.00 0.44 0.09 0.00 0.00 178.44 179.72 1mne h ASP 168 N 0.29 0.00 0.00 -0.43 3.32 0.43 -3.32 116.42 116.71 1mne h ASP 168 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1mne h ASP 168 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1mne h ASP 168 CO 0.03 0.00 -0.12 0.47 -1.72 0.00 0.00 179.24 177.89 1mne n ASP 169 N -2.35 0.62 -3.07 6.45 10.43 0.48 -4.98 116.55 124.13 1mne n ASP 169 Ca 0.05 -0.37 -0.22 0.00 2.57 0.00 0.00 54.79 56.82 1mne n ASP 169 Cb 0.44 0.87 0.02 0.00 1.84 0.00 0.00 41.12 44.29 1mne n ASP 169 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1mne n ARG 170 N -0.93 -4.39 -4.73 -1.24 5.12 0.30 -4.97 116.66 105.82 1mne n ARG 170 Ca 0.00 0.80 -0.33 0.00 -1.93 0.00 0.00 57.85 56.39 1mne n ARG 170 Cb 0.00 -5.62 -0.12 0.00 -1.16 0.00 0.00 32.46 25.56 1mne n ARG 170 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1mne s GLN 171 N -5.74 2.69 0.60 5.56 0.74 -1.18 -5.04 119.66 117.29 1mne s GLN 171 Ca 0.31 -0.61 -0.16 0.00 0.05 0.00 0.00 55.36 54.95 1mne s GLN 171 Cb -0.14 -2.51 -0.03 0.00 1.10 0.00 0.00 33.01 31.43 1mne s GLN 171 CO 0.38 0.63 1.08 -0.80 -0.55 0.00 0.00 175.29 176.03 1mne s ASN 172 N -0.72 5.58 0.39 6.67 0.01 -1.26 -4.35 114.94 121.27 1mne s ASN 172 Ca 0.11 1.92 0.06 0.00 -0.71 0.00 0.00 52.86 54.24 1mne s ASN 172 Cb -0.11 -2.54 -0.08 0.00 0.41 0.00 0.00 41.25 38.93 1mne s ASN 172 CO 0.01 -1.30 0.02 -1.10 -1.51 0.00 0.00 177.10 173.22 1mne s GLN 173 N -3.96 1.90 -0.22 -0.60 -1.52 -0.84 -0.82 119.66 113.60 1mne s GLN 173 Ca 0.66 -2.08 -0.19 0.00 -1.95 0.00 0.00 55.36 51.80 1mne s GLN 173 Cb -0.18 -1.49 0.06 0.00 -0.22 0.00 0.00 33.01 31.18 1mne s GLN 173 CO 0.37 -0.08 0.57 -1.54 -0.25 0.00 0.00 175.29 174.36 1mne s SER 174 N -3.67 -0.61 -0.15 5.90 1.04 0.18 -0.73 113.70 115.66 1mne s SER 174 Ca 0.35 1.16 0.00 0.00 0.48 0.00 0.00 55.95 57.94 1mne s SER 174 Cb 0.10 1.16 -0.00 0.00 0.10 0.00 0.00 66.02 67.38 1mne s SER 174 CO 0.17 -0.20 -0.15 -0.76 0.98 0.00 0.00 173.24 173.29 1mne s LEU 175 N 0.44 2.52 -0.40 2.42 1.02 -0.07 0.11 118.68 124.72 1mne s LEU 175 Ca -0.01 -0.44 -0.15 0.00 0.02 0.00 0.00 54.13 53.55 1mne s LEU 175 Cb -0.04 -1.57 0.01 0.00 0.02 0.00 0.00 46.19 44.61 1mne s LEU 175 CO -0.01 0.10 0.31 -0.76 0.02 0.00 0.00 176.35 176.00 1mne s LEU 176 N 0.75 4.98 -0.29 1.79 1.02 0.49 -1.99 118.68 125.43 1mne s LEU 176 Ca -0.06 -0.79 -0.03 0.00 0.02 0.00 0.00 54.13 53.27 1mne s LEU 176 Cb -0.15 -2.19 0.03 0.00 0.02 0.00 0.00 46.19 43.90 1mne s LEU 176 CO 0.01 -0.43 0.01 -0.63 0.02 0.00 0.00 176.35 175.33 1mne s ILE 177 N 1.74 3.25 0.14 -0.59 1.01 -0.14 -0.11 121.20 126.51 1mne s ILE 177 Ca 0.06 -1.09 -0.00 0.00 0.00 0.00 0.00 60.65 59.62 1mne s ILE 177 Cb -0.18 -2.75 -0.04 0.00 0.01 0.00 0.00 42.46 39.49 1mne s ILE 177 CO 0.11 0.02 0.04 0.42 0.00 0.00 0.00 174.94 175.53 1mne s THR 178 N 1.35 0.26 0.00 2.92 -4.23 -1.12 -2.61 115.64 112.21 1mne s THR 178 Ca -0.01 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 58.57 1mne s THR 178 Cb -0.18 -2.08 0.00 0.00 1.34 0.00 0.00 72.50 71.58 1mne s THR 178 CO -0.01 -0.45 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 1mne n GLY 179 N -0.14 0.26 3.70 3.99 0.00 -1.24 -2.13 105.19 109.62 1mne n GLY 179 Ca -0.06 -1.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.03 1mne n GLY 179 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mne s GLU 180 N -1.52 1.31 0.08 1.61 2.02 -1.26 -2.28 118.70 118.66 1mne s GLU 180 Ca 0.00 1.05 -0.33 0.00 0.02 0.00 0.00 54.97 55.71 1mne s GLU 180 Cb 0.00 -1.80 -0.13 0.00 0.10 0.00 0.00 34.13 32.31 1mne s GLU 180 CO 0.00 -2.27 1.72 0.45 0.02 0.00 0.00 175.26 175.18 1mne n SER 181 N -3.93 3.40 0.00 -0.19 2.88 -1.26 -1.29 113.62 113.22 1mne n SER 181 Ca 0.08 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.65 1mne n SER 181 Cb 0.54 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 1mne n SER 181 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1mne n GLY 182 N 3.86 2.06 0.28 0.46 0.00 -1.26 -4.86 105.19 105.74 1mne n GLY 182 Ca 0.19 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.38 1mne n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mne h ALA 183 N 0.00 1.07 0.00 4.61 0.00 -1.51 -3.47 119.26 119.95 1mne h ALA 183 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1mne h ALA 183 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1mne h ALA 183 CO 0.00 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.72 1mne n GLY 184 N -0.37 1.48 0.17 0.00 0.00 -1.26 -4.13 105.19 101.07 1mne n GLY 184 Ca -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1mne n GLY 184 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mne n LYS 185 N 0.00 -0.18 -0.10 1.61 5.02 -1.26 -1.30 118.16 121.95 1mne n LYS 185 Ca 0.00 0.80 0.01 0.00 -2.02 0.00 0.00 58.31 57.10 1mne n LYS 185 Cb 0.00 -1.19 0.31 0.00 -0.02 0.00 0.00 35.03 34.13 1mne n LYS 185 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1mne h THR 186 N 0.00 1.17 0.19 -0.18 2.02 -1.96 0.38 112.91 114.53 1mne h THR 186 Ca 0.07 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.81 1mne h THR 186 Cb 0.17 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1mne h THR 186 CO -0.39 0.19 -0.15 -0.33 0.37 0.00 0.00 175.52 175.22 1mne h GLU 187 N 0.75 -0.31 -0.93 6.66 4.39 -1.63 0.23 114.58 123.74 1mne h GLU 187 Ca 0.19 0.02 0.15 0.00 0.34 0.00 0.00 59.36 60.06 1mne h GLU 187 Cb 0.03 0.07 -0.09 0.00 -0.10 0.00 0.00 28.75 28.66 1mne h GLU 187 CO -0.03 -0.21 0.54 -0.91 -1.16 0.00 0.00 179.01 177.24 1mne h ASN 188 N -0.32 0.72 -0.32 1.42 2.35 -1.30 0.24 115.58 118.36 1mne h ASN 188 Ca -0.02 0.08 0.07 0.00 -0.55 0.00 0.00 56.30 55.87 1mne h ASN 188 Cb 0.27 -0.05 -0.06 0.00 0.05 0.00 0.00 38.32 38.52 1mne h ASN 188 CO 0.01 0.32 -0.09 0.74 -1.65 0.00 0.00 177.43 176.76 1mne h THR 189 N 0.78 0.65 -0.33 2.81 2.02 -0.07 0.33 112.91 119.09 1mne h THR 189 Ca 0.50 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.69 1mne h THR 189 Cb 0.66 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1mne h THR 189 CO -0.33 0.00 0.22 0.11 0.37 0.00 0.00 175.52 175.89 1mne h LYS 190 N -0.02 0.39 -0.06 6.66 1.57 0.15 -2.43 116.57 122.84 1mne h LYS 190 Ca 0.16 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1mne h LYS 190 Cb 0.26 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 1mne h LYS 190 CO -0.34 0.26 0.02 0.87 -0.57 0.00 0.00 179.45 179.69 1mne h LYS 191 N 0.41 0.09 -0.44 3.15 1.79 0.10 -1.73 116.57 119.94 1mne h LYS 191 Ca 0.13 -0.02 0.09 0.00 -2.18 0.00 0.00 60.65 58.67 1mne h LYS 191 Cb 0.02 -0.01 -0.10 0.00 -1.58 0.00 0.00 32.23 30.56 1mne h LYS 191 CO -0.03 0.23 -0.31 0.28 -1.08 0.00 0.00 179.45 178.54 1mne h VAL 192 N -0.07 0.24 -0.65 0.50 2.07 -0.74 0.55 116.25 118.15 1mne h VAL 192 Ca 0.02 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.60 1mne h VAL 192 Cb 0.17 0.24 -0.06 0.00 -1.52 0.00 0.00 31.29 30.13 1mne h VAL 192 CO -0.00 0.00 0.36 0.40 0.02 0.00 0.00 177.57 178.34 1mne h ILE 193 N -0.22 0.95 0.05 4.57 2.04 -1.29 0.35 117.51 123.97 1mne h ILE 193 Ca 0.19 -0.22 0.02 0.00 1.00 0.00 0.00 64.86 65.85 1mne h ILE 193 Cb 0.53 0.24 -0.05 0.00 -0.74 0.00 0.00 36.82 36.80 1mne h ILE 193 CO -0.56 0.12 -0.46 -0.61 0.00 0.00 0.00 178.15 176.64 1mne h GLN 194 N 0.66 -0.62 -0.87 2.37 4.15 -0.38 0.46 115.11 120.87 1mne h GLN 194 Ca 0.30 0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.79 1mne h GLN 194 Cb 0.20 0.14 -0.05 0.00 0.21 0.00 0.00 27.48 27.98 1mne h GLN 194 CO -0.19 -0.41 0.56 -0.92 -1.93 0.00 0.00 178.83 175.94 1mne h TYR 195 N -0.64 1.06 -0.21 3.99 3.20 0.79 -1.78 116.97 123.38 1mne h TYR 195 Ca 0.03 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 1mne h TYR 195 Cb 0.69 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 1mne h TYR 195 CO -0.43 0.61 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.61 1mne h LEU 196 N 1.10 0.37 -1.72 2.82 3.38 0.75 -1.70 115.31 120.31 1mne h LEU 196 Ca 0.35 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1mne h LEU 196 Cb -0.00 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1mne h LEU 196 CO -0.11 0.61 0.00 0.00 0.09 0.00 0.00 178.44 179.03 1mne h ALA 197 N 0.77 1.00 0.01 1.53 0.00 0.09 -1.44 119.26 121.22 1mne h ALA 197 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.71 1mne h ALA 197 Cb 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1mne h ALA 197 CO 0.01 0.00 -1.37 0.45 0.00 0.00 0.00 179.25 178.34 1mne n SER 198 N -2.70 1.89 0.13 0.00 2.88 -0.69 -2.64 113.62 112.49 1mne n SER 198 Ca -0.01 0.40 -0.01 0.00 -1.33 0.00 0.00 58.87 57.92 1mne n SER 198 Cb 0.16 -0.95 0.22 0.00 -0.75 0.00 0.00 64.21 62.88 1mne n SER 198 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 1mne h VAL 199 N -0.90 1.37 -0.13 2.46 -1.51 -1.30 -3.31 116.25 112.93 1mne h VAL 199 Ca -0.37 -1.80 0.00 0.00 -1.23 0.00 0.00 66.70 63.31 1mne h VAL 199 Cb 1.38 1.94 0.00 0.00 -2.13 0.00 0.00 31.29 32.48 1mne h VAL 199 CO -0.19 0.52 0.00 0.00 -1.23 0.00 0.00 177.57 176.67 1mne n ALA 200 N -2.45 2.09 -2.02 5.19 0.00 -0.55 -5.03 120.51 117.75 1mne n ALA 200 Ca -0.02 -1.14 -0.26 0.00 0.00 0.00 0.00 53.44 52.03 1mne n ALA 200 Cb 0.54 -0.19 0.05 0.00 0.00 0.00 0.00 19.45 19.85 1mne n ALA 200 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1mne s GLY 201 N -1.08 1.66 -0.87 0.00 0.00 -1.08 -2.23 107.32 103.72 1mne s GLY 201 Ca 0.10 -0.87 -0.00 0.00 0.00 0.00 0.00 44.72 43.95 1mne s GLY 201 CO 0.06 -0.54 0.87 0.54 0.00 0.00 0.00 173.10 174.03 1mne n ARG 202 N -2.68 2.87 -4.52 2.90 1.74 -1.26 -4.95 116.66 110.76 1mne n ARG 202 Ca 0.06 -4.53 -0.34 0.00 -0.77 0.00 0.00 57.85 52.27 1mne n ARG 202 Cb 0.59 -2.39 -0.11 0.00 -1.02 0.00 0.00 32.46 29.53 1mne n ARG 202 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1mne s ASN 203 N -0.92 4.82 0.00 0.55 0.02 -1.26 -4.10 114.94 114.06 1mne s ASN 203 Ca 0.30 -0.01 0.00 0.00 -1.02 0.00 0.00 52.86 52.14 1mne s ASN 203 Cb -0.01 -1.38 0.00 0.00 0.02 0.00 0.00 41.25 39.88 1mne s ASN 203 CO -0.07 0.32 0.00 0.00 0.02 0.00 0.00 177.10 177.37 1mne n GLN 204 N 2.50 2.52 -3.80 -0.60 1.13 -1.26 -5.23 117.38 112.63 1mne n GLN 204 Ca -0.18 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.79 1mne n GLN 204 Cb 0.53 -0.78 -0.04 0.00 0.11 0.00 0.00 30.24 30.06 1mne n GLN 204 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1mne s GLY 209 N -1.49 0.02 -0.04 1.08 0.00 -1.26 -5.33 107.32 100.31 1mne s GLY 209 Ca 0.00 -0.36 -0.18 0.00 0.00 0.00 0.00 44.72 44.18 1mne s GLY 209 CO 0.00 -0.30 0.78 -2.08 0.00 0.00 0.00 173.10 171.49 1mne h VAL 210 N 2.18 0.40 -0.19 1.40 2.07 -1.99 -3.02 116.25 117.10 1mne h VAL 210 Ca -0.27 -0.82 0.02 0.00 0.82 0.00 0.00 66.70 66.45 1mne h VAL 210 Cb 1.26 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 1mne h VAL 210 CO 0.35 0.10 -0.11 -0.11 0.02 0.00 0.00 177.57 177.82 1mne n LEU 211 N -5.05 -0.20 -0.34 2.57 7.94 -1.26 0.25 117.00 120.90 1mne n LEU 211 Ca -0.07 0.86 0.07 0.00 -1.11 0.00 0.00 56.01 55.76 1mne n LEU 211 Cb 0.24 -0.30 0.17 0.00 0.53 0.00 0.00 43.42 44.05 1mne n LEU 211 CO 0.21 -0.53 0.70 -0.33 -1.11 0.00 0.00 177.39 176.33 1mne h GLU 212 N 0.00 0.00 0.23 1.96 3.07 -1.97 1.18 114.58 119.06 1mne h GLU 212 Ca 0.03 -0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.89 1mne h GLU 212 Cb 0.08 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 1mne h GLU 212 CO -0.18 0.00 -0.33 0.37 -1.40 0.00 0.00 179.01 177.47 1mne h GLN 213 N 0.00 -0.57 -0.59 2.33 5.75 -0.59 0.10 115.11 121.55 1mne h GLN 213 Ca 0.49 0.04 0.12 0.00 -0.15 0.00 0.00 58.65 59.14 1mne h GLN 213 Cb 0.82 0.13 -0.09 0.00 1.07 0.00 0.00 27.48 29.40 1mne h GLN 213 CO -0.97 -0.38 0.06 1.96 -2.65 0.00 0.00 178.83 176.85 1mne h GLN 214 N -0.59 0.18 -0.56 1.69 4.20 0.39 0.25 115.11 120.66 1mne h GLN 214 Ca -0.03 -0.01 0.10 0.00 0.06 0.00 0.00 58.65 58.77 1mne h GLN 214 Cb 0.54 -0.04 -0.08 0.00 0.30 0.00 0.00 27.48 28.20 1mne h GLN 214 CO -0.10 0.12 0.12 0.82 -0.67 0.00 0.00 178.83 179.12 1mne h ILE 215 N 0.18 0.68 -0.16 2.54 2.04 0.17 -0.16 117.51 122.80 1mne h ILE 215 Ca 0.31 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 66.07 1mne h ILE 215 Cb 0.47 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1mne h ILE 215 CO -0.45 0.05 0.07 -0.07 0.00 0.00 0.00 178.15 177.75 1mne h LEU 216 N 0.26 0.22 -2.48 1.44 3.38 0.20 -2.71 115.31 115.61 1mne h LEU 216 Ca 0.29 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1mne h LEU 216 Cb 0.41 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1mne h LEU 216 CO -0.37 0.30 0.10 1.56 0.09 0.00 0.00 178.44 180.12 1mne h GLN 217 N 0.12 0.00 -0.60 1.13 1.08 0.06 -3.11 115.11 113.79 1mne h GLN 217 Ca 0.05 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.34 1mne h GLN 217 Cb 0.14 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 27.51 1mne h GLN 217 CO -0.01 0.00 0.25 0.00 -0.95 0.00 0.00 178.83 178.12 1mne h ALA 218 N 1.79 0.78 0.64 3.87 0.00 -0.73 -3.27 119.26 122.35 1mne h ALA 218 Ca 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1mne h ALA 218 Cb 0.20 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1mne h ALA 218 CO 0.00 -0.15 -0.48 -0.91 0.00 0.00 0.00 179.25 177.71 1mne h ASN 219 N 0.45 -1.27 -0.83 0.00 2.35 -1.75 -2.16 115.58 112.38 1mne h ASN 219 Ca 0.29 0.09 0.14 0.00 -0.55 0.00 0.00 56.30 56.27 1mne h ASN 219 Cb 0.32 0.39 -0.14 0.00 0.05 0.00 0.00 38.32 38.94 1mne h ASN 219 CO -0.27 -0.70 -0.28 -2.65 -1.65 0.00 0.00 177.43 171.89 1mne n PRO 220 N -5.59 -0.14 0.24 0.81 -0.02 -1.25 0.14 135.00 129.19 1mne n PRO 220 Ca -0.13 1.29 -0.17 0.00 -2.02 0.00 0.00 63.50 62.46 1mne n PRO 220 Cb 0.47 -1.92 -0.09 0.00 -0.02 0.00 0.00 33.50 31.94 1mne n PRO 220 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1mne h ILE 221 N 0.00 0.05 -0.64 4.25 2.04 -1.55 -0.18 117.51 121.48 1mne h ILE 221 Ca 0.34 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.33 1mne h ILE 221 Cb 0.54 0.05 -0.10 0.00 -0.74 0.00 0.00 36.82 36.58 1mne h ILE 221 CO -0.84 0.00 0.09 -0.07 0.00 0.00 0.00 178.15 177.33 1mne h LEU 222 N -0.91 -0.11 -1.30 1.44 3.38 -0.50 -2.17 115.31 115.13 1mne h LEU 222 Ca -0.04 0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1mne h LEU 222 Cb 0.82 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1mne h LEU 222 CO -0.11 -0.05 -0.32 -0.33 0.09 0.00 0.00 178.44 177.71 1mne h GLU 223 N 0.20 0.05 -0.81 1.13 5.08 0.26 0.64 114.58 121.14 1mne h GLU 223 Ca 0.34 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.67 1mne h GLU 223 Cb 0.55 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.76 1mne h GLU 223 CO -0.48 0.37 0.43 0.00 -1.00 0.00 0.00 179.01 178.32 1mne h ALA 224 N 1.63 1.23 0.00 3.43 0.00 -0.43 0.99 119.26 126.11 1mne h ALA 224 Ca 0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1mne h ALA 224 Cb 0.59 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1mne h ALA 224 CO 0.04 0.61 -1.70 1.19 0.00 0.00 0.00 179.25 179.40 1mne n PHE 225 N -4.34 0.44 0.20 0.00 3.01 -0.66 -1.35 117.46 114.75 1mne n PHE 225 Ca 0.08 0.13 0.02 0.00 1.01 0.00 0.00 57.45 58.70 1mne n PHE 225 Cb 0.11 -0.80 0.02 0.00 -0.01 0.00 0.00 39.48 38.80 1mne n PHE 225 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1mne n GLY 226 N 1.34 -1.01 3.58 1.37 0.00 0.22 -4.87 105.19 105.82 1mne n GLY 226 Ca -0.08 -0.14 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 1mne n GLY 226 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mne s ASN 227 N -0.39 4.25 0.19 1.61 -0.87 0.34 0.80 114.94 120.87 1mne s ASN 227 Ca 0.05 -0.67 -0.15 0.00 -1.57 0.00 0.00 52.86 50.52 1mne s ASN 227 Cb 0.04 -0.70 0.02 0.00 -0.02 0.00 0.00 41.25 40.59 1mne s ASN 227 CO 0.06 0.06 0.47 0.00 -2.57 0.00 0.00 177.10 175.12 1mne s ALA 228 N -2.03 -0.69 -0.37 0.60 0.00 0.15 -2.63 121.76 116.79 1mne s ALA 228 Ca 0.28 -0.42 -0.21 0.00 0.00 0.00 0.00 51.96 51.61 1mne s ALA 228 Cb -0.07 0.87 0.01 0.00 0.00 0.00 0.00 23.12 23.92 1mne s ALA 228 CO 0.17 -0.78 0.64 0.21 0.00 0.00 0.00 175.76 176.00 1mne s LYS 229 N -3.91 3.63 0.19 0.00 2.20 -1.26 -0.27 119.74 120.33 1mne s LYS 229 Ca 0.12 0.01 0.01 0.00 -0.36 0.00 0.00 55.97 55.75 1mne s LYS 229 Cb -0.00 -3.83 0.01 0.00 -1.51 0.00 0.00 37.83 32.50 1mne s LYS 229 CO -0.01 -0.78 0.12 0.25 -0.36 0.00 0.00 175.35 174.57 1mne n THR 230 N 5.63 0.00 0.19 3.43 -2.24 -0.09 0.49 114.28 121.70 1mne n THR 230 Ca -0.01 -0.80 0.08 0.00 -2.27 0.00 0.00 64.05 61.05 1mne n THR 230 Cb 0.48 -0.25 0.22 0.00 -2.10 0.00 0.00 70.33 68.68 1mne n THR 230 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1mne h THR 231 N 0.64 0.49 0.00 4.28 1.35 -1.91 -3.27 112.91 114.48 1mne h THR 231 Ca -0.13 -1.49 -0.07 0.00 -0.55 0.00 0.00 66.41 64.17 1mne h THR 231 Cb 0.46 2.08 -0.01 0.00 -1.73 0.00 0.00 68.15 68.94 1mne h THR 231 CO 0.21 0.25 -1.78 0.54 -0.25 0.00 0.00 175.52 174.49 1mne n ARG 232 N -3.22 0.65 -3.57 4.72 1.74 -1.26 -4.98 116.66 110.73 1mne n ARG 232 Ca 0.02 -0.06 -0.14 0.00 -0.77 0.00 0.00 57.85 56.90 1mne n ARG 232 Cb 0.57 -1.62 -0.06 0.00 -1.02 0.00 0.00 32.46 30.34 1mne n ARG 232 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1mne s ASN 233 N -4.97 -0.54 0.06 0.55 3.84 -1.23 -4.46 114.94 108.19 1mne s ASN 233 Ca -0.06 0.72 0.28 0.00 0.21 0.00 0.00 52.86 54.01 1mne s ASN 233 Cb 0.11 0.62 1.07 0.00 -0.55 0.00 0.00 41.25 42.50 1mne s ASN 233 CO 0.86 -0.41 1.85 0.59 -2.79 0.00 0.00 177.10 177.21 1mne n ASN 234 N 1.25 0.28 -3.04 -4.21 5.03 -1.26 -0.91 115.26 112.39 1mne n ASN 234 Ca -0.14 0.49 -0.15 0.00 0.87 0.00 0.00 54.58 55.64 1mne n ASN 234 Cb 0.57 -0.54 0.01 0.00 -1.02 0.00 0.00 39.78 38.79 1mne n ASN 234 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1mne n ASN 235 N -1.74 -0.03 -4.77 6.41 5.15 -1.24 -4.04 115.26 115.01 1mne n ASN 235 Ca 0.06 -3.18 -0.39 0.00 -0.60 0.00 0.00 54.58 50.47 1mne n ASN 235 Cb 0.37 0.08 -0.06 0.00 -0.53 0.00 0.00 39.78 39.64 1mne n ASN 235 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1mne s SER 236 N -2.13 7.35 -0.40 1.20 0.15 0.62 -4.74 113.70 115.75 1mne s SER 236 Ca 0.35 1.59 -0.29 0.00 0.70 0.00 0.00 55.95 58.30 1mne s SER 236 Cb 0.34 -2.49 0.01 0.00 -1.71 0.00 0.00 66.02 62.17 1mne s SER 236 CO -0.07 0.17 1.43 -0.44 1.20 0.00 0.00 173.24 175.53 1mne s SER 237 N -0.91 6.33 -0.06 5.45 0.01 -1.26 -0.68 113.70 122.57 1mne s SER 237 Ca 0.36 0.88 0.02 0.00 1.31 0.00 0.00 55.95 58.53 1mne s SER 237 Cb -0.22 -2.54 0.16 0.00 0.21 0.00 0.00 66.02 63.63 1mne s SER 237 CO 0.25 -1.43 0.89 0.54 0.41 0.00 0.00 173.24 173.90 1mne n ARG 238 N 8.05 1.65 -3.73 12.44 5.12 0.24 -4.81 116.66 135.61 1mne n ARG 238 Ca 0.17 -0.64 -0.10 0.00 -1.93 0.00 0.00 57.85 55.34 1mne n ARG 238 Cb 0.48 -1.54 -0.06 0.00 -1.16 0.00 0.00 32.46 30.18 1mne n ARG 238 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 1mne s PHE 239 N -1.16 -0.08 0.34 -1.55 -0.12 -1.26 -0.92 117.98 113.23 1mne s PHE 239 Ca 0.11 -0.22 0.01 0.00 -0.05 0.00 0.00 56.93 56.78 1mne s PHE 239 Cb 0.09 0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.57 1mne s PHE 239 CO 0.03 -0.60 0.53 0.20 -0.05 0.00 0.00 175.22 175.33 1mne s GLY 240 N -2.62 1.33 0.04 1.99 0.00 0.55 -4.90 107.32 103.72 1mne s GLY 240 Ca 0.01 -0.93 -0.27 0.00 0.00 0.00 0.00 44.72 43.53 1mne s GLY 240 CO -0.09 -0.88 0.67 -1.59 0.00 0.00 0.00 173.10 171.21 1mne s LYS 241 N -4.28 1.13 -0.11 2.90 -2.85 -0.64 -0.78 119.74 115.11 1mne s LYS 241 Ca 0.39 -0.09 -0.01 0.00 -1.00 0.00 0.00 55.97 55.26 1mne s LYS 241 Cb -0.10 0.52 0.03 0.00 -2.06 0.00 0.00 37.83 36.23 1mne s LYS 241 CO 0.35 -0.43 -0.02 0.12 0.10 0.00 0.00 175.35 175.48 1mne s PHE 242 N -2.39 1.02 -0.12 1.78 2.19 0.80 -0.76 117.98 120.51 1mne s PHE 242 Ca -0.05 -0.50 -0.05 0.00 0.33 0.00 0.00 56.93 56.66 1mne s PHE 242 Cb -0.00 -0.99 -0.04 0.00 -1.31 0.00 0.00 43.02 40.68 1mne s PHE 242 CO -0.01 -0.44 0.08 0.42 1.83 0.00 0.00 175.22 177.10 1mne s ILE 243 N 1.86 5.03 -0.22 3.12 -1.09 0.86 -2.21 121.20 128.55 1mne s ILE 243 Ca 0.04 0.03 -0.02 0.00 -2.23 0.00 0.00 60.65 58.47 1mne s ILE 243 Cb -0.13 -3.18 0.01 0.00 -1.58 0.00 0.00 42.46 37.58 1mne s ILE 243 CO -0.07 0.60 -0.10 -0.70 -1.23 0.00 0.00 174.94 173.44 1mne s GLU 244 N -0.82 3.11 -0.31 2.79 2.12 -0.18 0.18 118.70 125.58 1mne s GLU 244 Ca 0.13 -0.79 -0.15 0.00 0.36 0.00 0.00 54.97 54.53 1mne s GLU 244 Cb -0.12 -2.87 -0.02 0.00 0.26 0.00 0.00 34.13 31.38 1mne s GLU 244 CO 0.03 -0.26 0.35 0.42 -0.54 0.00 0.00 175.26 175.26 1mne s ILE 245 N 1.38 5.18 0.00 -3.70 -1.09 0.29 -2.07 121.20 121.19 1mne s ILE 245 Ca 0.04 0.23 -0.22 0.00 -2.23 0.00 0.00 60.65 58.47 1mne s ILE 245 Cb -0.15 -3.76 -0.05 0.00 -1.58 0.00 0.00 42.46 36.93 1mne s ILE 245 CO -0.07 0.02 0.64 -1.10 -1.23 0.00 0.00 174.94 173.20 1mne s GLN 246 N 2.02 4.37 0.33 2.79 -0.21 -0.29 -0.17 119.66 128.50 1mne s GLN 246 Ca 0.12 0.81 0.06 0.00 0.02 0.00 0.00 55.36 56.38 1mne s GLN 246 Cb -0.16 -3.35 -0.07 0.00 1.00 0.00 0.00 33.01 30.43 1mne s GLN 246 CO 0.11 0.33 -0.00 -0.06 -2.12 0.00 0.00 175.29 173.55 1mne s PHE 247 N -0.10 2.12 0.19 0.91 0.40 0.32 0.03 117.98 121.85 1mne s PHE 247 Ca 0.33 -0.77 0.04 0.00 -0.60 0.00 0.00 56.93 55.92 1mne s PHE 247 Cb -0.19 -1.35 -0.03 0.00 0.51 0.00 0.00 43.02 41.96 1mne s PHE 247 CO 0.18 0.24 0.31 0.54 0.70 0.00 0.00 175.22 177.20 1mne s ASN 248 N -3.53 6.30 0.16 1.36 2.20 0.12 -2.20 114.94 119.34 1mne s ASN 248 Ca 0.34 0.11 0.04 0.00 -0.94 0.00 0.00 52.86 52.40 1mne s ASN 248 Cb 0.07 -1.87 0.45 0.00 -2.00 0.00 0.00 41.25 37.91 1mne s ASN 248 CO 0.15 -0.01 0.74 -0.46 -2.94 0.00 0.00 177.10 174.59 1mne n ASN 249 N -0.95 0.02 -0.23 3.54 0.23 -1.26 0.21 115.26 116.81 1mne n ASN 249 Ca -0.08 0.80 -0.05 0.00 -0.53 0.00 0.00 54.58 54.72 1mne n ASN 249 Cb 0.55 -0.32 0.12 0.00 -2.08 0.00 0.00 39.78 38.05 1mne n ASN 249 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1mne h ALA 250 N 0.95 1.12 0.00 -2.53 0.00 -2.03 -3.46 119.26 113.30 1mne h ALA 250 Ca 0.32 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1mne h ALA 250 Cb 0.75 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1mne h ALA 250 CO -0.42 0.62 0.00 0.41 0.00 0.00 0.00 179.25 179.86 1mne n GLY 251 N -0.88 1.55 3.90 0.00 0.00 0.56 -5.10 105.19 105.22 1mne n GLY 251 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 1mne n GLY 251 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mne s PHE 252 N -1.94 3.48 0.25 1.61 0.40 -1.22 -4.76 117.98 115.78 1mne s PHE 252 Ca 0.00 0.52 -0.31 0.00 -0.60 0.00 0.00 56.93 56.54 1mne s PHE 252 Cb 0.00 -1.98 -0.11 0.00 0.51 0.00 0.00 43.02 41.44 1mne s PHE 252 CO 0.00 0.41 1.57 0.42 0.70 0.00 0.00 175.22 178.32 1mne s ILE 253 N -1.72 2.29 0.00 0.64 1.01 -0.94 0.15 121.20 122.63 1mne s ILE 253 Ca 0.41 0.23 0.00 0.00 0.00 0.00 0.00 60.65 61.29 1mne s ILE 253 Cb -0.12 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.20 1mne s ILE 253 CO 0.26 0.03 0.00 -1.54 0.00 0.00 0.00 174.94 173.69 1mne n SER 254 N 2.81 3.17 0.00 3.58 3.41 0.10 -4.79 113.62 121.92 1mne n SER 254 Ca 0.10 -0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1mne n SER 254 Cb 0.38 0.90 0.00 0.00 -0.26 0.00 0.00 64.21 65.23 1mne n SER 254 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mne n GLY 255 N 1.85 -0.90 3.62 5.00 0.00 -0.91 -4.79 105.19 109.06 1mne n GLY 255 Ca 0.00 -0.77 -0.02 0.00 0.00 0.00 0.00 46.02 45.23 1mne n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mne s ALA 256 N -1.00 -2.07 0.08 4.61 0.00 -1.09 -1.13 121.76 121.16 1mne s ALA 256 Ca 0.00 0.92 -0.06 0.00 0.00 0.00 0.00 51.96 52.82 1mne s ALA 256 Cb 0.00 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.36 1mne s ALA 256 CO 0.00 -0.88 0.12 -1.54 0.00 0.00 0.00 175.76 173.46 1mne s SER 257 N -2.68 0.24 0.01 0.00 1.04 -0.88 -1.44 113.70 109.98 1mne s SER 257 Ca 0.12 -0.80 0.06 0.00 0.48 0.00 0.00 55.95 55.80 1mne s SER 257 Cb 0.02 0.30 -0.02 0.00 0.10 0.00 0.00 66.02 66.42 1mne s SER 257 CO -0.04 -0.70 -0.17 -0.63 0.98 0.00 0.00 173.24 172.68 1mne s ILE 258 N -3.89 1.36 -0.05 -1.02 1.01 -1.26 -1.01 121.20 116.33 1mne s ILE 258 Ca 0.07 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.87 1mne s ILE 258 Cb 0.06 -1.16 0.02 0.00 0.01 0.00 0.00 42.46 41.40 1mne s ILE 258 CO -0.09 0.29 -0.03 -1.58 0.00 0.00 0.00 174.94 173.52 1mne s GLN 259 N -0.66 0.76 0.05 2.79 2.00 -0.94 -4.96 119.66 118.70 1mne s GLN 259 Ca 0.06 -0.06 0.04 0.00 -2.00 0.00 0.00 55.36 53.41 1mne s GLN 259 Cb -0.07 -0.85 -0.04 0.00 0.80 0.00 0.00 33.01 32.85 1mne s GLN 259 CO 0.00 -0.13 -0.05 -1.54 -0.50 0.00 0.00 175.29 173.07 1mne s SER 260 N 1.13 4.70 -0.02 6.67 1.04 -1.26 -0.14 113.70 125.82 1mne s SER 260 Ca -0.08 -0.20 0.02 0.00 0.48 0.00 0.00 55.95 56.16 1mne s SER 260 Cb -0.14 -1.06 0.01 0.00 0.10 0.00 0.00 66.02 64.92 1mne s SER 260 CO -0.01 0.23 -0.05 -0.31 0.98 0.00 0.00 173.24 174.08 1mne s TYR 261 N -1.14 0.57 -1.04 5.02 2.02 0.04 -4.94 117.35 117.89 1mne s TYR 261 Ca 0.20 -0.12 -0.12 0.00 -0.37 0.00 0.00 57.07 56.66 1mne s TYR 261 Cb -0.11 -0.43 -0.02 0.00 -0.40 0.00 0.00 41.96 40.99 1mne s TYR 261 CO 0.12 -0.06 0.81 1.28 -1.57 0.00 0.00 175.55 176.12 1mne n LEU 262 N 3.32 -4.13 -4.77 -1.29 4.77 -1.26 -0.33 117.00 113.31 1mne n LEU 262 Ca -0.17 -0.80 -0.39 0.00 -0.03 0.00 0.00 56.01 54.62 1mne n LEU 262 Cb 0.55 -2.70 -0.02 0.00 -2.33 0.00 0.00 43.42 38.92 1mne n LEU 262 CO 0.25 0.14 0.91 -0.22 -1.33 0.00 0.00 177.39 177.13 1mne s LEU 263 N -5.72 4.28 -1.31 2.23 2.96 -1.26 -4.45 118.68 115.40 1mne s LEU 263 Ca 0.38 2.52 -0.16 0.00 -0.22 0.00 0.00 54.13 56.65 1mne s LEU 263 Cb -0.10 -3.87 0.09 0.00 0.50 0.00 0.00 46.19 42.80 1mne s LEU 263 CO 0.81 -0.67 1.78 1.21 -1.32 0.00 0.00 176.35 178.17 1mne n GLU 264 N 0.32 3.20 0.28 1.98 2.13 -0.10 -4.77 120.64 123.69 1mne n GLU 264 Ca 0.03 -3.29 0.14 0.00 0.66 0.00 0.00 57.16 54.70 1mne n GLU 264 Cb 0.44 -3.32 0.82 0.00 0.27 0.00 0.00 31.44 29.66 1mne n GLU 264 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1mne h LYS 265 N 7.04 0.00 -0.35 5.31 1.57 -1.90 -2.35 116.57 125.88 1mne h LYS 265 Ca 0.44 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.18 1mne h LYS 265 Cb 0.81 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.10 1mne h LYS 265 CO 1.51 0.07 0.06 0.66 -0.57 0.00 0.00 179.45 181.18 1mne h SER 266 N 0.00 0.48 -0.24 0.86 4.64 -1.93 -2.13 113.55 115.22 1mne h SER 266 Ca -0.00 -0.07 0.07 0.00 -0.47 0.00 0.00 61.79 61.32 1mne h SER 266 Cb 0.20 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1mne h SER 266 CO 0.01 0.51 0.20 -0.09 -0.87 0.00 0.00 176.83 176.58 1mne h ARG 267 N 0.51 0.00 -0.83 4.77 2.43 -1.55 -0.31 114.38 119.40 1mne h ARG 267 Ca 0.12 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.36 1mne h ARG 267 Cb 0.24 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.73 1mne h ARG 267 CO 0.00 0.00 0.54 0.28 -1.51 0.00 0.00 179.97 179.28 1mne h VAL 268 N 0.00 1.02 -0.02 0.20 2.07 -1.55 -3.04 116.25 114.93 1mne h VAL 268 Ca 0.12 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1mne h VAL 268 Cb 0.51 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1mne h VAL 268 CO -0.00 0.16 0.00 1.33 0.02 0.00 0.00 177.57 179.08 1mne n VAL 269 N -4.49 0.02 -3.64 2.57 0.24 -0.21 -4.90 118.33 107.92 1mne n VAL 269 Ca 0.13 -0.51 -0.05 0.00 -2.04 0.00 0.00 64.34 61.87 1mne n VAL 269 Cb 0.24 1.26 -0.06 0.00 -1.47 0.00 0.00 33.84 33.81 1mne n VAL 269 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1mne s PHE 270 N -1.10 -1.09 -0.04 6.34 2.19 -0.70 -4.96 117.98 118.62 1mne s PHE 270 Ca 0.16 2.08 0.05 0.00 0.33 0.00 0.00 56.93 59.54 1mne s PHE 270 Cb 0.11 0.65 -0.01 0.00 -1.31 0.00 0.00 43.02 42.47 1mne s PHE 270 CO 0.17 -0.54 -0.17 -0.65 1.83 0.00 0.00 175.22 175.85 1mne s GLN 271 N 1.98 1.72 1.04 10.12 1.11 -1.26 -4.00 119.66 130.37 1mne s GLN 271 Ca -0.09 -0.62 -0.11 0.00 0.01 0.00 0.00 55.36 54.55 1mne s GLN 271 Cb -0.07 -1.53 0.22 0.00 -1.01 0.00 0.00 33.01 30.62 1mne s GLN 271 CO -0.19 0.28 1.08 -1.12 0.01 0.00 0.00 175.29 175.35 1mne s SER 272 N -0.07 1.93 0.33 5.90 0.01 -1.26 -4.46 113.70 116.07 1mne s SER 272 Ca -0.01 1.83 -0.29 0.00 1.31 0.00 0.00 55.95 58.79 1mne s SER 272 Cb -0.10 -2.43 -0.10 0.00 0.21 0.00 0.00 66.02 63.59 1mne s SER 272 CO 0.02 -3.66 1.38 -1.83 0.41 0.00 0.00 173.24 169.55 1mne s GLU 273 N -4.56 4.28 0.00 12.44 1.03 -1.26 -2.44 118.70 128.19 1mne s GLU 273 Ca 0.67 2.32 0.00 0.00 0.03 0.00 0.00 54.97 58.00 1mne s GLU 273 Cb -0.24 -3.05 0.00 0.00 -0.80 0.00 0.00 34.13 30.04 1mne s GLU 273 CO 0.61 -0.32 0.00 -2.37 -1.33 0.00 0.00 175.26 171.85 1mne n THR 274 N 1.04 0.00 -2.78 1.83 5.66 -0.73 -4.93 114.28 114.36 1mne n THR 274 Ca 0.02 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.80 1mne n THR 274 Cb 0.41 -0.00 0.08 0.00 -1.55 0.00 0.00 70.33 69.27 1mne n THR 274 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1mne s GLU 275 N -0.00 2.02 0.15 1.09 2.02 -1.02 -4.76 118.70 118.19 1mne s GLU 275 Ca 0.00 -1.30 0.05 0.00 0.02 0.00 0.00 54.97 53.74 1mne s GLU 275 Cb 0.00 -2.48 -0.04 0.00 0.10 0.00 0.00 34.13 31.70 1mne s GLU 275 CO 0.00 -1.12 -0.11 1.03 0.02 0.00 0.00 175.26 175.08 1mne s ARG 276 N -4.90 1.07 0.28 1.61 0.52 0.18 -4.35 118.95 113.37 1mne s ARG 276 Ca 0.64 -1.42 -0.05 0.00 -0.52 0.00 0.00 55.73 54.38 1mne s ARG 276 Cb -0.06 -0.72 0.07 0.00 0.52 0.00 0.00 34.95 34.76 1mne s ARG 276 CO 0.41 0.10 0.26 -1.71 0.02 0.00 0.00 175.30 174.39 1mne n ASN 277 N -0.06 -1.14 -4.76 0.23 2.85 -1.26 -4.09 115.26 107.03 1mne n ASN 277 Ca -0.11 -0.69 -0.39 0.00 -0.11 0.00 0.00 54.58 53.27 1mne n ASN 277 Cb 0.60 -0.23 0.03 0.00 1.24 0.00 0.00 39.78 41.41 1mne n ASN 277 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 1mne s TYR 278 N -1.48 2.38 0.21 1.20 2.02 -1.26 -4.31 117.35 116.11 1mne s TYR 278 Ca 0.17 1.30 -0.12 0.00 -0.37 0.00 0.00 57.07 58.05 1mne s TYR 278 Cb -0.01 -3.88 0.28 0.00 -0.40 0.00 0.00 41.96 37.94 1mne s TYR 278 CO 0.13 -2.94 1.64 0.45 -1.57 0.00 0.00 175.55 173.25 1mne h HIS 279 N 1.97 -0.21 -0.90 2.71 3.86 -1.53 -3.08 115.15 117.98 1mne h HIS 279 Ca -0.51 0.05 0.11 0.00 -1.16 0.00 0.00 60.37 58.87 1mne h HIS 279 Cb 1.28 0.19 -0.13 0.00 1.06 0.00 0.00 27.41 29.81 1mne h HIS 279 CO 0.48 -0.23 -0.42 0.44 0.86 0.00 0.00 177.93 179.05 1mne n ILE 280 N -5.37 -0.53 -0.29 2.45 -6.64 -0.46 0.15 119.36 108.67 1mne n ILE 280 Ca 0.09 2.13 0.05 0.00 -1.77 0.00 0.00 62.75 63.24 1mne n ILE 280 Cb 0.35 -2.74 0.14 0.00 -1.44 0.00 0.00 39.64 35.95 1mne n ILE 280 CO 0.00 0.00 0.00 -0.26 -1.77 0.00 0.00 176.55 174.52 1mne h PHE 281 N 0.00 -0.33 -0.44 4.28 0.04 -1.85 0.54 116.94 119.18 1mne h PHE 281 Ca 0.24 0.07 -0.13 0.00 2.80 0.00 0.00 57.97 60.95 1mne h PHE 281 Cb 0.47 0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.88 1mne h PHE 281 CO -0.84 -0.35 -0.24 1.88 -0.60 0.00 0.00 178.31 178.16 1mne h TYR 282 N 0.02 1.06 -0.03 -0.55 0.05 -0.44 -2.06 116.97 115.01 1mne h TYR 282 Ca 0.43 -0.26 -0.07 0.00 0.05 0.00 0.00 58.73 58.88 1mne h TYR 282 Cb 0.70 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 38.19 1mne h TYR 282 CO -0.60 1.06 -0.29 1.96 -1.05 0.00 0.00 178.16 179.24 1mne h GLN 283 N 0.79 0.05 0.46 4.88 4.20 0.61 -1.42 115.11 124.68 1mne h GLN 283 Ca 0.10 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.77 1mne h GLN 283 Cb 0.80 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.58 1mne h GLN 283 CO 0.07 0.34 -0.22 1.25 -0.67 0.00 0.00 178.83 179.60 1mne h LEU 284 N 0.05 -0.52 -1.70 1.46 5.85 0.21 -0.82 115.31 119.85 1mne h LEU 284 Ca 0.01 -0.05 0.29 0.00 0.84 0.00 0.00 57.88 58.96 1mne h LEU 284 Cb 0.54 0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.64 1mne h LEU 284 CO 0.04 -0.10 0.73 -0.07 -0.34 0.00 0.00 178.44 178.70 1mne h LEU 285 N -1.09 0.21 -0.88 2.25 3.38 -1.32 -0.34 115.31 117.53 1mne h LEU 285 Ca -0.06 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1mne h LEU 285 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1mne h LEU 285 CO 0.10 0.04 -0.35 0.00 0.09 0.00 0.00 178.44 178.32 1mne n ALA 286 N -2.62 3.29 -1.00 1.53 0.00 -0.54 -4.40 120.51 116.77 1mne n ALA 286 Ca 0.24 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1mne n ALA 286 Cb 1.01 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 19.53 1mne n ALA 286 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mne n GLY 287 N 1.38 -0.00 3.77 0.00 0.00 -0.33 -4.08 105.19 105.93 1mne n GLY 287 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1mne n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mne s ALA 288 N -0.00 3.18 1.01 4.61 0.00 -0.22 -4.98 121.76 125.35 1mne s ALA 288 Ca 0.00 1.05 -0.12 0.00 0.00 0.00 0.00 51.96 52.89 1mne s ALA 288 Cb 0.00 -3.41 0.19 0.00 0.00 0.00 0.00 23.12 19.90 1mne s ALA 288 CO 0.00 -0.62 1.08 0.95 0.00 0.00 0.00 175.76 177.17 1mne s THR 289 N -1.36 2.23 0.43 0.00 -4.23 -1.26 -4.76 115.64 106.69 1mne s THR 289 Ca 0.57 0.07 0.16 0.00 -1.18 0.00 0.00 61.69 61.31 1mne s THR 289 Cb -0.33 -2.24 0.18 0.00 1.34 0.00 0.00 72.50 71.45 1mne s THR 289 CO 0.42 -0.10 1.97 0.00 -0.54 0.00 0.00 174.62 176.37 1mne h ALA 290 N -2.08 1.58 0.00 3.99 0.00 -2.00 -0.45 119.26 120.30 1mne h ALA 290 Ca -0.52 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.09 1mne h ALA 290 Cb 1.30 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1mne h ALA 290 CO 0.49 0.26 -0.52 0.93 0.00 0.00 0.00 179.25 180.41 1mne h GLU 291 N 0.00 0.00 0.06 0.00 3.07 -2.00 -2.66 114.58 113.05 1mne h GLU 291 Ca -0.00 0.00 -0.27 0.00 -0.50 0.00 0.00 59.36 58.59 1mne h GLU 291 Cb 0.39 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.32 1mne h GLU 291 CO 0.03 0.52 -1.11 0.93 -1.40 0.00 0.00 179.01 177.98 1mne h GLU 292 N 0.00 0.55 0.22 2.33 5.08 -1.62 -2.62 114.58 118.52 1mne h GLU 292 Ca -0.01 -0.66 -0.01 0.00 -1.00 0.00 0.00 59.36 57.68 1mne h GLU 292 Cb 0.94 0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1mne h GLU 292 CO 0.07 1.27 -0.11 0.87 -1.00 0.00 0.00 179.01 180.11 1mne h LYS 293 N 0.27 -0.29 -0.60 2.33 1.57 -1.01 0.26 116.57 119.10 1mne h LYS 293 Ca -0.14 0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.60 1mne h LYS 293 Cb 1.77 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 34.12 1mne h LYS 293 CO 0.20 -0.08 0.11 1.57 -0.57 0.00 0.00 179.45 180.68 1mne h LYS 294 N -0.45 0.96 0.00 3.15 2.10 -1.60 0.98 116.57 121.71 1mne h LYS 294 Ca -0.03 -0.23 -0.02 0.00 -2.00 0.00 0.00 60.65 58.38 1mne h LYS 294 Cb 0.34 -0.13 -0.00 0.00 -0.90 0.00 0.00 32.23 31.54 1mne h LYS 294 CO 0.05 0.88 -0.08 0.00 -2.00 0.00 0.00 179.45 178.30 1mne h ALA 295 N 1.21 1.31 -0.14 0.07 0.00 -1.15 -2.52 119.26 118.05 1mne h ALA 295 Ca 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1mne h ALA 295 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1mne h ALA 295 CO 0.01 0.10 0.00 1.28 0.00 0.00 0.00 179.25 180.63 1mne n LEU 296 N -3.63 2.38 -2.51 0.00 4.77 0.88 -4.94 117.00 113.95 1mne n LEU 296 Ca -0.02 -2.04 -0.20 0.00 -0.03 0.00 0.00 56.01 53.73 1mne n LEU 296 Cb 0.19 -0.10 0.02 0.00 -2.33 0.00 0.00 43.42 41.19 1mne n LEU 296 CO 0.28 0.59 -0.09 1.41 -1.33 0.00 0.00 177.39 178.26 1mne n HIS 297 N -0.13 -1.44 -2.58 -1.77 8.25 0.31 -4.89 115.22 112.96 1mne n HIS 297 Ca 0.05 0.29 -0.35 0.00 -0.26 0.00 0.00 57.72 57.46 1mne n HIS 297 Cb 0.33 -3.99 -0.04 0.00 1.12 0.00 0.00 29.99 27.41 1mne n HIS 297 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1mne s LEU 298 N -5.82 3.96 0.00 2.41 1.43 0.23 -5.04 118.68 115.87 1mne s LEU 298 Ca 0.17 1.93 0.00 0.00 -1.03 0.00 0.00 54.13 55.20 1mne s LEU 298 Cb -0.07 -4.42 0.00 0.00 0.03 0.00 0.00 46.19 41.72 1mne s LEU 298 CO 0.21 -0.62 0.00 0.00 0.23 0.00 0.00 176.35 176.17 1mne n ALA 299 N -0.60 0.00 -1.78 4.21 0.00 -1.26 -4.84 120.51 116.24 1mne n ALA 299 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.14 1mne n ALA 299 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.91 1mne n ALA 299 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1mne s GLY 300 N -0.79 2.82 0.35 0.00 0.00 -1.26 -4.82 107.32 103.61 1mne s GLY 300 Ca 0.00 0.63 0.15 0.00 0.00 0.00 0.00 44.72 45.50 1mne s GLY 300 CO 0.00 1.09 1.62 -0.56 0.00 0.00 0.00 173.10 175.25 1mne h PRO 301 N 3.05 0.15 0.00 2.90 0.13 -1.96 1.20 132.00 137.47 1mne h PRO 301 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1mne h PRO 301 Cb 1.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1mne h PRO 301 CO 0.64 0.10 0.00 1.05 -0.23 0.00 0.00 178.00 179.57 1mne h GLU 302 N 0.16 0.00 -0.59 0.86 9.09 -1.93 0.44 114.58 122.61 1mne h GLU 302 Ca 0.75 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.16 1mne h GLU 302 Cb 1.82 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.92 1mne h GLU 302 CO -0.70 0.00 0.00 -1.13 0.05 0.00 0.00 179.01 177.23 1mne n SER 303 N -2.62 3.35 -3.74 3.06 3.41 0.41 -4.83 113.62 112.65 1mne n SER 303 Ca -0.02 -2.27 -0.25 0.00 -0.26 0.00 0.00 58.87 56.07 1mne n SER 303 Cb 0.05 -0.46 -0.17 0.00 -0.26 0.00 0.00 64.21 63.37 1mne n SER 303 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1mne s PHE 304 N -1.69 0.82 0.45 7.33 0.40 0.15 -4.98 117.98 120.45 1mne s PHE 304 Ca 0.35 -0.52 0.28 0.00 -0.60 0.00 0.00 56.93 56.45 1mne s PHE 304 Cb 0.22 -0.91 1.35 0.00 0.51 0.00 0.00 43.02 44.20 1mne s PHE 304 CO 0.18 -0.48 1.70 -0.91 0.70 0.00 0.00 175.22 176.41 1mne h ASN 305 N 8.29 0.26 0.00 1.36 2.35 -1.85 0.30 115.58 126.29 1mne h ASN 305 Ca -0.18 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1mne h ASN 305 Cb 1.12 0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.55 1mne h ASN 305 CO 0.30 -0.04 0.00 -1.22 -1.65 0.00 0.00 177.43 174.82 1mne n TYR 306 N -4.53 0.00 0.00 1.19 0.53 -1.26 -4.02 117.16 109.07 1mne n TYR 306 Ca 0.31 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 57.19 1mne n TYR 306 Cb 1.24 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 39.55 1mne n TYR 306 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 1mne n LEU 307 N -0.83 0.28 -0.82 7.72 4.77 0.10 -4.81 117.00 123.42 1mne n LEU 307 Ca 0.16 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.23 1mne n LEU 307 Cb 0.07 0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.43 1mne n LEU 307 CO 0.12 0.05 0.72 -0.46 -1.33 0.00 0.00 177.39 176.48 1mne n ASN 308 N -1.76 2.43 -0.01 -1.43 0.23 -1.04 -4.52 115.26 109.16 1mne n ASN 308 Ca 0.00 -1.89 -0.21 0.00 -0.53 0.00 0.00 54.58 51.95 1mne n ASN 308 Cb 0.40 -0.22 -0.13 0.00 -2.08 0.00 0.00 39.78 37.74 1mne n ASN 308 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1mne h GLN 309 N 2.96 0.20 0.00 -3.83 1.08 -1.85 -3.36 115.11 110.31 1mne h GLN 309 Ca 0.00 -0.34 -0.01 0.00 -1.45 0.00 0.00 58.65 56.86 1mne h GLN 309 Cb 0.66 0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 28.22 1mne h GLN 309 CO 0.00 1.16 -0.03 0.66 -0.95 0.00 0.00 178.83 179.67 1mne h SER 310 N -0.40 0.00 -1.57 1.46 4.64 -1.79 -3.46 113.55 112.43 1mne h SER 310 Ca -0.31 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.90 1mne h SER 310 Cb 1.68 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.79 1mne h SER 310 CO 0.02 0.03 -0.17 0.61 -0.87 0.00 0.00 176.83 176.45 1mne n GLY 311 N -0.87 0.33 3.02 -0.77 0.00 -1.26 -1.78 105.19 103.86 1mne n GLY 311 Ca -0.02 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 1mne n GLY 311 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mne n VAL 313 N 5.35 0.00 -3.86 0.00 0.24 -1.26 -4.65 118.33 114.16 1mne n VAL 313 Ca -0.06 -0.35 -0.10 0.00 -2.04 0.00 0.00 64.34 61.79 1mne n VAL 313 Cb 0.50 1.16 -0.09 0.00 -1.47 0.00 0.00 33.84 33.94 1mne n VAL 313 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1mne s ASP 314 N -0.33 0.04 -0.14 -1.34 3.84 -1.26 -5.02 116.67 112.46 1mne s ASP 314 Ca 0.00 -0.35 -0.03 0.00 -0.00 0.00 0.00 52.55 52.17 1mne s ASP 314 Cb 0.00 0.27 -0.03 0.00 -1.38 0.00 0.00 42.92 41.78 1mne s ASP 314 CO 0.00 -0.53 -0.03 -0.63 -0.00 0.00 0.00 175.17 173.98 1mne s ILE 315 N -2.39 3.99 0.18 2.11 1.01 -1.26 -5.07 121.20 119.77 1mne s ILE 315 Ca -0.06 -0.34 -0.32 0.00 0.00 0.00 0.00 60.65 59.93 1mne s ILE 315 Cb -0.02 -2.73 -0.11 0.00 0.01 0.00 0.00 42.46 39.61 1mne s ILE 315 CO -0.03 0.52 1.67 -1.59 0.00 0.00 0.00 174.94 175.51 1mne s LYS 316 N 0.03 4.16 -0.72 2.79 -2.85 -1.26 -1.97 119.74 119.92 1mne s LYS 316 Ca 0.01 2.51 -0.00 0.00 -1.00 0.00 0.00 55.97 57.49 1mne s LYS 316 Cb -0.13 -3.14 0.00 0.00 -2.06 0.00 0.00 37.83 32.50 1mne s LYS 316 CO 0.02 -0.71 0.02 0.41 0.10 0.00 0.00 175.35 175.20 1mne n GLY 317 N 3.91 0.03 2.91 0.59 0.00 -1.26 -5.01 105.19 106.36 1mne n GLY 317 Ca 0.15 -0.52 -0.14 0.00 0.00 0.00 0.00 46.02 45.52 1mne n GLY 317 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mne s VAL 318 N -2.46 -0.05 -0.48 1.61 1.01 -0.83 -5.12 120.40 114.08 1mne s VAL 318 Ca 0.01 0.17 -0.11 0.00 0.00 0.00 0.00 61.98 62.05 1mne s VAL 318 Cb -0.01 -0.21 0.12 0.00 0.00 0.00 0.00 36.38 36.28 1mne s VAL 318 CO 0.01 0.07 0.37 -0.55 0.00 0.00 0.00 175.10 175.00 1mne s SER 319 N 1.05 5.82 0.38 3.32 0.15 -1.26 -4.53 113.70 118.62 1mne s SER 319 Ca -0.08 -1.82 0.11 0.00 0.70 0.00 0.00 55.95 54.86 1mne s SER 319 Cb -0.11 -2.06 0.90 0.00 -1.71 0.00 0.00 66.02 63.04 1mne s SER 319 CO -0.05 -0.71 1.88 0.44 1.20 0.00 0.00 173.24 176.00 1mne h ASP 320 N 8.55 0.57 0.22 5.45 5.19 -1.93 0.44 116.42 134.90 1mne h ASP 320 Ca -0.23 0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.20 1mne h ASP 320 Cb 1.08 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.52 1mne h ASP 320 CO 0.89 0.28 -0.10 1.05 -3.12 0.00 0.00 179.24 178.24 1mne h GLU 321 N 0.60 -0.28 -0.73 3.56 9.09 -1.85 -1.60 114.58 123.37 1mne h GLU 321 Ca 0.44 0.02 0.01 0.00 0.05 0.00 0.00 59.36 59.87 1mne h GLU 321 Cb 0.80 0.06 -0.04 0.00 -1.65 0.00 0.00 28.75 27.93 1mne h GLU 321 CO -0.19 -0.10 0.48 -0.44 0.05 0.00 0.00 179.01 178.81 1mne h ASP 322 N -0.41 0.84 -0.89 3.06 3.32 -1.44 -2.10 116.42 118.79 1mne h ASP 322 Ca -0.03 -0.03 0.09 0.00 0.02 0.00 0.00 57.03 57.08 1mne h ASP 322 Cb 0.31 -0.21 -0.06 0.00 0.22 0.00 0.00 39.33 39.59 1mne h ASP 322 CO 0.05 0.61 0.58 -0.33 -1.72 0.00 0.00 179.24 178.43 1mne h GLU 323 N 0.99 0.89 -0.39 3.56 4.39 -0.76 -2.41 114.58 120.85 1mne h GLU 323 Ca 0.27 -0.05 0.05 0.00 0.34 0.00 0.00 59.36 59.96 1mne h GLU 323 Cb -0.11 -0.20 -0.04 0.00 -0.10 0.00 0.00 28.75 28.30 1mne h GLU 323 CO -0.06 0.59 0.14 0.35 -1.16 0.00 0.00 179.01 178.87 1mne h PHE 324 N 0.92 0.24 -0.58 4.33 3.57 -0.58 0.15 116.94 124.99 1mne h PHE 324 Ca 0.41 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.99 1mne h PHE 324 Cb 0.36 -0.05 -0.06 0.00 2.79 0.00 0.00 35.95 38.99 1mne h PHE 324 CO -0.00 0.10 0.27 0.87 -2.23 0.00 0.00 178.31 177.32 1mne h LYS 325 N 0.30 0.49 -0.12 1.11 1.57 -1.36 1.25 116.57 119.80 1mne h LYS 325 Ca 0.18 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1mne h LYS 325 Cb 0.16 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1mne h LYS 325 CO -0.18 0.33 0.06 0.82 -0.57 0.00 0.00 179.45 179.91 1mne h ILE 326 N 0.51 1.00 -0.25 1.86 2.04 -1.14 0.23 117.51 121.75 1mne h ILE 326 Ca 0.27 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 66.09 1mne h ILE 326 Cb 0.24 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1mne h ILE 326 CO -0.22 0.02 0.17 0.74 0.00 0.00 0.00 178.15 178.86 1mne h THR 327 N 0.14 1.07 -0.80 -0.27 2.02 0.12 -0.65 112.91 114.53 1mne h THR 327 Ca 0.05 -0.13 0.12 0.00 0.77 0.00 0.00 66.41 67.23 1mne h THR 327 Cb 0.01 0.70 -0.08 0.00 -1.74 0.00 0.00 68.15 67.03 1mne h THR 327 CO -0.03 0.07 0.41 0.03 0.37 0.00 0.00 175.52 176.36 1mne h ARG 328 N 0.34 0.61 -0.93 6.66 3.08 0.18 -1.29 114.38 123.02 1mne h ARG 328 Ca 0.09 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.12 1mne h ARG 328 Cb -0.04 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 29.83 1mne h ARG 328 CO -0.02 0.40 0.62 0.37 -1.07 0.00 0.00 179.97 180.27 1mne h GLN 329 N 0.63 1.21 0.00 0.04 4.15 0.59 -0.99 115.11 120.74 1mne h GLN 329 Ca 0.42 -0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.68 1mne h GLN 329 Cb 0.53 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 1mne h GLN 329 CO -0.32 0.80 -0.38 0.00 -1.93 0.00 0.00 178.83 177.00 1mne h ALA 330 N 1.43 0.82 -0.02 3.38 0.00 -0.07 -2.24 119.26 122.56 1mne h ALA 330 Ca 0.35 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1mne h ALA 330 Cb -0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1mne h ALA 330 CO -0.08 0.47 -0.47 0.52 0.00 0.00 0.00 179.25 179.69 1mne h MET 331 N 0.00 0.04 0.55 0.00 2.86 -0.33 0.25 114.93 118.30 1mne h MET 331 Ca -0.00 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 1mne h MET 331 Cb 1.14 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.81 1mne h MET 331 CO 0.05 0.51 -0.27 -0.44 1.06 0.00 0.00 176.91 177.82 1mne h ASP 332 N 0.03 -0.63 -0.44 1.22 3.45 -0.98 0.18 116.42 119.26 1mne h ASP 332 Ca -0.00 -0.01 0.08 0.00 0.43 0.00 0.00 57.03 57.53 1mne h ASP 332 Cb 0.85 0.16 -0.07 0.00 -0.56 0.00 0.00 39.33 39.72 1mne h ASP 332 CO 0.06 -0.23 0.03 0.40 -1.57 0.00 0.00 179.24 177.94 1mne h ILE 333 N -1.16 0.70 -0.48 0.35 2.04 -1.37 -1.28 117.51 116.30 1mne h ILE 333 Ca -0.08 -0.05 -0.04 0.00 1.00 0.00 0.00 64.86 65.70 1mne h ILE 333 Cb 0.60 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1mne h ILE 333 CO 0.12 0.03 0.14 0.58 0.00 0.00 0.00 178.15 179.02 1mne h VAL 334 N 0.15 1.20 0.00 1.67 2.07 -0.54 -3.45 116.25 117.35 1mne h VAL 334 Ca 0.22 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1mne h VAL 334 Cb 0.31 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 1mne h VAL 334 CO -0.34 0.25 0.00 0.61 0.02 0.00 0.00 177.57 178.12 1mne n GLY 335 N -1.00 0.59 3.65 2.17 0.00 -0.48 -4.98 105.19 105.13 1mne n GLY 335 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1mne n GLY 335 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mne s PHE 336 N -0.93 3.21 1.00 1.61 0.40 0.54 -5.02 117.98 118.81 1mne s PHE 336 Ca 0.00 1.33 -0.12 0.00 -0.60 0.00 0.00 56.93 57.53 1mne s PHE 336 Cb 0.00 -3.43 0.14 0.00 0.51 0.00 0.00 43.02 40.23 1mne s PHE 336 CO 0.00 -0.73 0.77 -1.13 0.70 0.00 0.00 175.22 174.83 1mne n SER 337 N 6.55 -1.10 0.09 1.36 3.41 -1.26 -4.64 113.62 118.02 1mne n SER 337 Ca 0.12 0.22 -0.00 0.00 -0.26 0.00 0.00 58.87 58.95 1mne n SER 337 Cb 0.46 -1.30 0.29 0.00 -0.26 0.00 0.00 64.21 63.40 1mne n SER 337 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1mne h GLN 338 N -1.97 0.29 0.25 4.33 1.08 -1.98 -2.12 115.11 115.00 1mne h GLN 338 Ca -0.48 -0.10 -0.01 0.00 -1.45 0.00 0.00 58.65 56.61 1mne h GLN 338 Cb 1.30 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.71 1mne h GLN 338 CO 0.40 0.53 -0.12 1.05 -0.95 0.00 0.00 178.83 179.74 1mne h GLU 339 N 0.26 -0.33 -0.82 1.46 9.09 -2.00 -2.32 114.58 119.93 1mne h GLU 339 Ca 0.04 0.02 0.19 0.00 0.05 0.00 0.00 59.36 59.67 1mne h GLU 339 Cb 0.60 0.07 -0.12 0.00 -1.65 0.00 0.00 28.75 27.65 1mne h GLU 339 CO 0.04 -0.05 0.26 0.93 0.05 0.00 0.00 179.01 180.24 1mne h GLU 340 N -0.59 0.30 -0.40 1.06 5.08 -1.87 0.49 114.58 118.66 1mne h GLU 340 Ca -0.03 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1mne h GLU 340 Cb 0.43 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 1mne h GLU 340 CO 0.06 0.20 0.20 1.96 -1.00 0.00 0.00 179.01 180.43 1mne h GLN 341 N 0.31 0.39 0.11 2.33 4.20 -1.26 0.17 115.11 121.37 1mne h GLN 341 Ca 0.49 -0.02 0.01 0.00 0.06 0.00 0.00 58.65 59.18 1mne h GLN 341 Cb 0.89 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.57 1mne h GLN 341 CO -0.54 0.26 -0.13 1.98 -0.67 0.00 0.00 178.83 179.73 1mne h MET 342 N 0.40 -0.27 -0.68 1.46 4.05 0.37 -1.60 114.93 118.66 1mne h MET 342 Ca 0.17 0.02 0.11 0.00 -0.28 0.00 0.00 59.70 59.72 1mne h MET 342 Cb 0.08 0.06 -0.08 0.00 -0.80 0.00 0.00 31.60 30.86 1mne h MET 342 CO -0.12 -0.18 0.28 0.77 0.23 0.00 0.00 176.91 177.89 1mne h SER 343 N -0.28 0.29 -0.55 1.39 0.02 -0.08 0.34 113.55 114.68 1mne h SER 343 Ca 0.01 0.09 0.11 0.00 -0.84 0.00 0.00 61.79 61.16 1mne h SER 343 Cb 0.28 0.05 -0.09 0.00 0.14 0.00 0.00 62.40 62.78 1mne h SER 343 CO -0.05 0.15 0.02 0.40 -1.14 0.00 0.00 176.83 176.21 1mne h ILE 344 N 0.46 0.57 -0.12 3.27 2.04 -0.12 -0.21 117.51 123.40 1mne h ILE 344 Ca 0.35 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 66.17 1mne h ILE 344 Cb 0.46 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1mne h ILE 344 CO -0.33 0.02 0.08 -0.26 0.00 0.00 0.00 178.15 177.66 1mne h PHE 345 N 0.14 0.16 -0.30 1.37 0.04 -0.34 -0.11 116.94 117.90 1mne h PHE 345 Ca 0.28 0.00 0.06 0.00 2.80 0.00 0.00 57.97 61.11 1mne h PHE 345 Cb 0.44 -0.05 -0.05 0.00 2.20 0.00 0.00 35.95 38.48 1mne h PHE 345 CO -0.32 0.12 -0.03 0.87 -0.60 0.00 0.00 178.31 178.35 1mne h LYS 346 N 0.14 0.04 -0.09 1.51 1.57 0.81 0.57 116.57 121.13 1mne h LYS 346 Ca 0.04 -0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.86 1mne h LYS 346 Cb 0.01 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 1mne h LYS 346 CO -0.01 0.03 -0.19 0.82 -0.57 0.00 0.00 179.45 179.53 1mne h ILE 347 N 0.04 0.52 -0.99 1.86 2.04 -0.75 1.16 117.51 121.39 1mne h ILE 347 Ca 0.14 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.14 1mne h ILE 347 Cb 0.20 0.52 -0.09 0.00 -0.74 0.00 0.00 36.82 36.72 1mne h ILE 347 CO -0.27 0.00 0.62 0.40 0.00 0.00 0.00 178.15 178.90 1mne h ILE 348 N -0.27 0.85 0.28 -0.67 1.08 0.36 0.60 117.51 119.74 1mne h ILE 348 Ca 0.08 -0.31 -0.01 0.00 -0.39 0.00 0.00 64.86 64.23 1mne h ILE 348 Cb 0.39 -0.12 0.00 0.00 -3.07 0.00 0.00 36.82 34.02 1mne h ILE 348 CO -0.24 0.16 -0.14 0.00 -0.69 0.00 0.00 178.15 177.24 1mne h ALA 349 N 1.58 -0.38 -0.90 1.87 0.00 0.26 -2.87 119.26 118.81 1mne h ALA 349 Ca 0.51 -0.19 0.23 0.00 0.00 0.00 0.00 54.91 55.46 1mne h ALA 349 Cb 0.63 0.15 -0.13 0.00 0.00 0.00 0.00 17.79 18.44 1mne h ALA 349 CO -0.29 -0.50 0.38 0.78 0.00 0.00 0.00 179.25 179.62 1mne h GLY 350 N -0.80 1.55 0.50 0.00 0.00 0.23 0.45 103.07 104.99 1mne h GLY 350 Ca -0.04 -0.15 0.06 0.00 0.00 0.00 0.00 47.33 47.21 1mne h GLY 350 CO 0.06 -0.31 0.06 -2.22 0.00 0.00 0.00 176.54 174.14 1mne h ILE 351 N 0.35 0.78 -0.68 2.60 2.04 -0.86 0.25 117.51 121.99 1mne h ILE 351 Ca 0.57 -0.06 0.03 0.00 1.00 0.00 0.00 64.86 66.40 1mne h ILE 351 Cb 1.13 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 37.75 1mne h ILE 351 CO -0.56 0.03 0.42 -0.07 0.00 0.00 0.00 178.15 177.97 1mne h LEU 352 N 0.19 0.68 0.13 1.44 3.38 0.05 -1.75 115.31 119.42 1mne h LEU 352 Ca 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 1mne h LEU 352 Cb 0.23 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1mne h LEU 352 CO -0.26 0.47 -0.06 0.45 0.09 0.00 0.00 178.44 179.13 1mne h HIS 353 N 0.82 -0.16 -0.99 1.13 3.86 0.48 -2.34 115.15 117.93 1mne h HIS 353 Ca 0.28 -0.00 0.24 0.00 -1.16 0.00 0.00 60.37 59.72 1mne h HIS 353 Cb 0.04 0.05 -0.12 0.00 1.06 0.00 0.00 27.41 28.45 1mne h HIS 353 CO -0.05 0.01 0.58 -0.07 0.86 0.00 0.00 177.93 179.26 1mne h LEU 354 N -0.31 0.66 -0.59 2.43 3.38 -0.38 2.05 115.31 122.56 1mne h LEU 354 Ca -0.02 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1mne h LEU 354 Cb 0.25 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1mne h LEU 354 CO 0.03 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.29 1mne n GLY 355 N -1.31 -1.03 0.00 0.83 0.00 -0.68 -2.38 105.19 100.62 1mne n GLY 355 Ca 0.26 0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.45 1mne n GLY 355 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mne n ASN 356 N -1.97 0.88 -4.68 1.61 4.13 0.69 -4.55 115.26 111.38 1mne n ASN 356 Ca 0.01 -0.82 -0.47 0.00 1.68 0.00 0.00 54.58 54.98 1mne n ASN 356 Cb 0.15 0.88 -0.04 0.00 -1.54 0.00 0.00 39.78 39.23 1mne n ASN 356 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1mne n ILE 357 N -1.53 0.44 -4.01 2.41 5.41 -1.00 -4.90 119.36 116.18 1mne n ILE 357 Ca 0.04 -0.08 -0.35 0.00 1.00 0.00 0.00 62.75 63.36 1mne n ILE 357 Cb 0.34 -1.83 -0.13 0.00 -0.71 0.00 0.00 39.64 37.32 1mne n ILE 357 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1mne s LYS 358 N 3.28 3.61 -0.43 0.38 2.36 -1.26 -5.08 119.74 122.60 1mne s LYS 358 Ca 0.89 -0.52 -0.14 0.00 -2.55 0.00 0.00 55.97 53.65 1mne s LYS 358 Cb -0.67 -3.11 0.05 0.00 -1.05 0.00 0.00 37.83 33.05 1mne s LYS 358 CO 0.47 -0.03 0.31 -0.06 1.55 0.00 0.00 175.35 177.59 1mne s PHE 359 N 1.11 3.25 0.51 4.03 2.99 -1.26 -4.76 117.98 123.86 1mne s PHE 359 Ca 0.03 -0.90 0.07 0.00 0.00 0.00 0.00 56.93 56.13 1mne s PHE 359 Cb -0.14 -2.81 0.05 0.00 0.00 0.00 0.00 43.02 40.12 1mne s PHE 359 CO 0.02 -0.71 0.71 -1.21 -0.00 0.00 0.00 175.22 174.03 1mne s GLU 360 N 1.61 2.52 0.00 0.44 2.02 -1.20 -4.92 118.70 119.17 1mne s GLU 360 Ca 0.04 -1.32 0.00 0.00 0.02 0.00 0.00 54.97 53.71 1mne s GLU 360 Cb -0.21 -2.65 0.00 0.00 0.10 0.00 0.00 34.13 31.36 1mne s GLU 360 CO 0.07 -0.63 0.00 0.36 0.02 0.00 0.00 175.26 175.09 1mne n LYS 361 N -2.13 0.00 0.00 1.61 -0.00 -1.26 -1.34 118.16 115.05 1mne n LYS 361 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.42 1mne n LYS 361 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.63 1mne n LYS 361 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1mne n GLY 362 N 4.03 2.19 0.18 2.58 0.00 -1.26 -4.73 105.19 108.18 1mne n GLY 362 Ca 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 46.02 45.87 1mne n GLY 362 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mne n ALA 363 N 0.00 -0.11 -2.00 4.61 0.00 -1.26 -4.63 120.51 117.12 1mne n ALA 363 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1mne n ALA 363 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1mne n ALA 363 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mne n GLY 364 N -1.20 2.92 0.00 0.00 0.00 -1.26 -4.98 105.19 100.66 1mne n GLY 364 Ca 0.04 -0.39 0.01 0.00 0.00 0.00 0.00 46.02 45.68 1mne n GLY 364 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1mne n GLU 365 N 0.00 0.56 -0.70 1.61 0.00 -1.26 -5.05 120.64 115.79 1mne n GLU 365 Ca 0.00 -0.01 -0.32 0.00 0.00 0.00 0.00 57.16 56.82 1mne n GLU 365 Cb 0.00 -1.04 0.16 0.00 0.00 0.00 0.00 31.44 30.56 1mne n GLU 365 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1mne n GLY 366 N 2.47 -2.37 3.85 8.31 0.00 -1.26 -4.17 105.19 112.01 1mne n GLY 366 Ca -0.01 -0.78 -0.26 0.00 0.00 0.00 0.00 46.02 44.97 1mne n GLY 366 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mne s ALA 367 N -2.28 3.70 0.22 4.61 0.00 0.02 -4.57 121.76 123.45 1mne s ALA 367 Ca 0.56 -1.17 -0.01 0.00 0.00 0.00 0.00 51.96 51.34 1mne s ALA 367 Cb -0.14 -1.49 -0.04 0.00 0.00 0.00 0.00 23.12 21.45 1mne s ALA 367 CO 0.66 0.50 0.17 0.14 0.00 0.00 0.00 175.76 177.23 1mne s VAL 368 N -1.77 0.00 -0.66 0.00 -7.23 -0.45 -4.91 120.40 105.38 1mne s VAL 368 Ca 0.32 -1.95 0.06 0.00 -1.81 0.00 0.00 61.98 58.60 1mne s VAL 368 Cb -0.10 -2.48 0.23 0.00 0.56 0.00 0.00 36.38 34.59 1mne s VAL 368 CO 0.25 0.00 0.68 -0.11 -0.31 0.00 0.00 175.10 175.62 1mne n LEU 369 N -0.31 3.58 0.04 1.32 7.94 -1.26 -3.22 117.00 125.09 1mne n LEU 369 Ca 0.02 -5.39 -0.12 0.00 -1.11 0.00 0.00 56.01 49.41 1mne n LEU 369 Cb 0.65 -0.69 -0.06 0.00 0.53 0.00 0.00 43.42 43.86 1mne n LEU 369 CO 0.32 1.98 0.61 0.50 -1.11 0.00 0.00 177.39 179.70 1mne h LYS 370 N 4.48 -0.49 -6.41 1.96 1.63 -1.94 -3.39 116.57 112.41 1mne h LYS 370 Ca 0.19 0.03 -0.54 0.00 -0.85 0.00 0.00 60.65 59.48 1mne h LYS 370 Cb 0.68 0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.39 1mne h LYS 370 CO 0.81 -0.33 0.08 0.34 -3.45 0.00 0.00 179.45 176.90 1mne s ASP 371 N -4.84 7.20 0.00 4.20 3.68 -1.26 -4.95 116.67 120.70 1mne s ASP 371 Ca -0.16 1.45 0.00 0.00 2.13 0.00 0.00 52.55 55.97 1mne s ASP 371 Cb 0.09 -2.43 0.00 0.00 -1.45 0.00 0.00 42.92 39.13 1mne s ASP 371 CO 0.65 0.21 0.81 0.29 0.13 0.00 0.00 175.17 177.25 1mne n LYS 372 N 1.50 1.82 0.00 4.34 5.02 -1.26 -4.87 118.16 124.70 1mne n LYS 372 Ca -0.07 -1.13 0.00 0.00 -2.02 0.00 0.00 58.31 55.09 1mne n LYS 372 Cb 0.50 -0.88 0.00 0.00 -0.02 0.00 0.00 35.03 34.62 1mne n LYS 372 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1mne n THR 373 N -0.32 0.00 -0.35 -0.18 -1.04 -1.26 -1.45 114.28 109.68 1mne n THR 373 Ca 0.00 0.96 0.25 0.00 -2.04 0.00 0.00 64.05 63.22 1mne n THR 373 Cb 0.27 -1.83 0.51 0.00 -1.82 0.00 0.00 70.33 67.45 1mne n THR 373 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mne h ALA 374 N -2.02 2.17 -0.84 2.41 0.00 -1.90 1.17 119.26 120.26 1mne h ALA 374 Ca 0.00 0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.13 1mne h ALA 374 Cb 0.00 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 17.81 1mne h ALA 374 CO 0.00 -0.70 0.48 1.25 0.00 0.00 0.00 179.25 180.28 1mne h LEU 375 N 0.34 0.67 0.55 0.00 6.46 -1.85 0.31 115.31 121.80 1mne h LEU 375 Ca 0.69 0.05 -0.03 0.00 -0.12 0.00 0.00 57.88 58.48 1mne h LEU 375 Cb 1.72 -0.07 0.01 0.00 -0.73 0.00 0.00 40.66 41.58 1mne h LEU 375 CO -0.45 0.37 -0.27 0.78 -0.62 0.00 0.00 178.44 178.26 1mne h ASN 376 N 0.78 -0.63 -0.39 1.25 2.35 0.26 -1.12 115.58 118.07 1mne h ASN 376 Ca 0.41 -0.05 0.07 0.00 -0.55 0.00 0.00 56.30 56.19 1mne h ASN 376 Cb 0.41 0.16 -0.09 0.00 0.05 0.00 0.00 38.32 38.85 1mne h ASN 376 CO -0.26 -0.31 -0.41 0.00 -1.65 0.00 0.00 177.43 174.80 1mne h ALA 377 N -0.65 -0.38 -0.64 -0.83 0.00 -0.71 0.27 119.26 116.31 1mne h ALA 377 Ca -0.08 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1mne h ALA 377 Cb 0.64 0.85 -0.04 0.00 0.00 0.00 0.00 17.79 19.23 1mne h ALA 377 CO 0.12 -0.84 0.40 0.00 0.00 0.00 0.00 179.25 178.94 1mne h ALA 378 N 0.48 0.83 -0.18 0.00 0.00 -0.40 -1.60 119.26 118.39 1mne h ALA 378 Ca 0.14 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1mne h ALA 378 Cb 0.58 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 1mne h ALA 378 CO -0.56 0.17 -0.21 0.77 0.00 0.00 0.00 179.25 179.42 1mne h SER 379 N 0.80 -0.67 0.03 0.00 0.02 0.57 -0.54 113.55 113.75 1mne h SER 379 Ca 0.25 0.12 0.01 0.00 -0.84 0.00 0.00 61.79 61.33 1mne h SER 379 Cb -0.00 0.31 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 1mne h SER 379 CO -0.09 -0.26 -0.22 0.74 -1.14 0.00 0.00 176.83 175.85 1mne h THR 380 N -0.24 0.00 -1.00 -2.27 2.02 -0.31 0.17 112.91 111.27 1mne h THR 380 Ca 0.12 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.51 1mne h THR 380 Cb 0.42 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.72 1mne h THR 380 CO -0.32 0.00 0.61 -0.37 0.37 0.00 0.00 175.52 175.81 1mne h VAL 381 N -0.30 0.63 0.00 3.16 -1.51 -0.61 0.91 116.25 118.53 1mne h VAL 381 Ca 0.00 -0.23 -0.13 0.00 -1.23 0.00 0.00 66.70 65.11 1mne h VAL 381 Cb 0.31 -0.09 -0.02 0.00 -2.13 0.00 0.00 31.29 29.37 1mne h VAL 381 CO -0.13 0.12 -0.64 -0.26 -1.23 0.00 0.00 177.57 175.43 1mne h PHE 382 N 0.66 0.00 -1.83 5.19 0.05 -0.97 -3.44 116.94 116.60 1mne h PHE 382 Ca 0.60 0.00 -0.03 0.00 3.82 0.00 0.00 57.97 62.37 1mne h PHE 382 Cb 1.08 0.00 0.01 0.00 2.00 0.00 0.00 35.95 39.04 1mne h PHE 382 CO -0.00 0.64 -0.05 0.41 -0.18 0.00 0.00 178.31 179.12 1mne n GLY 383 N 0.88 0.61 3.13 -1.45 0.00 0.54 -4.33 105.19 104.56 1mne n GLY 383 Ca 0.00 -0.52 -0.09 0.00 0.00 0.00 0.00 46.02 45.42 1mne n GLY 383 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mne s VAL 384 N -3.02 0.15 -0.76 1.61 -7.23 -0.89 0.70 120.40 110.95 1mne s VAL 384 Ca 0.02 -1.87 -0.26 0.00 -1.81 0.00 0.00 61.98 58.06 1mne s VAL 384 Cb -0.01 -1.83 0.01 0.00 0.56 0.00 0.00 36.38 35.11 1mne s VAL 384 CO 0.05 -0.68 1.56 0.21 -0.31 0.00 0.00 175.10 175.93 1mne s ASN 385 N -3.00 5.83 0.30 4.85 2.47 -1.26 -4.51 114.94 119.63 1mne s ASN 385 Ca 0.17 -0.39 0.09 0.00 0.42 0.00 0.00 52.86 53.15 1mne s ASN 385 Cb 0.08 -2.55 0.92 0.00 -1.45 0.00 0.00 41.25 38.24 1mne s ASN 385 CO -0.03 -2.05 1.42 -0.81 -3.72 0.00 0.00 177.10 171.91 1mne n PRO 386 N 9.19 -0.06 -0.07 0.43 -0.04 -1.26 0.56 135.00 143.74 1mne n PRO 386 Ca 0.17 1.31 -0.11 0.00 -0.04 0.00 0.00 63.50 64.83 1mne n PRO 386 Cb 0.50 -2.20 -0.05 0.00 -0.04 0.00 0.00 33.50 31.72 1mne n PRO 386 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1mne h SER 387 N 0.00 0.37 -0.43 3.54 4.64 -1.98 0.21 113.55 119.91 1mne h SER 387 Ca 0.64 -0.30 0.09 0.00 -0.47 0.00 0.00 61.79 61.75 1mne h SER 387 Cb 1.52 -0.10 -0.08 0.00 -0.31 0.00 0.00 62.40 63.43 1mne h SER 387 CO -0.79 0.58 -0.11 0.58 -0.87 0.00 0.00 176.83 176.22 1mne h VAL 388 N 0.16 0.56 -0.58 0.95 2.07 -0.29 0.17 116.25 119.28 1mne h VAL 388 Ca 0.06 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.49 1mne h VAL 388 Cb 0.39 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1mne h VAL 388 CO 0.01 0.00 -0.00 0.25 0.02 0.00 0.00 177.57 177.85 1mne h LEU 389 N -0.01 1.00 -0.06 2.57 5.85 -0.94 0.18 115.31 123.91 1mne h LEU 389 Ca 0.21 -0.31 0.04 0.00 0.84 0.00 0.00 57.88 58.66 1mne h LEU 389 Cb 0.32 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.02 1mne h LEU 389 CO -0.44 1.06 -0.33 -0.08 -0.34 0.00 0.00 178.44 178.31 1mne h GLU 390 N 0.91 -0.42 0.14 1.25 4.81 0.50 0.18 114.58 121.93 1mne h GLU 390 Ca 0.16 0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.44 1mne h GLU 390 Cb 0.55 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.00 1mne h GLU 390 CO 0.03 -0.28 -0.26 0.87 -0.73 0.00 0.00 179.01 178.64 1mne h LYS 391 N -0.44 -0.46 -0.48 1.92 1.79 -0.92 -0.74 116.57 117.24 1mne h LYS 391 Ca 0.08 0.03 0.14 0.00 -2.18 0.00 0.00 60.65 58.72 1mne h LYS 391 Cb 0.56 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.29 1mne h LYS 391 CO -0.31 -0.31 0.40 0.00 -1.08 0.00 0.00 179.45 178.15 1mne h ALA 392 N 0.24 2.32 0.02 3.86 0.00 0.37 1.53 119.26 127.60 1mne h ALA 392 Ca 0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1mne h ALA 392 Cb 0.50 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1mne h ALA 392 CO -0.14 -0.64 -0.01 -0.07 0.00 0.00 0.00 179.25 178.39 1mne h LEU 393 N 0.00 -0.02 0.00 0.00 3.38 -0.16 -3.34 115.31 115.17 1mne h LEU 393 Ca 0.23 -0.72 -0.11 0.00 0.09 0.00 0.00 57.88 57.37 1mne h LEU 393 Cb 1.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1mne h LEU 393 CO -0.00 0.81 -1.86 0.23 0.09 0.00 0.00 178.44 177.70 1mne n MET 394 N -4.69 0.88 -2.56 1.13 0.00 -0.33 -4.64 117.12 106.91 1mne n MET 394 Ca -0.08 -0.10 -0.30 0.00 0.00 0.00 0.00 57.70 57.22 1mne n MET 394 Cb 0.36 -1.39 -0.00 0.00 0.00 0.00 0.00 33.22 32.18 1mne n MET 394 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1mne n GLU 395 N -2.26 3.49 -1.74 0.03 1.02 0.52 0.13 120.64 121.83 1mne n GLU 395 Ca -0.11 -4.50 -0.42 0.00 -0.02 0.00 0.00 57.16 52.11 1mne n GLU 395 Cb 0.65 -2.27 -0.02 0.00 -0.02 0.00 0.00 31.44 29.77 1mne n GLU 395 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1mne n PRO 396 N -0.37 2.72 -2.68 3.49 -0.04 -1.09 -4.41 135.00 132.62 1mne n PRO 396 Ca 0.39 0.97 -0.40 0.00 -0.04 0.00 0.00 63.50 64.43 1mne n PRO 396 Cb 0.47 -2.77 -0.06 0.00 -0.04 0.00 0.00 33.50 31.10 1mne n PRO 396 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1mne s ARG 397 N -0.02 4.75 -0.02 0.54 0.52 -1.26 0.20 118.95 123.65 1mne s ARG 397 Ca 0.67 1.55 0.03 0.00 -0.52 0.00 0.00 55.73 57.45 1mne s ARG 397 Cb -0.50 -3.17 -0.00 0.00 0.52 0.00 0.00 34.95 31.80 1mne s ARG 397 CO 0.44 0.39 -0.09 0.42 0.02 0.00 0.00 175.30 176.48 1mne s ILE 398 N -1.25 0.74 -0.16 1.52 1.09 -0.58 -4.79 121.20 117.77 1mne s ILE 398 Ca 0.44 -0.36 -0.29 0.00 -1.10 0.00 0.00 60.65 59.33 1mne s ILE 398 Cb -0.26 -0.65 -0.04 0.00 -1.06 0.00 0.00 42.46 40.45 1mne s ILE 398 CO 0.33 0.23 1.66 -0.22 -0.10 0.00 0.00 174.94 176.84 1mne s LEU 399 N 0.05 4.02 -0.55 2.97 1.98 -1.26 -1.60 118.68 124.29 1mne s LEU 399 Ca -0.01 1.85 0.01 0.00 -2.89 0.00 0.00 54.13 53.10 1mne s LEU 399 Cb -0.07 -3.53 0.52 0.00 0.66 0.00 0.00 46.19 43.77 1mne s LEU 399 CO 0.00 -1.18 1.90 0.00 -1.89 0.00 0.00 176.35 175.18 1mne n ALA 400 N 8.18 5.90 0.00 5.97 0.00 0.88 -4.97 120.51 136.46 1mne n ALA 400 Ca 0.19 -3.30 0.00 0.00 0.00 0.00 0.00 53.44 50.33 1mne n ALA 400 Cb 0.44 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1mne n ALA 400 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mne n GLY 401 N -0.99 2.29 0.14 0.00 0.00 -1.26 -3.75 105.19 101.62 1mne n GLY 401 Ca 0.59 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 46.18 1mne n GLY 401 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1mne h ARG 402 N 0.00 0.44 -6.09 1.61 2.47 -1.99 -3.44 114.38 107.39 1mne h ARG 402 Ca 0.00 -0.75 -0.60 0.00 -1.26 0.00 0.00 59.98 57.37 1mne h ARG 402 Cb 0.00 0.28 -0.10 0.00 -1.65 0.00 0.00 29.97 28.50 1mne h ARG 402 CO 0.00 1.36 0.56 -0.51 0.56 0.00 0.00 179.97 181.94 1mne s ASP 403 N -7.36 6.57 -0.56 7.04 -0.00 -1.25 -4.99 116.67 116.12 1mne s ASP 403 Ca -0.12 0.31 -0.25 0.00 -0.00 0.00 0.00 52.55 52.49 1mne s ASP 403 Cb 0.04 -2.45 0.04 0.00 -0.00 0.00 0.00 42.92 40.55 1mne s ASP 403 CO 0.89 -0.94 0.99 -0.22 -0.00 0.00 0.00 175.17 175.89 1mne s LEU 404 N 3.58 3.98 -0.11 1.23 0.20 -1.26 -0.09 118.68 126.21 1mne s LEU 404 Ca 0.37 -0.30 0.02 0.00 0.69 0.00 0.00 54.13 54.91 1mne s LEU 404 Cb -0.11 -2.86 0.01 0.00 -0.43 0.00 0.00 46.19 42.80 1mne s LEU 404 CO 0.22 -1.30 -0.17 -0.69 -0.29 0.00 0.00 176.35 174.13 1mne s VAL 405 N 4.17 1.60 -0.10 1.68 1.01 -0.63 -4.82 120.40 123.32 1mne s VAL 405 Ca 0.32 -0.72 -0.29 0.00 0.00 0.00 0.00 61.98 61.29 1mne s VAL 405 Cb -0.12 -1.45 -0.05 0.00 0.00 0.00 0.00 36.38 34.77 1mne s VAL 405 CO 0.20 0.46 1.72 0.00 0.00 0.00 0.00 175.10 177.48 1mne s ALA 406 N 0.86 3.45 0.02 5.51 0.00 -1.26 -1.53 121.76 128.80 1mne s ALA 406 Ca -0.09 0.84 -0.23 0.00 0.00 0.00 0.00 51.96 52.48 1mne s ALA 406 Cb -0.15 -3.81 -0.05 0.00 0.00 0.00 0.00 23.12 19.10 1mne s ALA 406 CO 0.00 -1.67 0.71 -0.65 0.00 0.00 0.00 175.76 174.15 1mne s GLN 407 N 4.43 4.44 -0.25 0.00 -1.52 0.13 -4.87 119.66 122.01 1mne s GLN 407 Ca 0.76 0.95 -0.14 0.00 -1.95 0.00 0.00 55.36 54.99 1mne s GLN 407 Cb -0.32 -3.36 -0.04 0.00 -0.22 0.00 0.00 33.01 29.06 1mne s GLN 407 CO 0.31 0.29 0.32 -1.58 -0.25 0.00 0.00 175.29 174.38 1mne s HIS 408 N -0.02 3.28 0.06 0.91 5.65 -1.26 -2.68 115.29 121.23 1mne s HIS 408 Ca 0.36 0.39 -0.02 0.00 0.25 0.00 0.00 55.06 56.04 1mne s HIS 408 Cb -0.20 -2.49 -0.04 0.00 -1.18 0.00 0.00 32.58 28.67 1mne s HIS 408 CO 0.21 -0.12 0.25 -0.51 -0.65 0.00 0.00 174.74 173.91 1mne s LEU 409 N 1.70 4.34 0.00 8.88 1.43 0.12 -4.82 118.68 130.33 1mne s LEU 409 Ca 0.14 0.38 -0.10 0.00 -1.03 0.00 0.00 54.13 53.52 1mne s LEU 409 Cb -0.15 -2.94 0.15 0.00 0.03 0.00 0.00 46.19 43.28 1mne s LEU 409 CO 0.09 0.17 0.36 -0.46 0.23 0.00 0.00 176.35 176.74 1mne n ASN 410 N 0.46 -2.73 0.10 2.29 0.23 -1.26 -0.80 115.26 113.56 1mne n ASN 410 Ca -0.06 -0.41 -0.16 0.00 -0.53 0.00 0.00 54.58 53.42 1mne n ASN 410 Cb 0.52 -0.40 -0.14 0.00 -2.08 0.00 0.00 39.78 37.67 1mne n ASN 410 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1mne h VAL 411 N -2.60 1.48 0.06 3.53 2.07 -1.84 -1.37 116.25 117.59 1mne h VAL 411 Ca -0.16 -3.04 -0.00 0.00 0.82 0.00 0.00 66.70 64.31 1mne h VAL 411 Cb 0.54 2.94 0.00 0.00 -1.52 0.00 0.00 31.29 33.25 1mne h VAL 411 CO 0.10 0.89 -0.03 -0.08 0.02 0.00 0.00 177.57 178.47 1mne h GLU 412 N 0.08 -0.08 -0.49 1.57 4.81 -1.94 0.52 114.58 119.05 1mne h GLU 412 Ca -0.14 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.08 1mne h GLU 412 Cb 1.98 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 31.36 1mne h GLU 412 CO 0.21 0.45 0.26 0.87 -0.73 0.00 0.00 179.01 180.06 1mne h LYS 413 N -0.66 0.67 -0.07 1.92 1.57 -1.93 0.90 116.57 118.97 1mne h LYS 413 Ca -0.01 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1mne h LYS 413 Cb 0.56 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 1mne h LYS 413 CO 0.01 0.51 -0.00 0.77 -0.57 0.00 0.00 179.45 180.17 1mne h SER 414 N 0.68 0.12 -0.55 0.86 0.02 -1.08 -1.42 113.55 112.17 1mne h SER 414 Ca 0.17 -0.31 0.08 0.00 -0.84 0.00 0.00 61.79 60.89 1mne h SER 414 Cb 0.04 -0.03 -0.06 0.00 0.14 0.00 0.00 62.40 62.48 1mne h SER 414 CO -0.03 0.40 0.20 0.77 -1.14 0.00 0.00 176.83 177.04 1mne h SER 415 N -0.17 0.21 -0.38 3.07 4.64 0.13 -2.33 113.55 118.71 1mne h SER 415 Ca 0.02 0.07 0.05 0.00 -0.47 0.00 0.00 61.79 61.45 1mne h SER 415 Cb 0.34 0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.44 1mne h SER 415 CO 0.00 0.14 0.13 0.28 -0.87 0.00 0.00 176.83 176.51 1mne h SER 416 N 0.38 0.13 -0.26 4.97 0.02 0.96 -2.46 113.55 117.30 1mne h SER 416 Ca 0.27 0.04 0.06 0.00 -0.84 0.00 0.00 61.79 61.32 1mne h SER 416 Cb 0.30 0.03 -0.06 0.00 0.14 0.00 0.00 62.40 62.82 1mne h SER 416 CO -0.27 0.11 -0.12 -1.28 -1.14 0.00 0.00 176.83 174.13 1mne h SER 417 N 0.28 -0.41 -0.89 3.07 0.87 -0.74 -1.27 113.55 114.45 1mne h SER 417 Ca 0.17 0.10 0.19 0.00 -1.23 0.00 0.00 61.79 61.02 1mne h SER 417 Cb 0.16 0.23 -0.11 0.00 -0.44 0.00 0.00 62.40 62.24 1mne h SER 417 CO -0.18 -0.15 0.45 -0.09 -0.53 0.00 0.00 176.83 176.32 1mne h ARG 418 N -0.08 0.53 -0.41 2.24 1.12 -1.08 0.14 114.38 116.84 1mne h ARG 418 Ca 0.14 -0.03 -0.02 0.00 -1.11 0.00 0.00 59.98 58.95 1mne h ARG 418 Cb 0.29 -0.12 -0.02 0.00 -0.01 0.00 0.00 29.97 30.11 1mne h ARG 418 CO -0.31 0.35 0.17 -0.44 -3.11 0.00 0.00 179.97 176.63 1mne h ASP 419 N 0.55 0.56 -0.92 -3.80 5.19 -0.82 -1.17 116.42 116.01 1mne h ASP 419 Ca 0.52 -0.16 -0.01 0.00 -0.62 0.00 0.00 57.03 56.77 1mne h ASP 419 Cb 0.87 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 40.19 1mne h ASP 419 CO -0.44 0.57 0.55 0.00 -3.12 0.00 0.00 179.24 176.80 1mne h ALA 420 N 1.02 1.17 -0.40 3.45 0.00 -0.29 0.44 119.26 124.65 1mne h ALA 420 Ca 0.14 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1mne h ALA 420 Cb 0.18 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1mne h ALA 420 CO -0.01 0.63 0.16 1.25 0.00 0.00 0.00 179.25 181.28 1mne h LEU 421 N 1.27 0.19 -0.20 0.00 5.85 -0.37 -1.38 115.31 120.66 1mne h LEU 421 Ca 0.33 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.08 1mne h LEU 421 Cb -0.05 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1mne h LEU 421 CO -0.06 0.14 0.09 0.58 -0.34 0.00 0.00 178.44 178.86 1mne h VAL 422 N 0.33 1.14 -0.37 1.05 2.07 -0.47 -0.15 116.25 119.85 1mne h VAL 422 Ca 0.18 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 1mne h VAL 422 Cb 0.14 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1mne h VAL 422 CO -0.17 0.13 0.09 0.11 0.02 0.00 0.00 177.57 177.75 1mne h LYS 423 N 0.19 0.53 -0.01 1.57 1.57 -0.67 -1.12 116.57 118.64 1mne h LYS 423 Ca 0.07 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1mne h LYS 423 Cb 0.13 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 1mne h LYS 423 CO -0.01 0.49 0.00 0.00 -0.57 0.00 0.00 179.45 179.37 1mne h ALA 424 N 1.58 0.01 -0.38 3.86 0.00 -0.86 -0.12 119.26 123.35 1mne h ALA 424 Ca 0.12 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.96 1mne h ALA 424 Cb 0.20 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.90 1mne h ALA 424 CO -0.00 -0.34 -0.35 -0.07 0.00 0.00 0.00 179.25 178.48 1mne h LEU 425 N -0.27 -1.17 -0.24 0.00 3.38 -0.44 0.24 115.31 116.82 1mne h LEU 425 Ca 0.00 0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 1mne h LEU 425 Cb 0.29 0.53 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1mne h LEU 425 CO 0.00 -0.34 0.05 0.22 0.09 0.00 0.00 178.44 178.46 1mne h TYR 426 N -0.28 0.41 -0.12 1.13 5.03 -1.10 -0.99 116.97 121.04 1mne h TYR 426 Ca 0.16 -0.05 -0.06 0.00 2.58 0.00 0.00 58.73 61.36 1mne h TYR 426 Cb 0.55 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.71 1mne h TYR 426 CO -0.55 0.50 -0.18 0.78 -1.32 0.00 0.00 178.16 177.39 1mne h GLY 427 N 0.21 0.22 0.45 1.82 0.00 -0.48 -0.27 103.07 105.01 1mne h GLY 427 Ca 0.07 -0.14 -0.05 0.00 0.00 0.00 0.00 47.33 47.20 1mne h GLY 427 CO 0.00 0.13 -0.21 3.21 0.00 0.00 0.00 176.54 179.68 1mne h ARG 428 N 0.19 0.16 -0.79 4.80 3.08 -0.19 -2.83 114.38 118.79 1mne h ARG 428 Ca 0.04 -0.16 0.16 0.00 0.07 0.00 0.00 59.98 60.09 1mne h ARG 428 Cb 0.44 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 30.43 1mne h ARG 428 CO 0.03 0.88 0.33 1.25 -1.07 0.00 0.00 179.97 181.38 1mne h LEU 429 N -0.50 0.30 0.27 3.04 5.85 -0.79 0.31 115.31 123.80 1mne h LEU 429 Ca -0.02 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1mne h LEU 429 Cb 0.94 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 1mne h LEU 429 CO 0.04 0.09 -0.20 0.15 -0.34 0.00 0.00 178.44 178.18 1mne h PHE 430 N 0.45 -0.52 -0.49 1.25 3.04 -1.08 0.35 116.94 119.94 1mne h PHE 430 Ca 0.45 -0.00 0.10 0.00 3.98 0.00 0.00 57.97 62.49 1mne h PHE 430 Cb 0.71 0.19 -0.10 0.00 2.56 0.00 0.00 35.95 39.32 1mne h PHE 430 CO -0.16 -0.30 -0.18 -0.07 -2.02 0.00 0.00 178.31 175.57 1mne h LEU 431 N -0.47 -0.64 -0.64 0.59 3.38 -0.98 -1.22 115.31 115.32 1mne h LEU 431 Ca -0.02 0.17 0.13 0.00 0.09 0.00 0.00 57.88 58.25 1mne h LEU 431 Cb 0.41 0.37 -0.11 0.00 0.09 0.00 0.00 40.66 41.42 1mne h LEU 431 CO -0.00 -0.22 -0.06 -0.25 0.09 0.00 0.00 178.44 178.00 1mne h TRP 432 N -0.07 -0.16 0.20 1.13 7.01 0.44 0.58 115.95 125.07 1mne h TRP 432 Ca 0.23 0.05 0.01 0.00 2.11 0.00 0.00 58.89 61.29 1mne h TRP 432 Cb 0.43 0.17 -0.04 0.00 -2.10 0.00 0.00 29.16 27.62 1mne h TRP 432 CO -0.47 -0.22 -0.51 -0.07 -2.79 0.00 0.00 178.44 174.38 1mne h LEU 433 N 0.06 -1.52 -0.50 0.65 3.38 0.17 0.12 115.31 117.68 1mne h LEU 433 Ca 0.33 0.15 0.10 0.00 0.09 0.00 0.00 57.88 58.55 1mne h LEU 433 Cb 0.53 0.55 -0.09 0.00 0.09 0.00 0.00 40.66 41.73 1mne h LEU 433 CO -0.60 -0.58 -0.12 0.58 0.09 0.00 0.00 178.44 177.82 1mne h VAL 434 N -0.80 0.50 0.07 1.22 2.07 -0.11 0.10 116.25 119.31 1mne h VAL 434 Ca -0.01 -0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.52 1mne h VAL 434 Cb 0.78 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 1mne h VAL 434 CO -0.24 0.00 -0.20 0.50 0.02 0.00 0.00 177.57 177.65 1mne h LYS 435 N 0.00 -0.34 -0.68 1.57 3.64 -0.57 0.29 116.57 120.48 1mne h LYS 435 Ca 0.24 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.71 1mne h LYS 435 Cb 0.37 0.08 -0.10 0.00 -0.41 0.00 0.00 32.23 32.17 1mne h LYS 435 CO -0.51 -0.23 -0.54 -0.22 -2.27 0.00 0.00 179.45 175.68 1mne h LYS 436 N -0.35 -0.17 0.00 1.90 1.63 0.25 0.19 116.57 120.02 1mne h LYS 436 Ca 0.04 0.01 0.03 0.00 -0.85 0.00 0.00 60.65 59.88 1mne h LYS 436 Cb 0.39 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.02 1mne h LYS 436 CO -0.14 -0.11 -0.26 0.82 -3.45 0.00 0.00 179.45 176.31 1mne h ILE 437 N -0.18 0.41 -0.83 2.00 2.04 -0.45 -1.98 117.51 118.52 1mne h ILE 437 Ca 0.11 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.14 1mne h ILE 437 Cb 0.47 0.41 -0.11 0.00 -0.74 0.00 0.00 36.82 36.85 1mne h ILE 437 CO -0.74 0.00 0.37 0.78 0.00 0.00 0.00 178.15 178.56 1mne h ASN 438 N -0.40 0.36 -0.66 1.72 2.35 0.83 0.24 115.58 120.02 1mne h ASN 438 Ca 0.06 0.12 0.11 0.00 -0.55 0.00 0.00 56.30 56.04 1mne h ASN 438 Cb 0.48 0.08 -0.08 0.00 0.05 0.00 0.00 38.32 38.86 1mne h ASN 438 CO -0.23 0.10 0.26 0.78 -1.65 0.00 0.00 177.43 176.70 1mne h ASN 439 N 0.48 0.27 -0.14 5.81 -0.26 0.08 1.21 115.58 123.04 1mne h ASN 439 Ca 0.48 0.08 -0.03 0.00 -0.56 0.00 0.00 56.30 56.27 1mne h ASN 439 Cb 0.78 0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 38.09 1mne h ASN 439 CO -0.44 0.15 -0.03 0.58 -1.06 0.00 0.00 177.43 176.63 1mne h VAL 440 N 0.45 1.28 0.06 2.81 2.07 -0.55 -3.38 116.25 119.00 1mne h VAL 440 Ca 0.34 -0.95 -0.35 0.00 0.82 0.00 0.00 66.70 66.55 1mne h VAL 440 Cb 0.44 1.64 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 1mne h VAL 440 CO -0.33 0.28 -2.06 0.18 0.02 0.00 0.00 177.57 175.66 1mne n LEU 441 N -4.73 2.11 -4.75 2.57 4.32 0.61 -4.96 117.00 112.17 1mne n LEU 441 Ca -0.06 0.17 -0.41 0.00 -0.02 0.00 0.00 56.01 55.69 1mne n LEU 441 Cb 0.24 -0.67 -0.02 0.00 -1.62 0.00 0.00 43.42 41.36 1mne n LEU 441 CO 0.36 0.74 1.19 0.00 -1.22 0.00 0.00 177.39 178.46 1mne s SER 443 N 0.36 4.79 0.19 0.00 1.04 -1.26 -4.88 113.70 113.94 1mne s SER 443 Ca 0.61 -0.27 -0.12 0.00 0.48 0.00 0.00 55.95 56.65 1mne s SER 443 Cb -0.46 -1.84 0.12 0.00 0.10 0.00 0.00 66.02 63.94 1mne s SER 443 CO 0.48 -0.01 1.84 1.05 0.98 0.00 0.00 173.24 177.58 1mne h GLU 444 N 8.02 0.89 -3.85 4.02 4.11 -1.99 -3.35 114.58 122.44 1mne h GLU 444 Ca -0.39 -0.08 -0.77 0.00 0.07 0.00 0.00 59.36 58.20 1mne h GLU 444 Cb 1.17 -0.19 -0.27 0.00 0.50 0.00 0.00 28.75 29.96 1mne h GLU 444 CO 0.59 0.63 -0.05 1.03 0.07 0.00 0.00 179.01 181.29 1mne s ARG 445 N -6.01 3.29 0.12 1.06 0.52 -1.26 -5.02 118.95 111.65 1mne s ARG 445 Ca -0.13 -2.34 0.09 0.00 -0.52 0.00 0.00 55.73 52.83 1mne s ARG 445 Cb 0.14 -4.27 -0.04 0.00 0.52 0.00 0.00 34.95 31.30 1mne s ARG 445 CO 0.77 -1.27 -0.23 0.00 0.02 0.00 0.00 175.30 174.60 1mne s ALA 446 N 0.38 2.00 -0.16 2.13 0.00 -1.26 -5.00 121.76 119.85 1mne s ALA 446 Ca 0.15 -1.33 0.14 0.00 0.00 0.00 0.00 51.96 50.92 1mne s ALA 446 Cb -0.15 -0.28 -0.24 0.00 0.00 0.00 0.00 23.12 22.45 1mne s ALA 446 CO -0.06 0.41 0.22 0.00 0.00 0.00 0.00 175.76 176.32 1mne n ALA 447 N 0.97 1.47 -3.29 0.00 0.00 -0.93 -5.02 120.51 113.71 1mne n ALA 447 Ca -0.19 -1.14 -0.09 0.00 0.00 0.00 0.00 53.44 52.03 1mne n ALA 447 Cb 0.54 -0.37 -0.04 0.00 0.00 0.00 0.00 19.45 19.57 1mne n ALA 447 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1mne s TYR 448 N -2.52 0.06 0.22 0.00 1.51 -1.17 -4.95 117.35 110.49 1mne s TYR 448 Ca -0.11 -0.43 -0.17 0.00 -1.01 0.00 0.00 57.07 55.34 1mne s TYR 448 Cb 0.07 0.33 0.02 0.00 -0.11 0.00 0.00 41.96 42.27 1mne s TYR 448 CO 0.81 -0.97 0.55 -0.59 -1.11 0.00 0.00 175.55 174.24 1mne s PHE 449 N -3.93 -0.06 -0.14 2.71 -0.71 -1.26 -0.52 117.98 114.07 1mne s PHE 449 Ca 0.14 -0.31 -0.00 0.00 -1.04 0.00 0.00 56.93 55.72 1mne s PHE 449 Cb -0.01 0.41 0.03 0.00 -1.21 0.00 0.00 43.02 42.24 1mne s PHE 449 CO 0.02 -0.98 -0.10 0.42 -1.34 0.00 0.00 175.22 173.25 1mne s ILE 450 N -3.90 1.27 -0.17 -4.49 1.01 0.76 -1.99 121.20 113.69 1mne s ILE 450 Ca 0.12 -0.52 -0.05 0.00 0.00 0.00 0.00 60.65 60.20 1mne s ILE 450 Cb -0.02 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 1mne s ILE 450 CO 0.01 0.34 -0.01 -0.83 0.00 0.00 0.00 174.94 174.44 1mne s GLY 451 N 1.60 1.74 -0.17 6.18 0.00 0.09 0.10 107.32 116.86 1mne s GLY 451 Ca 0.04 -0.86 -0.03 0.00 0.00 0.00 0.00 44.72 43.86 1mne s GLY 451 CO -0.09 0.04 -0.04 0.14 0.00 0.00 0.00 173.10 173.15 1mne s VAL 452 N 0.56 3.67 -0.28 1.40 1.01 0.47 -0.90 120.40 126.32 1mne s VAL 452 Ca -0.01 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.47 1mne s VAL 452 Cb -0.14 -2.62 -0.01 0.00 0.00 0.00 0.00 36.38 33.61 1mne s VAL 452 CO 0.02 0.47 0.09 -0.22 0.00 0.00 0.00 175.10 175.46 1mne s LEU 453 N 0.74 3.77 -0.41 3.92 2.96 -0.84 0.30 118.68 129.11 1mne s LEU 453 Ca -0.02 -0.50 -0.04 0.00 -0.22 0.00 0.00 54.13 53.35 1mne s LEU 453 Cb -0.15 -1.92 0.10 0.00 0.50 0.00 0.00 46.19 44.73 1mne s LEU 453 CO 0.02 -0.14 0.21 -0.62 -1.32 0.00 0.00 176.35 174.50 1mne s ASP 454 N 1.56 5.32 -0.04 3.68 3.68 0.06 -0.96 116.67 129.97 1mne s ASP 454 Ca 0.04 -1.92 -0.13 0.00 2.13 0.00 0.00 52.55 52.67 1mne s ASP 454 Cb -0.16 -1.86 0.02 0.00 -1.45 0.00 0.00 42.92 39.47 1mne s ASP 454 CO 0.04 -0.54 0.30 -0.51 0.13 0.00 0.00 175.17 174.59 1mne s ILE 455 N 1.20 0.05 0.65 4.11 2.07 -1.07 -1.61 121.20 126.59 1mne s ILE 455 Ca 0.07 -0.37 -0.16 0.00 -1.41 0.00 0.00 60.65 58.77 1mne s ILE 455 Cb -0.23 -0.56 -0.00 0.00 0.13 0.00 0.00 42.46 41.79 1mne s ILE 455 CO -0.03 -0.21 1.13 -0.94 -1.91 0.00 0.00 174.94 172.98 1mne s SER 456 N -0.97 5.05 0.43 4.50 1.04 -1.26 -3.69 113.70 118.80 1mne s SER 456 Ca -0.10 2.09 0.00 0.00 0.48 0.00 0.00 55.95 58.42 1mne s SER 456 Cb -0.05 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.51 1mne s SER 456 CO 0.03 -1.67 0.00 0.61 0.98 0.00 0.00 173.24 173.19 1mne n GLY 457 N -0.25 -1.05 3.59 7.32 0.00 -0.97 -4.62 105.19 109.21 1mne n GLY 457 Ca 0.11 -1.62 -0.49 0.00 0.00 0.00 0.00 46.02 44.02 1mne n GLY 457 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mne n PHE 458 N -0.90 1.41 -3.89 1.61 3.72 -1.26 -4.88 117.46 113.26 1mne n PHE 458 Ca 0.00 0.65 -0.35 0.00 -0.05 0.00 0.00 57.45 57.69 1mne n PHE 458 Cb 0.00 -2.30 -0.14 0.00 -0.94 0.00 0.00 39.48 36.10 1mne n PHE 458 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1mne s GLU 459 N -0.28 2.77 -0.32 -1.08 2.02 -1.26 -4.89 118.70 115.65 1mne s GLU 459 Ca 0.74 -1.04 0.01 0.00 0.02 0.00 0.00 54.97 54.70 1mne s GLU 459 Cb -0.84 -3.14 0.10 0.00 0.10 0.00 0.00 34.13 30.35 1mne s GLU 459 CO 0.51 -0.48 0.08 0.42 0.02 0.00 0.00 175.26 175.81 1mne s ILE 460 N 1.34 1.47 0.00 -1.63 1.01 -1.26 -4.91 121.20 117.22 1mne s ILE 460 Ca -0.01 -1.80 0.00 0.00 0.00 0.00 0.00 60.65 58.84 1mne s ILE 460 Cb -0.18 -2.10 0.00 0.00 0.01 0.00 0.00 42.46 40.19 1mne s ILE 460 CO -0.02 -0.64 0.00 0.49 0.00 0.00 0.00 174.94 174.77 1mne n PHE 461 N 4.59 -1.56 0.22 3.97 3.72 -1.26 -5.03 117.46 122.12 1mne n PHE 461 Ca 0.00 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.27 1mne n PHE 461 Cb 0.42 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.89 1mne n PHE 461 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1mne h LYS 462 N 0.00 -0.57 -4.68 -1.08 1.57 -1.99 -3.41 116.57 106.41 1mne h LYS 462 Ca 0.00 0.04 -0.69 0.00 -1.87 0.00 0.00 60.65 58.13 1mne h LYS 462 Cb 0.00 0.13 -0.25 0.00 0.08 0.00 0.00 32.23 32.19 1mne h LYS 462 CO 0.00 -0.26 -0.56 0.08 -0.57 0.00 0.00 179.45 178.14 1mne s VAL 463 N -4.55 4.32 -0.28 0.50 1.01 -1.26 -4.98 120.40 115.16 1mne s VAL 463 Ca -0.14 -0.79 -0.09 0.00 0.00 0.00 0.00 61.98 60.97 1mne s VAL 463 Cb 0.02 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.03 1mne s VAL 463 CO 0.48 -0.11 0.12 0.20 0.00 0.00 0.00 175.10 175.80 1mne s ASN 464 N 1.53 5.41 0.19 3.32 0.01 -1.25 -5.03 114.94 119.13 1mne s ASN 464 Ca 0.02 -0.30 0.03 0.00 -0.71 0.00 0.00 52.86 51.90 1mne s ASN 464 Cb -0.18 -1.98 0.03 0.00 0.41 0.00 0.00 41.25 39.53 1mne s ASN 464 CO 0.05 -0.10 0.24 -0.24 -1.51 0.00 0.00 177.10 175.55 1mne n SER 465 N 4.96 0.84 -0.28 -1.22 2.88 -1.26 -1.39 113.62 118.16 1mne n SER 465 Ca -0.15 -1.53 0.02 0.00 -1.33 0.00 0.00 58.87 55.88 1mne n SER 465 Cb 0.51 -0.12 0.15 0.00 -0.75 0.00 0.00 64.21 64.00 1mne n SER 465 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1mne h PHE 466 N 0.12 0.80 -0.73 0.66 3.57 -1.90 -1.75 116.94 117.71 1mne h PHE 466 Ca -0.09 0.03 0.10 0.00 3.53 0.00 0.00 57.97 61.54 1mne h PHE 466 Cb 0.41 -0.24 -0.07 0.00 2.79 0.00 0.00 35.95 38.83 1mne h PHE 466 CO 0.00 0.34 0.36 0.93 -2.23 0.00 0.00 178.31 177.71 1mne h GLU 467 N 0.76 0.58 0.00 1.11 3.07 -1.99 0.10 114.58 118.21 1mne h GLU 467 Ca 0.37 -0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 59.14 1mne h GLU 467 Cb 0.32 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 1mne h GLU 467 CO -0.23 0.38 -0.29 1.96 -1.40 0.00 0.00 179.01 179.43 1mne h GLN 468 N 0.60 0.00 -0.34 2.33 7.50 -1.75 -2.61 115.11 120.84 1mne h GLN 468 Ca 0.36 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 59.43 1mne h GLN 468 Cb 0.41 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.92 1mne h GLN 468 CO -0.29 0.29 -0.13 1.25 -1.50 0.00 0.00 178.83 178.46 1mne h LEU 469 N 0.00 0.58 0.62 1.46 5.85 0.03 -0.58 115.31 123.27 1mne h LEU 469 Ca -0.00 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 1mne h LEU 469 Cb 0.57 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.45 1mne h LEU 469 CO 0.04 0.74 -0.30 0.00 -0.34 0.00 0.00 178.44 178.58 1mne h ILE 471 N -0.98 0.74 -0.04 0.00 1.08 -1.42 -0.67 117.51 116.23 1mne h ILE 471 Ca -0.09 -0.19 -0.18 0.00 -0.39 0.00 0.00 64.86 64.01 1mne h ILE 471 Cb 0.68 0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 34.56 1mne h ILE 471 CO 0.14 0.10 -0.75 0.78 -0.69 0.00 0.00 178.15 177.73 1mne h ASN 472 N 0.56 0.35 0.17 1.72 2.35 -0.90 0.97 115.58 120.79 1mne h ASN 472 Ca 0.41 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1mne h ASN 472 Cb 0.55 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 1mne h ASN 472 CO -0.35 0.98 -0.34 0.22 -1.65 0.00 0.00 177.43 176.29 1mne h TYR 473 N 0.19 -0.98 -0.80 1.19 3.20 -0.63 0.16 116.97 119.30 1mne h TYR 473 Ca -0.03 0.02 0.16 0.00 3.14 0.00 0.00 58.73 62.02 1mne h TYR 473 Cb 1.33 0.40 -0.15 0.00 1.54 0.00 0.00 36.73 39.85 1mne h TYR 473 CO 0.03 -0.41 -0.21 1.15 -1.64 0.00 0.00 178.16 177.09 1mne h THR 474 N -0.56 0.20 -0.52 1.81 2.02 -1.13 0.32 112.91 115.05 1mne h THR 474 Ca -0.02 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.17 1mne h THR 474 Cb 0.53 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 1mne h THR 474 CO -0.13 0.00 0.34 0.78 0.37 0.00 0.00 175.52 176.88 1mne h ASN 475 N -0.01 0.59 -0.35 4.18 2.35 -0.04 -1.10 115.58 121.20 1mne h ASN 475 Ca 0.38 -0.02 -0.06 0.00 -0.55 0.00 0.00 56.30 56.05 1mne h ASN 475 Cb 0.58 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 1mne h ASN 475 CO -0.82 0.43 -0.01 -0.33 -1.65 0.00 0.00 177.43 175.04 1mne h GLU 476 N 0.70 0.63 0.02 0.81 4.39 0.25 -0.23 114.58 121.15 1mne h GLU 476 Ca 0.19 -0.21 0.02 0.00 0.34 0.00 0.00 59.36 59.70 1mne h GLU 476 Cb -0.08 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 1mne h GLU 476 CO -0.04 0.75 -0.12 0.87 -1.16 0.00 0.00 179.01 179.31 1mne h LYS 477 N 0.44 -0.21 -0.92 2.33 1.57 -0.66 -1.45 116.57 117.67 1mne h LYS 477 Ca 0.10 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1mne h LYS 477 Cb 0.48 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.79 1mne h LYS 477 CO 0.02 -0.14 0.61 -0.07 -0.57 0.00 0.00 179.45 179.29 1mne h LEU 478 N -0.22 1.05 -0.46 2.94 3.38 -1.13 -0.93 115.31 119.95 1mne h LEU 478 Ca 0.04 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1mne h LEU 478 Cb 0.26 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1mne h LEU 478 CO -0.11 0.77 0.07 -0.61 0.09 0.00 0.00 178.44 178.65 1mne h GLN 479 N 1.24 0.77 -0.52 1.13 5.75 -0.77 -2.03 115.11 120.68 1mne h GLN 479 Ca 0.34 -0.21 -0.05 0.00 -0.15 0.00 0.00 58.65 58.57 1mne h GLN 479 Cb -0.14 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.30 1mne h GLN 479 CO -0.07 0.79 0.10 0.37 -2.65 0.00 0.00 178.83 177.37 1mne h GLN 480 N 0.63 0.80 -0.52 1.69 4.15 -0.64 -1.95 115.11 119.28 1mne h GLN 480 Ca 0.14 -0.17 0.03 0.00 0.77 0.00 0.00 58.65 59.41 1mne h GLN 480 Cb 0.40 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.94 1mne h GLN 480 CO 0.01 0.74 0.31 0.35 -1.93 0.00 0.00 178.83 178.32 1mne h PHE 481 N 0.77 0.58 -0.16 3.99 3.04 -0.80 -0.64 116.94 123.72 1mne h PHE 481 Ca 0.17 0.02 0.05 0.00 3.98 0.00 0.00 57.97 62.18 1mne h PHE 481 Cb 0.32 -0.19 -0.05 0.00 2.56 0.00 0.00 35.95 38.59 1mne h PHE 481 CO 0.02 0.33 -0.19 0.35 -2.02 0.00 0.00 178.31 176.80 1mne h PHE 482 N 0.62 -0.49 -0.98 0.41 3.04 -0.79 -0.57 116.94 118.17 1mne h PHE 482 Ca 0.21 0.03 0.04 0.00 3.98 0.00 0.00 57.97 62.23 1mne h PHE 482 Cb 0.03 0.24 -0.06 0.00 2.56 0.00 0.00 35.95 38.72 1mne h PHE 482 CO -0.07 -0.27 0.64 -0.91 -2.02 0.00 0.00 178.31 175.69 1mne h ASN 483 N -0.23 1.05 0.45 0.41 2.35 -0.91 1.00 115.58 119.70 1mne h ASN 483 Ca 0.11 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.83 1mne h ASN 483 Cb 0.39 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1mne h ASN 483 CO -0.29 0.71 -0.22 0.45 -1.65 0.00 0.00 177.43 176.43 1mne h HIS 484 N 1.21 -0.56 -0.12 1.19 3.86 -0.40 -2.57 115.15 117.77 1mne h HIS 484 Ca 0.40 -0.01 0.04 0.00 -1.16 0.00 0.00 60.37 59.64 1mne h HIS 484 Cb 0.04 0.18 -0.05 0.00 1.06 0.00 0.00 27.41 28.64 1mne h HIS 484 CO -0.01 -0.29 -0.22 1.25 0.86 0.00 0.00 177.93 179.52 1mne h HIS 485 N -0.71 -0.58 -0.12 2.45 -0.00 -0.31 -1.81 115.15 114.06 1mne h HIS 485 Ca -0.06 0.03 0.04 0.00 -0.00 0.00 0.00 60.37 60.37 1mne h HIS 485 Cb 0.51 0.28 -0.00 0.00 -0.00 0.00 0.00 27.41 28.20 1mne h HIS 485 CO -0.02 -0.30 0.11 1.98 -0.00 0.00 0.00 177.93 179.69 1mne h MET 486 N -0.29 0.00 -0.19 5.26 -1.53 0.10 -1.73 114.93 116.55 1mne h MET 486 Ca 0.10 0.00 -0.20 0.00 -3.44 0.00 0.00 59.70 56.16 1mne h MET 486 Cb 0.43 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.48 1mne h MET 486 CO -0.28 0.00 -0.66 0.35 0.14 0.00 0.00 176.91 176.45 1mne h PHE 487 N 0.00 0.96 0.43 1.39 3.57 -0.92 -0.65 116.94 121.73 1mne h PHE 487 Ca 0.06 -0.38 -0.02 0.00 3.53 0.00 0.00 57.97 61.15 1mne h PHE 487 Cb 0.27 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.85 1mne h PHE 487 CO 0.00 1.19 -0.21 0.87 -2.23 0.00 0.00 178.31 177.94 1mne h LYS 488 N 0.53 -0.56 -1.01 1.11 1.57 -0.91 -1.34 116.57 115.97 1mne h LYS 488 Ca -0.02 0.04 0.27 0.00 -1.87 0.00 0.00 60.65 59.07 1mne h LYS 488 Cb 1.27 0.13 -0.13 0.00 0.08 0.00 0.00 32.23 33.57 1mne h LYS 488 CO 0.14 -0.28 0.60 0.28 -0.57 0.00 0.00 179.45 179.61 1mne h VAL 489 N -1.06 0.45 -0.14 0.50 2.07 -1.47 1.29 116.25 117.89 1mne h VAL 489 Ca -0.06 -0.16 -0.20 0.00 0.82 0.00 0.00 66.70 67.09 1mne h VAL 489 Cb 0.54 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1mne h VAL 489 CO 0.10 0.09 -0.73 -0.08 0.02 0.00 0.00 177.57 176.96 1mne h GLU 490 N 0.48 0.66 -0.10 1.57 4.57 -1.10 -2.79 114.58 117.88 1mne h GLU 490 Ca 0.67 -0.52 -0.10 0.00 -1.18 0.00 0.00 59.36 58.23 1mne h GLU 490 Cb 1.41 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 30.09 1mne h GLU 490 CO -0.50 1.14 -0.38 0.37 -1.18 0.00 0.00 179.01 178.45 1mne h GLN 491 N 0.46 0.21 -0.70 1.92 4.15 0.15 -2.04 115.11 119.26 1mne h GLN 491 Ca -0.04 -0.09 0.03 0.00 0.77 0.00 0.00 58.65 59.32 1mne h GLN 491 Cb 1.34 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.98 1mne h GLN 491 CO 0.14 0.57 0.44 0.93 -1.93 0.00 0.00 178.83 178.98 1mne h GLU 492 N 0.18 0.85 -0.36 1.69 5.08 0.14 -2.85 114.58 119.30 1mne h GLU 492 Ca 0.02 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 1mne h GLU 492 Cb 0.76 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 1mne h GLU 492 CO 0.06 0.56 -0.03 0.93 -1.00 0.00 0.00 179.01 179.53 1mne h GLU 493 N 0.88 0.59 -0.09 2.33 5.08 -1.10 -0.88 114.58 121.39 1mne h GLU 493 Ca 0.28 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1mne h GLU 493 Cb -0.01 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1mne h GLU 493 CO -0.10 0.64 -0.31 1.88 -1.00 0.00 0.00 179.01 180.12 1mne h TYR 494 N 0.56 0.19 0.04 4.33 0.99 -1.35 -2.55 116.97 119.18 1mne h TYR 494 Ca 0.11 -0.04 -0.07 0.00 2.00 0.00 0.00 58.73 60.74 1mne h TYR 494 Cb 0.41 -0.05 0.01 0.00 1.00 0.00 0.00 36.73 38.10 1mne h TYR 494 CO 0.02 0.47 -0.28 -0.07 -0.00 0.00 0.00 178.16 178.29 1mne h LEU 495 N 0.15 0.19 -1.91 3.88 4.07 -1.14 -0.97 115.31 119.57 1mne h LEU 495 Ca 0.02 -0.91 0.02 0.00 0.08 0.00 0.00 57.88 57.08 1mne h LEU 495 Cb 0.63 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.31 1mne h LEU 495 CO 0.05 1.08 0.38 0.11 -1.08 0.00 0.00 178.44 178.98 1mne h LYS 496 N -0.68 0.00 -0.01 1.13 1.57 -1.10 0.22 116.57 117.70 1mne h LYS 496 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1mne h LYS 496 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 1mne h LYS 496 CO 0.05 0.00 -0.27 0.39 -0.57 0.00 0.00 179.45 179.05 1mne n GLU 497 N -2.98 1.78 -1.04 3.15 -0.58 -0.97 -4.87 120.64 115.13 1mne n GLU 497 Ca -0.01 -0.77 -0.01 0.00 -0.42 0.00 0.00 57.16 55.95 1mne n GLU 497 Cb 0.44 -1.21 -0.01 0.00 -0.57 0.00 0.00 31.44 30.09 1mne n GLU 497 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1mne n LYS 498 N -0.12 -1.01 -1.36 3.49 4.81 0.78 -3.37 118.16 121.39 1mne n LYS 498 Ca 0.06 0.34 -0.31 0.00 -0.87 0.00 0.00 58.31 57.53 1mne n LYS 498 Cb 0.30 -4.14 0.08 0.00 0.02 0.00 0.00 35.03 31.29 1mne n LYS 498 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1mne s ILE 499 N -1.59 3.50 -0.13 3.15 1.01 -0.75 -4.99 121.20 121.40 1mne s ILE 499 Ca 0.00 0.49 -0.27 0.00 0.00 0.00 0.00 60.65 60.87 1mne s ILE 499 Cb 0.00 -3.06 -0.02 0.00 0.01 0.00 0.00 42.46 39.40 1mne s ILE 499 CO 0.00 -0.64 0.90 0.20 0.00 0.00 0.00 174.94 175.41 1mne s ASN 500 N -3.53 7.10 0.00 3.58 0.01 -1.26 -4.51 114.94 116.32 1mne s ASN 500 Ca 0.60 1.35 0.00 0.00 -0.71 0.00 0.00 52.86 54.10 1mne s ASN 500 Cb -0.16 -2.50 0.00 0.00 0.41 0.00 0.00 41.25 39.00 1mne s ASN 500 CO 0.56 -0.39 0.00 0.18 -1.51 0.00 0.00 177.10 175.93 1mne n LEU 508 N 4.97 0.00 0.11 0.60 4.77 -1.26 -5.11 117.00 121.09 1mne n LEU 508 Ca 0.06 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.00 1mne n LEU 508 Cb 0.49 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.67 1mne n LEU 508 CO 0.50 0.00 0.40 -0.78 -1.33 0.00 0.00 177.39 176.18 1mne h ASP 509 N 0.00 0.06 -0.22 -1.43 3.58 -2.04 -2.96 116.42 113.40 1mne h ASP 509 Ca 0.00 -0.04 -0.02 0.00 0.42 0.00 0.00 57.03 57.39 1mne h ASP 509 Cb 0.00 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.02 1mne h ASP 509 CO 0.00 0.76 0.08 0.28 -2.88 0.00 0.00 179.24 177.48 1mne h SER 510 N 0.03 0.37 -0.39 2.28 0.02 -2.00 -2.64 113.55 111.23 1mne h SER 510 Ca -0.01 -0.04 -0.10 0.00 -0.84 0.00 0.00 61.79 60.80 1mne h SER 510 Cb 1.27 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 1mne h SER 510 CO 0.10 0.37 -0.15 -0.61 -1.14 0.00 0.00 176.83 175.39 1mne h GLN 511 N 0.41 0.78 -0.45 3.45 5.75 -1.94 -0.22 115.11 122.89 1mne h GLN 511 Ca 0.10 -0.33 0.05 0.00 -0.15 0.00 0.00 58.65 58.32 1mne h GLN 511 Cb 0.14 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.61 1mne h GLN 511 CO -0.01 0.95 0.18 0.00 -2.65 0.00 0.00 178.83 177.30 1mne h ALA 512 N 0.82 0.55 -0.14 3.38 0.00 -1.52 0.87 119.26 123.22 1mne h ALA 512 Ca 0.09 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1mne h ALA 512 Cb 0.69 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1mne h ALA 512 CO 0.05 -0.20 0.02 1.15 0.00 0.00 0.00 179.25 180.27 1mne h THR 513 N 0.37 1.22 -0.39 0.00 2.02 -1.28 -1.22 112.91 113.63 1mne h THR 513 Ca 0.21 -0.71 0.08 0.00 0.77 0.00 0.00 66.41 66.76 1mne h THR 513 Cb 0.18 1.43 -0.09 0.00 -1.74 0.00 0.00 68.15 67.93 1mne h THR 513 CO -0.19 0.21 -0.31 0.40 0.37 0.00 0.00 175.52 175.99 1mne h ILE 514 N 0.00 0.25 -0.31 3.11 2.04 -0.55 -1.67 117.51 120.37 1mne h ILE 514 Ca 0.04 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.97 1mne h ILE 514 Cb 0.30 0.25 -0.07 0.00 -0.74 0.00 0.00 36.82 36.56 1mne h ILE 514 CO 0.00 0.00 -0.18 0.44 0.00 0.00 0.00 178.15 178.42 1mne h ASP 515 N -0.25 -0.58 -0.60 1.72 3.45 0.10 0.10 116.42 120.36 1mne h ASP 515 Ca 0.17 0.13 0.17 0.00 0.43 0.00 0.00 57.03 57.94 1mne h ASP 515 Cb 0.53 0.31 -0.02 0.00 -0.56 0.00 0.00 39.33 39.59 1mne h ASP 515 CO -0.53 -0.21 0.57 0.25 -1.57 0.00 0.00 179.24 177.76 1mne h LEU 516 N -0.13 0.00 0.00 1.55 5.85 -0.26 0.02 115.31 122.33 1mne h LEU 516 Ca 0.16 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.76 1mne h LEU 516 Cb 0.38 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1mne h LEU 516 CO -0.40 0.00 -1.01 -0.38 -0.34 0.00 0.00 178.44 176.31 1mne n ILE 517 N -3.81 1.48 0.72 4.05 5.41 0.27 0.72 119.36 128.20 1mne n ILE 517 Ca 0.12 0.07 0.08 0.00 1.00 0.00 0.00 62.75 64.01 1mne n ILE 517 Cb 0.80 -2.22 -0.05 0.00 -0.71 0.00 0.00 39.64 37.46 1mne n ILE 517 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1mne n ASP 518 N -4.50 1.15 -4.48 4.38 5.75 -0.73 -0.52 116.55 117.60 1mne n ASP 518 Ca -0.21 -1.07 -0.37 0.00 -0.01 0.00 0.00 54.79 53.13 1mne n ASP 518 Cb 0.49 0.75 0.05 0.00 -1.03 0.00 0.00 41.12 41.39 1mne n ASP 518 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1mne n GLY 519 N 1.27 -1.44 0.16 6.12 0.00 -0.01 -4.80 105.19 106.49 1mne n GLY 519 Ca 0.05 -0.26 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 1mne n GLY 519 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1mne n ARG 520 N -0.41 0.47 -3.40 1.61 0.63 -1.26 -1.99 116.66 112.31 1mne n ARG 520 Ca 0.11 0.13 -0.10 0.00 -0.92 0.00 0.00 57.85 57.07 1mne n ARG 520 Cb 0.49 -1.34 -0.09 0.00 0.45 0.00 0.00 32.46 31.97 1mne n ARG 520 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 1mne s GLN 521 N -2.38 0.33 0.81 -0.14 -1.52 -1.26 -3.15 119.66 112.34 1mne s GLN 521 Ca -0.26 0.57 -0.12 0.00 -1.95 0.00 0.00 55.36 53.60 1mne s GLN 521 Cb 0.08 -0.43 0.08 0.00 -0.22 0.00 0.00 33.01 32.51 1mne s GLN 521 CO 0.42 -0.59 1.14 -1.25 -0.25 0.00 0.00 175.29 174.76 1mne s PRO 522 N 2.54 2.00 0.23 2.91 0.04 -1.26 -5.10 135.00 136.36 1mne s PRO 522 Ca 0.11 0.28 -0.30 0.00 0.04 0.00 0.00 61.00 61.12 1mne s PRO 522 Cb -0.15 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.36 1mne s PRO 522 CO -0.15 -1.60 0.99 -1.25 0.04 0.00 0.00 177.00 175.03 1mne s PRO 523 N -5.43 4.77 0.32 0.56 0.04 -1.19 -4.70 135.00 129.38 1mne s PRO 523 Ca 0.61 1.58 0.05 0.00 0.04 0.00 0.00 61.00 63.29 1mne s PRO 523 Cb -0.12 -3.27 0.05 0.00 0.04 0.00 0.00 34.50 31.21 1mne s PRO 523 CO 0.51 0.38 0.44 0.41 0.04 0.00 0.00 177.00 178.78 1mne n GLY 524 N 1.53 1.87 0.40 0.56 0.00 -0.84 -4.87 105.19 103.84 1mne n GLY 524 Ca -0.01 -2.17 -0.10 0.00 0.00 0.00 0.00 46.02 43.74 1mne n GLY 524 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1mne h ILE 525 N 0.02 0.09 -0.56 -0.61 2.04 0.43 -1.43 117.51 117.50 1mne h ILE 525 Ca -0.15 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.82 1mne h ILE 525 Cb 0.67 0.09 -0.08 0.00 -0.74 0.00 0.00 36.82 36.76 1mne h ILE 525 CO 0.21 0.00 0.08 -0.07 0.00 0.00 0.00 178.15 178.37 1mne h LEU 526 N -0.32 -0.07 -0.30 1.44 3.38 -1.05 -0.25 115.31 118.14 1mne h LEU 526 Ca 0.14 0.11 0.05 0.00 0.09 0.00 0.00 57.88 58.27 1mne h LEU 526 Cb 0.58 0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 1mne h LEU 526 CO -0.60 -0.02 0.04 0.00 0.09 0.00 0.00 178.44 177.95 1mne h ALA 527 N 1.46 0.30 -0.69 1.53 0.00 -1.64 0.32 119.26 120.54 1mne h ALA 527 Ca 0.29 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.20 1mne h ALA 527 Cb 0.43 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1mne h ALA 527 CO -0.40 -0.37 0.18 -0.07 0.00 0.00 0.00 179.25 178.59 1mne h LEU 528 N 0.14 1.03 0.24 0.00 3.38 -0.29 -1.51 115.31 118.30 1mne h LEU 528 Ca 0.14 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1mne h LEU 528 Cb 0.17 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1mne h LEU 528 CO -0.20 0.99 -0.16 0.25 0.09 0.00 0.00 178.44 179.41 1mne h LEU 529 N 1.03 -0.40 -1.18 1.67 5.85 -0.80 -1.87 115.31 119.61 1mne h LEU 529 Ca 0.22 0.03 0.07 0.00 0.84 0.00 0.00 57.88 59.03 1mne h LEU 529 Cb 0.35 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.45 1mne h LEU 529 CO 0.00 -0.25 0.57 0.44 -0.34 0.00 0.00 178.44 178.86 1mne h ASP 530 N -0.39 0.87 -0.81 1.25 3.45 -0.15 -2.04 116.42 118.59 1mne h ASP 530 Ca -0.02 0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.43 1mne h ASP 530 Cb 0.33 -0.18 -0.04 0.00 -0.56 0.00 0.00 39.33 38.88 1mne h ASP 530 CO 0.01 0.56 0.44 -0.08 -1.57 0.00 0.00 179.24 178.60 1mne h GLU 531 N 0.98 1.13 0.00 3.56 4.81 -0.52 -1.14 114.58 123.41 1mne h GLU 531 Ca 0.38 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1mne h GLU 531 Cb 0.22 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1mne h GLU 531 CO -0.14 0.84 0.00 0.94 -0.73 0.00 0.00 179.01 179.91 1mne n GLN 532 N -4.40 0.15 -0.03 1.92 -0.06 -0.78 -3.34 117.38 110.84 1mne n GLN 532 Ca 0.08 0.31 0.01 0.00 -2.00 0.00 0.00 57.00 55.40 1mne n GLN 532 Cb 0.09 -1.75 0.02 0.00 -4.06 0.00 0.00 30.24 24.55 1mne n GLN 532 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 1mne n SER 533 N -2.03 0.49 -0.00 1.69 7.64 -0.43 -2.98 113.62 118.00 1mne n SER 533 Ca 0.03 -2.01 0.06 0.00 1.01 0.00 0.00 58.87 57.96 1mne n SER 533 Cb 0.27 -0.13 -0.08 0.00 -1.01 0.00 0.00 64.21 63.26 1mne n SER 533 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1mne n VAL 534 N -0.27 0.00 -3.43 0.44 0.31 -1.21 -4.86 118.33 109.32 1mne n VAL 534 Ca 0.02 -0.20 -0.39 0.00 -0.01 0.00 0.00 64.34 63.75 1mne n VAL 534 Cb 0.10 0.92 -0.09 0.00 -0.91 0.00 0.00 33.84 33.85 1mne n VAL 534 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1mne s PHE 535 N -2.30 3.23 0.10 3.52 0.08 -1.16 -4.96 117.98 116.50 1mne s PHE 535 Ca 0.04 0.25 -0.17 0.00 0.12 0.00 0.00 56.93 57.17 1mne s PHE 535 Cb 0.10 -2.56 -0.05 0.00 -0.57 0.00 0.00 43.02 39.93 1mne s PHE 535 CO 0.54 -0.27 1.56 -1.35 -0.10 0.00 0.00 175.22 175.60 1mne h PRO 536 N 8.28 0.54 -0.01 0.24 0.11 -1.89 -3.23 132.00 136.05 1mne h PRO 536 Ca -0.32 -0.16 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1mne h PRO 536 Cb 1.16 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1mne h PRO 536 CO 0.64 0.66 -0.26 0.09 -0.21 0.00 0.00 178.00 178.91 1mne n ASN 537 N -4.58 0.84 -4.66 -2.05 3.02 -1.26 -4.88 115.26 101.69 1mne n ASN 537 Ca -0.02 -0.72 -0.36 0.00 -0.03 0.00 0.00 54.58 53.45 1mne n ASN 537 Cb 0.24 0.11 0.09 0.00 -0.61 0.00 0.00 39.78 39.60 1mne n ASN 537 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mne n ALA 538 N -0.84 0.19 -2.30 5.41 0.00 -1.22 -5.01 120.51 116.74 1mne n ALA 538 Ca 0.11 -0.16 -0.16 0.00 0.00 0.00 0.00 53.44 53.24 1mne n ALA 538 Cb 0.33 -2.20 -0.10 0.00 0.00 0.00 0.00 19.45 17.49 1mne n ALA 538 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1mne s THR 539 N -1.74 1.11 0.44 0.00 -4.23 -1.26 -5.02 115.64 104.94 1mne s THR 539 Ca 0.76 -2.05 0.25 0.00 -1.18 0.00 0.00 61.69 59.47 1mne s THR 539 Cb -0.35 -2.15 0.45 0.00 1.34 0.00 0.00 72.50 71.79 1mne s THR 539 CO 0.47 -0.49 1.74 0.44 -0.54 0.00 0.00 174.62 176.25 1mne h ASP 540 N 2.59 0.30 0.20 3.99 3.45 -1.95 0.24 116.42 125.24 1mne h ASP 540 Ca -0.38 0.08 -0.01 0.00 0.43 0.00 0.00 57.03 57.15 1mne h ASP 540 Cb 1.21 0.04 0.00 0.00 -0.56 0.00 0.00 39.33 40.02 1mne h ASP 540 CO 0.64 0.00 -0.10 -1.13 -1.57 0.00 0.00 179.24 177.09 1mne h ASN 541 N 0.23 -0.23 -0.87 6.45 -0.00 -1.95 0.83 115.58 120.04 1mne h ASN 541 Ca 0.65 -0.20 0.19 0.00 -0.00 0.00 0.00 56.30 56.94 1mne h ASN 541 Cb 1.96 0.06 -0.16 0.00 -0.00 0.00 0.00 38.32 40.17 1mne h ASN 541 CO -0.26 0.08 -0.17 0.74 -0.00 0.00 0.00 177.43 177.82 1mne h THR 542 N -0.56 0.14 0.25 -3.57 2.02 -0.98 0.31 112.91 110.52 1mne h THR 542 Ca -0.03 -0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 1mne h THR 542 Cb 0.41 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 1mne h THR 542 CO 0.05 0.00 -0.12 0.25 0.37 0.00 0.00 175.52 176.07 1mne h LEU 543 N 0.01 -0.28 -2.08 2.58 5.85 -0.87 -1.83 115.31 118.69 1mne h LEU 543 Ca 0.44 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 1mne h LEU 543 Cb 0.71 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.82 1mne h LEU 543 CO -0.88 0.12 -0.08 -0.29 -0.34 0.00 0.00 178.44 176.97 1mne h ILE 544 N -0.74 0.42 -0.20 4.05 2.10 -0.39 -0.47 117.51 122.28 1mne h ILE 544 Ca -0.03 -0.40 -0.21 0.00 1.08 0.00 0.00 64.86 65.30 1mne h ILE 544 Cb 0.49 1.27 0.01 0.00 -1.09 0.00 0.00 36.82 37.51 1mne h ILE 544 CO 0.06 0.08 -0.70 0.74 -1.08 0.00 0.00 178.15 177.24 1mne h THR 545 N 0.00 1.28 -0.60 2.19 2.02 -0.03 -2.12 112.91 115.64 1mne h THR 545 Ca -0.00 -1.90 0.04 0.00 0.77 0.00 0.00 66.41 65.32 1mne h THR 545 Cb 0.27 1.86 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 1mne h THR 545 CO 0.01 0.61 0.35 0.50 0.37 0.00 0.00 175.52 177.36 1mne h LYS 546 N 0.58 0.66 0.09 6.66 3.64 -0.55 0.45 116.57 128.10 1mne h LYS 546 Ca -0.03 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1mne h LYS 546 Cb 1.32 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1mne h LYS 546 CO 0.15 0.44 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.65 1mne h LEU 547 N 0.68 -0.10 -1.51 5.20 3.38 -0.96 -1.09 115.31 120.91 1mne h LEU 547 Ca 0.25 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1mne h LEU 547 Cb 0.07 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1mne h LEU 547 CO -0.13 0.09 0.05 0.45 0.09 0.00 0.00 178.44 179.00 1mne h HIS 548 N -0.29 0.36 -0.61 1.13 3.86 -1.15 0.21 115.15 118.66 1mne h HIS 548 Ca -0.01 -0.02 0.10 0.00 -1.16 0.00 0.00 60.37 59.28 1mne h HIS 548 Cb 0.25 -0.11 -0.07 0.00 1.06 0.00 0.00 27.41 28.53 1mne h HIS 548 CO -0.02 0.34 0.22 1.03 0.86 0.00 0.00 177.93 180.36 1mne h SER 549 N 0.36 0.20 0.09 2.45 0.87 0.62 -1.51 113.55 116.63 1mne h SER 549 Ca 0.09 0.08 -0.28 0.00 -1.23 0.00 0.00 61.79 60.45 1mne h SER 549 Cb 0.17 0.07 0.02 0.00 -0.44 0.00 0.00 62.40 62.22 1mne h SER 549 CO -0.00 0.12 -1.14 0.45 -0.53 0.00 0.00 176.83 175.73 1mne h HIS 550 N 0.39 1.00 0.00 2.24 3.86 -0.04 -3.41 115.15 119.19 1mne h HIS 550 Ca 0.31 -0.58 -0.05 0.00 -1.16 0.00 0.00 60.37 58.88 1mne h HIS 550 Cb 0.39 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 1mne h HIS 550 CO -0.17 1.42 -1.58 1.19 0.86 0.00 0.00 177.93 179.64 1mne n PHE 551 N -3.81 0.00 -1.79 2.45 3.01 -0.05 -4.72 117.46 112.55 1mne n PHE 551 Ca -0.12 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 57.91 1mne n PHE 551 Cb 0.93 -0.33 -0.03 0.00 -0.01 0.00 0.00 39.48 40.04 1mne n PHE 551 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1mne s SER 552 N -3.59 5.83 0.00 4.37 0.15 -0.58 -1.22 113.70 118.67 1mne s SER 552 Ca -0.05 1.82 0.00 0.00 0.70 0.00 0.00 55.95 58.42 1mne s SER 552 Cb 0.06 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.85 1mne s SER 552 CO 0.47 -1.67 0.00 0.29 1.20 0.00 0.00 173.24 173.53 1mne n LYS 553 N 8.35 0.00 -0.03 5.44 4.76 -1.26 -4.79 118.16 130.63 1mne n LYS 553 Ca 0.25 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.74 1mne n LYS 553 Cb 0.45 -1.86 -0.15 0.00 -1.84 0.00 0.00 35.03 31.63 1mne n LYS 553 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1mne n LYS 554 N -2.00 0.70 -4.11 1.97 5.02 -0.68 -4.95 118.16 114.12 1mne n LYS 554 Ca 0.00 -0.14 -0.23 0.00 -2.02 0.00 0.00 58.31 55.93 1mne n LYS 554 Cb 0.00 -1.47 -0.17 0.00 -0.02 0.00 0.00 35.03 33.37 1mne n LYS 554 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1mne s ASN 555 N -4.51 1.45 0.00 4.39 3.84 -0.36 -4.99 114.94 114.75 1mne s ASN 555 Ca -0.08 -0.18 0.22 0.00 0.21 0.00 0.00 52.86 53.03 1mne s ASN 555 Cb 0.11 -0.58 0.98 0.00 -0.55 0.00 0.00 41.25 41.21 1mne s ASN 555 CO 0.80 -0.08 1.69 0.00 -2.79 0.00 0.00 177.10 176.73 1mne n ALA 556 N 4.40 2.03 1.11 1.71 0.00 -1.26 -1.31 120.51 127.20 1mne n ALA 556 Ca -0.19 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.29 1mne n ALA 556 Cb 0.51 -1.35 0.16 0.00 0.00 0.00 0.00 19.45 18.77 1mne n ALA 556 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1mne n LYS 557 N -1.42 1.37 -4.08 0.00 4.76 -1.26 -4.91 118.16 112.62 1mne n LYS 557 Ca 0.07 -1.04 -0.29 0.00 -2.87 0.00 0.00 58.31 54.18 1mne n LYS 557 Cb 0.22 -1.48 -0.06 0.00 -1.84 0.00 0.00 35.03 31.87 1mne n LYS 557 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1mne s TYR 558 N -2.35 3.14 -0.13 2.13 5.04 -0.42 -1.19 117.35 123.56 1mne s TYR 558 Ca 0.24 0.03 -0.05 0.00 -2.44 0.00 0.00 57.07 54.84 1mne s TYR 558 Cb 0.19 -1.57 0.06 0.00 0.35 0.00 0.00 41.96 40.99 1mne s TYR 558 CO 0.49 0.51 0.27 -2.00 -1.34 0.00 0.00 175.55 173.48 1mne s GLU 559 N -2.58 0.18 -0.20 4.97 2.12 -0.37 -4.82 118.70 117.99 1mne s GLU 559 Ca 0.29 0.71 -0.20 0.00 0.36 0.00 0.00 54.97 56.13 1mne s GLU 559 Cb -0.11 -0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.21 1mne s GLU 559 CO 0.22 -0.25 0.59 -2.00 -0.54 0.00 0.00 175.26 173.28 1mne s GLU 560 N 2.12 4.19 0.88 4.30 2.12 -1.26 -1.26 118.70 129.79 1mne s GLU 560 Ca -0.02 0.54 -0.10 0.00 0.36 0.00 0.00 54.97 55.74 1mne s GLU 560 Cb -0.11 -3.58 0.12 0.00 0.26 0.00 0.00 34.13 30.82 1mne s GLU 560 CO -0.09 -0.22 1.14 -2.14 -0.54 0.00 0.00 175.26 173.41 1mne s PRO 561 N 1.87 1.29 0.37 4.30 0.02 -1.26 -4.94 135.00 136.66 1mne s PRO 561 Ca 0.27 1.51 0.23 0.00 0.02 0.00 0.00 61.00 63.03 1mne s PRO 561 Cb -0.16 -1.76 0.31 0.00 0.02 0.00 0.00 34.50 32.91 1mne s PRO 561 CO 0.10 -2.42 1.51 0.07 -0.33 0.00 0.00 177.00 175.92 1mne h ARG 562 N -1.64 0.00 0.00 5.54 0.11 -1.97 -3.42 114.38 113.00 1mne h ARG 562 Ca -0.43 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.65 1mne h ARG 562 Cb 1.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.34 1mne h ARG 562 CO 0.44 0.00 -0.41 1.19 0.10 0.00 0.00 179.97 181.29 1mne n PHE 563 N -2.94 0.00 -1.90 4.08 3.01 -1.26 -5.06 117.46 113.38 1mne n PHE 563 Ca 0.03 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.08 1mne n PHE 563 Cb 0.53 0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 39.98 1mne n PHE 563 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1mne s SER 564 N -3.44 6.52 0.00 4.37 0.15 -1.26 -4.85 113.70 115.19 1mne s SER 564 Ca 0.00 2.82 0.15 0.00 0.70 0.00 0.00 55.95 59.61 1mne s SER 564 Cb 0.00 -2.63 0.35 0.00 -1.71 0.00 0.00 66.02 62.02 1mne s SER 564 CO 0.00 -0.80 1.26 0.29 1.20 0.00 0.00 173.24 175.19 1mne n LYS 565 N 2.08 2.41 -0.00 5.44 5.02 -1.26 -4.42 118.16 127.43 1mne n LYS 565 Ca 0.07 -2.05 0.01 0.00 -2.02 0.00 0.00 58.31 54.32 1mne n LYS 565 Cb 0.39 -1.35 -0.01 0.00 -0.02 0.00 0.00 35.03 34.04 1mne n LYS 565 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1mne n THR 566 N 0.88 0.00 -4.50 -0.18 -2.24 -1.26 -5.02 114.28 101.96 1mne n THR 566 Ca 0.14 -0.42 -0.25 0.00 -2.27 0.00 0.00 64.05 61.26 1mne n THR 566 Cb 0.46 0.95 -0.10 0.00 -2.10 0.00 0.00 70.33 69.54 1mne n THR 566 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1mne s GLU 567 N -1.27 1.74 0.12 -0.78 2.02 -1.26 -1.45 118.70 117.82 1mne s GLU 567 Ca 0.01 -1.84 -0.00 0.00 0.02 0.00 0.00 54.97 53.15 1mne s GLU 567 Cb 0.01 -1.74 -0.04 0.00 0.10 0.00 0.00 34.13 32.46 1mne s GLU 567 CO 0.08 0.25 0.02 -0.59 0.02 0.00 0.00 175.26 175.04 1mne s PHE 568 N -2.55 0.86 -0.07 1.61 -0.12 -0.51 -4.26 117.98 112.94 1mne s PHE 568 Ca 0.31 -1.14 0.05 0.00 -0.05 0.00 0.00 56.93 56.09 1mne s PHE 568 Cb -0.02 -0.51 -0.00 0.00 -0.63 0.00 0.00 43.02 41.86 1mne s PHE 568 CO 0.16 -0.41 -0.21 0.20 -0.05 0.00 0.00 175.22 174.91 1mne s GLY 569 N -3.05 1.14 -0.08 1.99 0.00 -0.39 0.17 107.32 107.10 1mne s GLY 569 Ca 0.20 -0.85 0.02 0.00 0.00 0.00 0.00 44.72 44.09 1mne s GLY 569 CO -0.01 -0.38 -0.13 0.14 0.00 0.00 0.00 173.10 172.73 1mne s VAL 570 N 0.14 3.14 -0.73 1.40 1.01 0.16 -1.24 120.40 124.28 1mne s VAL 570 Ca -0.09 -0.67 -0.21 0.00 0.00 0.00 0.00 61.98 61.00 1mne s VAL 570 Cb -0.15 -2.27 0.09 0.00 0.00 0.00 0.00 36.38 34.05 1mne s VAL 570 CO 0.05 0.56 1.00 -0.89 0.00 0.00 0.00 175.10 175.82 1mne s THR 571 N -0.31 4.44 0.71 3.92 2.01 -0.33 0.48 115.64 126.55 1mne s THR 571 Ca 0.03 -0.71 -0.03 0.00 0.31 0.00 0.00 61.69 61.29 1mne s THR 571 Cb -0.13 -4.71 0.10 0.00 0.01 0.00 0.00 72.50 67.78 1mne s THR 571 CO 0.03 -1.46 0.99 -1.00 -0.69 0.00 0.00 174.62 172.48 1mne s HIS 572 N 3.67 2.11 0.11 4.92 3.76 0.31 -4.89 115.29 125.28 1mne s HIS 572 Ca 0.25 -0.02 -0.28 0.00 -0.15 0.00 0.00 55.06 54.86 1mne s HIS 572 Cb -0.14 -3.11 -0.08 0.00 1.11 0.00 0.00 32.58 30.36 1mne s HIS 572 CO 0.05 -1.58 1.62 -0.92 -0.85 0.00 0.00 174.74 173.05 1mne h TYR 573 N -0.54 -0.87 0.00 1.40 3.20 -1.96 -1.32 116.97 116.89 1mne h TYR 573 Ca -0.40 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.49 1mne h TYR 573 Cb 1.28 0.37 -0.00 0.00 1.54 0.00 0.00 36.73 39.92 1mne h TYR 573 CO -0.08 -0.42 -0.01 0.00 -1.64 0.00 0.00 178.16 176.01 1mne h ALA 574 N 0.12 1.10 0.00 1.82 0.00 -1.90 -3.48 119.26 116.91 1mne h ALA 574 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1mne h ALA 574 Cb 0.57 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1mne h ALA 574 CO -0.19 0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.48 1mne n GLY 575 N -0.92 0.73 3.78 0.00 0.00 -0.50 -4.88 105.19 103.42 1mne n GLY 575 Ca -0.02 -2.06 -0.37 0.00 0.00 0.00 0.00 46.02 43.57 1mne n GLY 575 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1mne s GLN 576 N -1.26 4.35 -0.07 1.61 0.74 -1.26 -0.53 119.66 123.24 1mne s GLN 576 Ca 0.00 1.42 0.01 0.00 0.05 0.00 0.00 55.36 56.84 1mne s GLN 576 Cb 0.00 -2.64 0.02 0.00 1.10 0.00 0.00 33.01 31.49 1mne s GLN 576 CO 0.00 0.04 -0.08 0.08 -0.55 0.00 0.00 175.29 174.79 1mne s VAL 577 N -1.67 0.84 -0.20 1.34 1.01 0.18 -4.90 120.40 117.00 1mne s VAL 577 Ca 0.55 -0.27 -0.14 0.00 0.00 0.00 0.00 61.98 62.12 1mne s VAL 577 Cb -0.20 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 1mne s VAL 577 CO 0.25 0.30 0.30 -0.04 0.00 0.00 0.00 175.10 175.92 1mne s MET 578 N 1.06 4.17 -0.07 2.72 -1.94 -1.26 0.37 119.30 124.36 1mne s MET 578 Ca -0.08 0.04 0.02 0.00 -1.71 0.00 0.00 55.69 53.96 1mne s MET 578 Cb -0.14 -3.51 -0.02 0.00 2.01 0.00 0.00 34.83 33.16 1mne s MET 578 CO -0.01 0.06 -0.12 0.71 -0.01 0.00 0.00 175.02 175.65 1mne s TYR 579 N 1.02 2.78 -0.15 -0.03 2.02 0.45 -3.76 117.35 119.67 1mne s TYR 579 Ca 0.15 -0.21 -0.09 0.00 -0.37 0.00 0.00 57.07 56.55 1mne s TYR 579 Cb -0.14 -1.69 -0.05 0.00 -0.40 0.00 0.00 41.96 39.69 1mne s TYR 579 CO 0.06 0.14 0.16 -2.00 -1.57 0.00 0.00 175.55 172.34 1mne s GLU 580 N -0.53 3.81 0.00 -0.62 2.56 -0.49 -1.42 118.70 122.01 1mne s GLU 580 Ca 0.07 -0.13 0.24 0.00 0.00 0.00 0.00 54.97 55.15 1mne s GLU 580 Cb -0.12 -3.30 0.34 0.00 2.00 0.00 0.00 34.13 33.06 1mne s GLU 580 CO 0.02 0.55 1.30 1.51 -0.56 0.00 0.00 175.26 178.08 1mne n ILE 581 N 2.70 0.00 -1.68 -3.70 0.13 -0.53 -4.57 119.36 111.71 1mne n ILE 581 Ca -0.18 -0.16 -0.52 0.00 -1.10 0.00 0.00 62.75 60.79 1mne n ILE 581 Cb 0.53 0.79 -0.06 0.00 -0.84 0.00 0.00 39.64 40.07 1mne n ILE 581 CO 0.00 0.00 0.00 1.67 2.80 0.00 0.00 176.55 181.02 1mne n GLN 582 N -0.51 1.73 -1.14 9.51 7.27 -1.26 -1.64 117.38 131.34 1mne n GLN 582 Ca 0.10 0.63 -0.05 0.00 0.07 0.00 0.00 57.00 57.75 1mne n GLN 582 Cb 0.40 -2.39 -0.02 0.00 2.41 0.00 0.00 30.24 30.63 1mne n GLN 582 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1mne n ASP 583 N 5.46 -3.79 -0.04 1.69 10.43 -1.26 -4.89 116.55 124.15 1mne n ASP 583 Ca 0.23 0.12 -0.04 0.00 2.57 0.00 0.00 54.79 57.67 1mne n ASP 583 Cb 0.23 -1.70 0.19 0.00 1.84 0.00 0.00 41.12 41.68 1mne n ASP 583 CO 0.00 0.00 0.00 -0.50 -1.07 0.00 0.00 177.20 175.63 1mne h TRP 584 N 0.00 0.67 -0.78 1.24 4.06 -1.67 -0.50 115.95 118.97 1mne h TRP 584 Ca -0.10 -0.11 0.02 0.00 2.06 0.00 0.00 58.89 60.76 1mne h TRP 584 Cb 0.38 -0.18 -0.04 0.00 -1.00 0.00 0.00 29.16 28.32 1mne h TRP 584 CO 0.18 0.71 0.51 -0.07 -3.56 0.00 0.00 178.44 176.21 1mne h LEU 585 N 0.56 0.85 -0.26 -4.49 3.38 -1.91 0.14 115.31 113.58 1mne h LEU 585 Ca 0.10 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 1mne h LEU 585 Cb 0.54 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1mne h LEU 585 CO 0.03 0.60 -0.04 -0.08 0.09 0.00 0.00 178.44 179.04 1mne h GLU 586 N 1.01 0.49 -0.44 1.13 4.81 -1.87 -1.90 114.58 117.81 1mne h GLU 586 Ca 0.30 -0.18 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 1mne h GLU 586 Cb -0.04 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1mne h GLU 586 CO -0.09 0.69 0.20 0.87 -0.73 0.00 0.00 179.01 179.94 1mne h LYS 587 N 0.25 0.61 0.01 1.92 1.57 -0.63 0.19 116.57 120.50 1mne h LYS 587 Ca 0.07 -0.07 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 1mne h LYS 587 Cb 0.49 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 1mne h LYS 587 CO 0.02 0.49 -0.94 -0.97 -0.57 0.00 0.00 179.45 177.49 1mne h ASN 588 N 0.62 0.09 0.48 0.86 -1.24 -0.33 -3.28 115.58 112.77 1mne h ASN 588 Ca 0.15 -0.08 -0.30 0.00 0.71 0.00 0.00 56.30 56.78 1mne h ASN 588 Cb 0.09 -0.03 0.00 0.00 0.73 0.00 0.00 38.32 39.11 1mne h ASN 588 CO -0.02 0.97 -1.46 0.11 -1.29 0.00 0.00 177.43 175.75 1mne h LYS 589 N 0.03 0.28 -6.45 6.67 1.57 -1.19 -1.36 116.57 116.11 1mne h LYS 589 Ca -0.03 -0.48 -0.49 0.00 -1.87 0.00 0.00 60.65 57.78 1mne h LYS 589 Cb 1.63 0.18 -0.04 0.00 0.08 0.00 0.00 32.23 34.07 1mne h LYS 589 CO 0.13 1.17 -0.88 -3.47 -0.57 0.00 0.00 179.45 175.83 1mne n ASP 590 N -3.50 -0.45 -4.42 0.86 4.64 0.66 -4.86 116.55 109.48 1mne n ASP 590 Ca -0.15 -0.99 -0.33 0.00 -1.38 0.00 0.00 54.79 51.95 1mne n ASP 590 Cb 1.04 -3.16 0.13 0.00 -1.04 0.00 0.00 41.12 38.09 1mne n ASP 590 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1mne n PRO 591 N -4.39 -0.44 -3.41 -0.67 -0.04 -1.26 -5.08 135.00 119.71 1mne n PRO 591 Ca -0.30 -0.09 0.01 0.00 -0.04 0.00 0.00 63.50 63.08 1mne n PRO 591 Cb 0.68 -1.88 -0.04 0.00 -0.04 0.00 0.00 33.50 32.22 1mne n PRO 591 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1mne s LEU 592 N -1.56 -0.62 0.04 1.53 2.96 -1.26 -4.94 118.68 114.82 1mne s LEU 592 Ca 0.58 0.83 -0.36 0.00 -0.22 0.00 0.00 54.13 54.96 1mne s LEU 592 Cb -0.20 1.70 -0.15 0.00 0.50 0.00 0.00 46.19 48.03 1mne s LEU 592 CO 0.67 -0.12 1.55 0.00 -1.32 0.00 0.00 176.35 177.13 1mne n GLN 593 N 5.02 1.62 -0.36 1.98 1.13 -1.26 -4.89 117.38 120.63 1mne n GLN 593 Ca -0.09 0.59 0.08 0.00 -1.94 0.00 0.00 57.00 55.63 1mne n GLN 593 Cb 0.52 -2.31 0.25 0.00 0.11 0.00 0.00 30.24 28.82 1mne n GLN 593 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 1mne h GLN 594 N 5.99 0.94 -0.83 -1.09 5.75 -1.98 0.46 115.11 124.35 1mne h GLN 594 Ca -0.47 -0.06 0.20 0.00 -0.15 0.00 0.00 58.65 58.18 1mne h GLN 594 Cb 1.30 -0.21 -0.05 0.00 1.07 0.00 0.00 27.48 29.58 1mne h GLN 594 CO 0.86 0.62 0.56 -0.44 -2.65 0.00 0.00 178.83 177.79 1mne h ASP 595 N 0.97 0.26 -0.25 -0.69 3.45 -1.90 -0.10 116.42 118.17 1mne h ASP 595 Ca 0.50 0.02 -0.17 0.00 0.43 0.00 0.00 57.03 57.81 1mne h ASP 595 Cb 0.52 -0.03 -0.00 0.00 -0.56 0.00 0.00 39.33 39.26 1mne h ASP 595 CO -0.27 0.11 -0.50 -0.07 -1.57 0.00 0.00 179.24 176.95 1mne h LEU 596 N 0.27 0.91 -0.14 1.55 3.38 -0.36 0.11 115.31 121.01 1mne h LEU 596 Ca 0.42 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1mne h LEU 596 Cb 1.21 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 1mne h LEU 596 CO -0.11 1.24 0.09 -0.33 0.09 0.00 0.00 178.44 179.43 1mne h GLU 597 N 0.65 0.19 -0.10 1.13 4.39 -1.11 -0.11 114.58 119.61 1mne h GLU 597 Ca 0.03 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.75 1mne h GLU 597 Cb 1.08 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.65 1mne h GLU 597 CO 0.11 0.15 -0.13 -0.07 -1.16 0.00 0.00 179.01 177.90 1mne h LEU 598 N 0.18 -0.41 -0.03 1.33 3.38 -0.80 0.67 115.31 119.63 1mne h LEU 598 Ca 0.05 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.13 1mne h LEU 598 Cb -0.00 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1mne h LEU 598 CO -0.01 -0.18 -0.30 0.00 0.09 0.00 0.00 178.44 178.05 1mne h PHE 600 N -0.43 0.00 -0.15 0.00 -1.00 -0.73 -2.98 116.94 111.64 1mne h PHE 600 Ca 0.07 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.79 1mne h PHE 600 Cb 0.53 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.08 1mne h PHE 600 CO -0.34 0.04 -0.17 0.87 -1.61 0.00 0.00 178.31 177.11 1mne h LYS 601 N 0.00 0.25 -1.51 1.51 1.57 0.22 -2.46 116.57 116.15 1mne h LYS 601 Ca -0.00 -0.07 -0.32 0.00 -1.87 0.00 0.00 60.65 58.39 1mne h LYS 601 Cb 0.50 -0.03 -0.14 0.00 0.08 0.00 0.00 32.23 32.64 1mne h LYS 601 CO 0.01 0.42 0.41 -0.25 -0.57 0.00 0.00 179.45 179.47 1mne n ASP 602 N -4.24 6.37 -4.83 0.86 10.43 -1.09 -4.85 116.55 119.21 1mne n ASP 602 Ca -0.01 -3.05 -0.32 0.00 2.57 0.00 0.00 54.79 53.98 1mne n ASP 602 Cb 0.30 -1.05 0.00 0.00 1.84 0.00 0.00 41.12 42.21 1mne n ASP 602 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 1mne s SER 603 N 0.18 6.10 0.17 -2.24 0.15 -0.93 -4.73 113.70 112.40 1mne s SER 603 Ca 0.31 1.62 0.02 0.00 0.70 0.00 0.00 55.95 58.60 1mne s SER 603 Cb 0.24 -2.51 0.03 0.00 -1.71 0.00 0.00 66.02 62.07 1mne s SER 603 CO -0.00 -0.95 1.40 0.77 1.20 0.00 0.00 173.24 175.66 1mne h SER 604 N 0.27 0.27 -3.10 5.45 4.64 0.06 -3.46 113.55 117.68 1mne h SER 604 Ca -0.46 -0.21 -0.53 0.00 -0.47 0.00 0.00 61.79 60.13 1mne h SER 604 Cb 1.20 -0.08 0.05 0.00 -0.31 0.00 0.00 62.40 63.26 1mne h SER 604 CO 0.60 0.99 0.83 -0.62 -0.87 0.00 0.00 176.83 177.76 1mne s ASP 605 N -6.93 6.59 0.00 4.97 -1.08 -1.26 -4.99 116.67 113.97 1mne s ASP 605 Ca -0.03 2.68 0.00 0.00 -0.52 0.00 0.00 52.55 54.68 1mne s ASP 605 Cb 0.10 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.95 1mne s ASP 605 CO 0.82 -0.79 0.96 0.59 0.52 0.00 0.00 175.17 177.27 1mne n ASN 606 N 3.11 0.00 -0.05 -0.34 4.13 -1.26 -1.83 115.26 119.02 1mne n ASN 606 Ca 0.10 0.96 -0.08 0.00 1.68 0.00 0.00 54.58 57.23 1mne n ASN 606 Cb 0.39 -0.46 -0.02 0.00 -1.54 0.00 0.00 39.78 38.15 1mne n ASN 606 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1mne h VAL 607 N 0.00 0.90 -0.47 2.41 2.07 -1.97 -2.86 116.25 116.33 1mne h VAL 607 Ca 0.00 -0.04 0.10 0.00 0.82 0.00 0.00 66.70 67.57 1mne h VAL 607 Cb 0.00 0.76 -0.10 0.00 -1.52 0.00 0.00 31.29 30.44 1mne h VAL 607 CO 0.00 0.02 -0.21 0.58 0.02 0.00 0.00 177.57 177.98 1mne h VAL 608 N 0.12 0.37 -0.82 2.57 2.07 -1.92 0.43 116.25 119.07 1mne h VAL 608 Ca 0.10 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.74 1mne h VAL 608 Cb 0.10 0.37 -0.06 0.00 -1.52 0.00 0.00 31.29 30.18 1mne h VAL 608 CO -0.14 0.00 0.53 0.74 0.02 0.00 0.00 177.57 178.73 1mne h THR 609 N -0.11 0.90 0.26 2.57 2.02 -1.20 -2.55 112.91 114.80 1mne h THR 609 Ca 0.22 -0.23 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1mne h THR 609 Cb 0.45 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1mne h THR 609 CO -0.54 0.12 -0.13 0.11 0.37 0.00 0.00 175.52 175.46 1mne h LYS 610 N 0.68 -0.34 -0.44 6.66 1.57 0.03 0.22 116.57 124.96 1mne h LYS 610 Ca 0.39 0.02 0.13 0.00 -1.87 0.00 0.00 60.65 59.32 1mne h LYS 610 Cb 0.57 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 1mne h LYS 610 CO -0.16 -0.14 0.66 -0.07 -0.57 0.00 0.00 179.45 179.17 1mne h LEU 611 N -0.47 0.00 0.00 2.94 3.38 -0.87 0.44 115.31 120.73 1mne h LEU 611 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1mne h LEU 611 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1mne h LEU 611 CO 0.06 0.00 -1.16 0.49 0.09 0.00 0.00 178.44 177.92 1mne n PHE 612 N -3.31 0.00 1.02 1.13 3.01 -0.83 -3.85 117.46 114.63 1mne n PHE 612 Ca 0.09 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.66 1mne n PHE 612 Cb 0.83 -0.16 0.02 0.00 -0.01 0.00 0.00 39.48 40.16 1mne n PHE 612 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1mne n ASN 613 N -1.66 1.94 -4.26 4.37 5.03 0.71 -4.85 115.26 116.54 1mne n ASN 613 Ca -0.01 -1.46 -0.36 0.00 0.87 0.00 0.00 54.58 53.62 1mne n ASN 613 Cb 0.22 0.46 -0.13 0.00 -1.02 0.00 0.00 39.78 39.31 1mne n ASN 613 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1mne s ASP 614 N -2.49 4.87 0.40 6.41 2.15 -0.06 -4.96 116.67 122.99 1mne s ASP 614 Ca 0.19 -0.90 0.14 0.00 0.43 0.00 0.00 52.55 52.40 1mne s ASP 614 Cb 0.18 -1.79 0.98 0.00 -0.30 0.00 0.00 42.92 42.00 1mne s ASP 614 CO 0.58 -0.20 1.88 1.55 -0.17 0.00 0.00 175.17 178.80 1mne h PRO 615 N 8.13 0.49 -0.19 4.34 0.13 -1.89 1.78 132.00 144.79 1mne h PRO 615 Ca -0.29 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1mne h PRO 615 Cb 1.10 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 1mne h PRO 615 CO 0.58 0.32 0.12 -0.91 -0.23 0.00 0.00 178.00 177.89 1mne h ASN 616 N 0.50 0.22 0.00 1.44 4.21 -1.87 -2.18 115.58 117.91 1mne h ASN 616 Ca 0.43 -0.01 -0.38 0.00 1.21 0.00 0.00 56.30 57.56 1mne h ASN 616 Cb 0.93 -0.06 -0.06 0.00 -1.12 0.00 0.00 38.32 38.01 1mne h ASN 616 CO -0.17 0.17 -2.26 -0.38 -1.29 0.00 0.00 177.43 173.50 1mne n ILE 617 N -4.50 1.46 0.31 2.81 5.41 0.11 -4.65 119.36 120.31 1mne n ILE 617 Ca -0.00 -0.29 0.17 0.00 1.00 0.00 0.00 62.75 63.62 1mne n ILE 617 Cb 0.08 -1.93 0.74 0.00 -0.71 0.00 0.00 39.64 37.82 1mne n ILE 617 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1mne h ALA 618 N -0.95 1.00 -2.96 -1.39 0.00 0.24 -3.45 119.26 111.76 1mne h ALA 618 Ca -0.57 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.05 1mne h ALA 618 Cb 1.49 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 19.09 1mne h ALA 618 CO -0.35 0.00 -0.73 -1.12 0.00 0.00 0.00 179.25 177.05 1mne s SER 619 N -5.13 1.05 0.49 0.00 0.01 -0.82 -4.98 113.70 104.31 1mne s SER 619 Ca 0.00 -0.67 0.24 0.00 1.31 0.00 0.00 55.95 56.83 1mne s SER 619 Cb 0.10 0.04 1.25 0.00 0.21 0.00 0.00 66.02 67.61 1mne s SER 619 CO 0.45 -0.25 2.00 0.03 0.41 0.00 0.00 173.24 175.89 1mne h ARG 620 N 4.07 0.00 0.00 12.44 3.08 -1.86 -3.43 114.38 128.68 1mne h ARG 620 Ca -0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.69 1mne h ARG 620 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.24 1mne h ARG 620 CO 0.47 0.17 0.00 0.00 -1.07 0.00 0.00 179.97 179.54 1mne n ALA 621 N -2.32 0.00 -2.71 0.04 0.00 -1.26 -4.97 120.51 109.29 1mne n ALA 621 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.04 1mne n ALA 621 Cb 0.28 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.68 1mne n ALA 621 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1mne s PHE 627 N 1.61 3.55 -0.08 0.00 5.99 -1.26 -4.80 117.98 122.99 1mne s PHE 627 Ca 0.00 1.06 0.03 0.00 0.00 0.00 0.00 56.93 58.02 1mne s PHE 627 Cb 0.00 -2.67 -0.01 0.00 0.00 0.00 0.00 43.02 40.34 1mne s PHE 627 CO 0.00 0.14 -0.19 0.96 -0.00 0.00 0.00 175.22 176.13 1mne s ILE 628 N 0.68 2.61 0.47 3.12 -5.25 -1.26 -5.11 121.20 116.46 1mne s ILE 628 Ca 0.31 -0.85 -0.13 0.00 -0.99 0.00 0.00 60.65 58.99 1mne s ILE 628 Cb -0.16 -2.02 -0.07 0.00 2.95 0.00 0.00 42.46 43.16 1mne s ILE 628 CO 0.14 0.56 0.88 0.42 -1.79 0.00 0.00 174.94 175.15 1mne s THR 629 N -0.11 4.67 0.27 8.37 -4.23 -1.26 -4.88 115.64 118.48 1mne s THR 629 Ca -0.03 0.89 0.00 0.00 -1.18 0.00 0.00 61.69 61.37 1mne s THR 629 Cb -0.14 -3.74 0.26 0.00 1.34 0.00 0.00 72.50 70.22 1mne s THR 629 CO 0.04 -0.63 1.80 0.58 -0.54 0.00 0.00 174.62 175.86 1mne h VAL 630 N 0.93 0.83 0.21 2.29 2.07 -1.53 0.59 116.25 121.63 1mne h VAL 630 Ca -0.47 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 1mne h VAL 630 Cb 1.19 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1mne h VAL 630 CO 0.63 0.15 -0.10 0.00 0.02 0.00 0.00 177.57 178.26 1mne h ALA 631 N 1.54 -0.28 -0.62 1.67 0.00 -1.90 -1.80 119.26 117.87 1mne h ALA 631 Ca 0.48 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 1mne h ALA 631 Cb 0.58 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1mne h ALA 631 CO -0.31 -0.64 0.35 0.00 0.00 0.00 0.00 179.25 178.65 1mne h ALA 632 N 0.46 0.79 -0.94 0.00 0.00 -1.26 0.18 119.26 118.48 1mne h ALA 632 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1mne h ALA 632 Cb 0.25 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1mne h ALA 632 CO 0.05 0.29 0.60 0.37 0.00 0.00 0.00 179.25 180.56 1mne h GLN 633 N 0.83 1.25 -0.44 0.00 4.15 0.19 -1.31 115.11 119.79 1mne h GLN 633 Ca 0.22 -0.09 -0.07 0.00 0.77 0.00 0.00 58.65 59.48 1mne h GLN 633 Cb 0.02 -0.28 -0.02 0.00 0.21 0.00 0.00 27.48 27.42 1mne h GLN 633 CO -0.04 0.85 -0.01 -0.92 -1.93 0.00 0.00 178.83 176.78 1mne h TYR 634 N 1.29 0.85 -0.65 3.99 5.03 -0.66 -0.95 116.97 125.87 1mne h TYR 634 Ca 0.34 -0.15 0.07 0.00 2.58 0.00 0.00 58.73 61.57 1mne h TYR 634 Cb -0.12 -0.22 -0.04 0.00 1.55 0.00 0.00 36.73 37.90 1mne h TYR 634 CO 0.00 0.84 0.43 -0.22 -1.32 0.00 0.00 178.16 177.89 1mne h LYS 635 N 0.62 0.60 0.38 1.82 3.64 0.15 -0.97 116.57 122.81 1mne h LYS 635 Ca 0.12 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1mne h LYS 635 Cb 0.51 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1mne h LYS 635 CO 0.02 0.40 -0.18 1.49 -2.27 0.00 0.00 179.45 178.91 1mne h GLU 636 N 0.62 -0.49 -0.98 1.90 4.81 -0.87 -2.37 114.58 117.20 1mne h GLU 636 Ca 0.29 0.03 0.33 0.00 -0.13 0.00 0.00 59.36 59.88 1mne h GLU 636 Cb 0.33 0.11 -0.16 0.00 0.63 0.00 0.00 28.75 29.66 1mne h GLU 636 CO -0.09 -0.19 0.45 1.96 -0.73 0.00 0.00 179.01 180.41 1mne h GLN 637 N -1.00 0.17 -0.19 1.92 4.20 -0.77 0.86 115.11 120.30 1mne h GLN 637 Ca -0.05 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.54 1mne h GLN 637 Cb 0.52 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.26 1mne h GLN 637 CO 0.08 0.11 -0.30 -0.07 -0.67 0.00 0.00 178.83 177.98 1mne h LEU 638 N 0.17 0.60 -0.52 1.46 -0.00 -1.18 -2.35 115.31 113.49 1mne h LEU 638 Ca 0.73 -0.53 0.10 0.00 -0.00 0.00 0.00 57.88 58.19 1mne h LEU 638 Cb 1.72 -0.17 -0.10 0.00 -0.00 0.00 0.00 40.66 42.11 1mne h LEU 638 CO -0.70 1.01 -0.16 0.00 -0.00 0.00 0.00 178.44 178.59 1mne h ALA 639 N 0.61 0.29 0.06 1.53 0.00 -0.31 0.19 119.26 121.63 1mne h ALA 639 Ca 0.02 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1mne h ALA 639 Cb 0.88 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1mne h ALA 639 CO 0.07 -0.47 -0.03 0.77 0.00 0.00 0.00 179.25 179.59 1mne h SER 640 N -0.03 -0.07 -0.19 0.00 0.02 -1.24 -1.09 113.55 110.94 1mne h SER 640 Ca 0.25 -0.20 0.05 0.00 -0.84 0.00 0.00 61.79 61.05 1mne h SER 640 Cb 0.41 0.02 -0.06 0.00 0.14 0.00 0.00 62.40 62.91 1mne h SER 640 CO -0.55 0.16 -0.16 0.25 -1.14 0.00 0.00 176.83 175.39 1mne h LEU 641 N -0.30 -0.52 -1.82 5.07 5.85 -0.83 0.69 115.31 123.46 1mne h LEU 641 Ca -0.01 0.10 0.16 0.00 0.84 0.00 0.00 57.88 58.98 1mne h LEU 641 Cb 0.26 0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 1mne h LEU 641 CO 0.01 -0.20 0.46 0.24 -0.34 0.00 0.00 178.44 178.61 1mne h MET 642 N -0.17 0.17 0.16 1.25 2.86 -0.64 0.16 114.93 118.72 1mne h MET 642 Ca 0.12 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1mne h MET 642 Cb 0.35 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.97 1mne h MET 642 CO -0.30 0.12 -0.07 0.00 1.06 0.00 0.00 176.91 177.71 1mne h ALA 643 N 1.68 -0.21 -0.31 6.32 0.00 0.16 -1.31 119.26 125.60 1mne h ALA 643 Ca 0.32 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1mne h ALA 643 Cb 1.01 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 1mne h ALA 643 CO -0.05 -0.34 -0.18 1.15 0.00 0.00 0.00 179.25 179.83 1mne h THR 644 N -0.77 0.48 -0.69 0.00 2.02 -0.59 -1.89 112.91 111.47 1mne h THR 644 Ca -0.02 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.26 1mne h THR 644 Cb 0.53 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.37 1mne h THR 644 CO 0.04 0.00 0.46 -0.07 0.37 0.00 0.00 175.52 176.32 1mne h LEU 645 N -0.14 0.49 -2.52 2.58 3.38 -0.62 0.54 115.31 119.02 1mne h LEU 645 Ca 0.16 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 1mne h LEU 645 Cb 0.39 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1mne h LEU 645 CO -0.40 0.29 -0.01 -0.33 0.09 0.00 0.00 178.44 178.08 1mne h GLU 646 N 0.54 0.00 0.00 1.13 5.08 -0.39 -0.18 114.58 120.76 1mne h GLU 646 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1mne h GLU 646 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1mne h GLU 646 CO -0.11 0.01 -0.69 0.25 -1.00 0.00 0.00 179.01 177.47 1mne n THR 647 N -3.16 0.09 -2.79 1.13 -2.24 0.17 -4.93 114.28 102.55 1mne n THR 647 Ca -0.02 -0.10 -0.20 0.00 -2.27 0.00 0.00 64.05 61.46 1mne n THR 647 Cb 0.14 0.26 0.04 0.00 -2.10 0.00 0.00 70.33 68.67 1mne n THR 647 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1mne s THR 648 N -3.07 2.63 -0.22 4.28 -4.23 -0.08 -4.60 115.64 110.35 1mne s THR 648 Ca 0.08 -0.80 -0.10 0.00 -1.18 0.00 0.00 61.69 59.69 1mne s THR 648 Cb 0.16 -2.83 -0.05 0.00 1.34 0.00 0.00 72.50 71.12 1mne s THR 648 CO 0.74 0.00 0.14 0.21 -0.54 0.00 0.00 174.62 175.17 1mne s ASN 649 N -4.48 6.16 0.06 3.99 2.47 -0.00 -4.93 114.94 118.21 1mne s ASN 649 Ca 0.58 0.18 0.03 0.00 0.42 0.00 0.00 52.86 54.08 1mne s ASN 649 Cb -0.09 -2.09 -0.04 0.00 -1.45 0.00 0.00 41.25 37.58 1mne s ASN 649 CO 0.38 0.13 0.01 -2.16 -3.72 0.00 0.00 177.10 171.75 1mne s PRO 650 N 0.64 2.70 -0.06 0.43 0.04 -1.26 -0.65 135.00 136.84 1mne s PRO 650 Ca 0.08 -0.73 0.06 0.00 0.04 0.00 0.00 61.00 60.44 1mne s PRO 650 Cb -0.12 -2.62 -0.01 0.00 0.04 0.00 0.00 34.50 31.79 1mne s PRO 650 CO 0.01 0.58 -0.23 -1.01 0.04 0.00 0.00 177.00 176.38 1mne s HIS 651 N -1.24 2.31 -0.18 0.56 3.76 0.31 -4.95 115.29 115.86 1mne s HIS 651 Ca 0.24 -0.72 -0.04 0.00 -0.15 0.00 0.00 55.06 54.40 1mne s HIS 651 Cb -0.12 -1.53 -0.02 0.00 1.11 0.00 0.00 32.58 32.02 1mne s HIS 651 CO 0.16 -0.23 -0.04 -0.06 -0.85 0.00 0.00 174.74 173.72 1mne s PHE 652 N -0.06 2.99 -0.11 1.40 0.40 -1.26 0.19 117.98 121.52 1mne s PHE 652 Ca -0.06 -0.51 0.03 0.00 -0.60 0.00 0.00 56.93 55.80 1mne s PHE 652 Cb -0.14 -2.01 0.00 0.00 0.51 0.00 0.00 43.02 41.38 1mne s PHE 652 CO 0.04 -0.22 -0.22 0.08 0.70 0.00 0.00 175.22 175.60 1mne s VAL 653 N 0.76 2.17 -0.23 -0.44 1.01 0.84 -2.94 120.40 121.57 1mne s VAL 653 Ca -0.01 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 60.96 1mne s VAL 653 Cb -0.15 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.39 1mne s VAL 653 CO 0.02 0.55 -0.04 -0.13 0.00 0.00 0.00 175.10 175.50 1mne s ARG 654 N 0.47 3.23 -0.13 2.72 1.81 -0.89 -2.78 118.95 123.38 1mne s ARG 654 Ca -0.15 -0.73 -0.18 0.00 -1.72 0.00 0.00 55.73 52.96 1mne s ARG 654 Cb -0.17 -3.02 -0.04 0.00 -0.45 0.00 0.00 34.95 31.27 1mne s ARG 654 CO 0.06 -0.26 0.46 0.00 -0.68 0.00 0.00 175.30 174.88 1mne s ILE 656 N 0.69 1.85 -0.07 0.00 1.01 0.97 -4.17 121.20 121.47 1mne s ILE 656 Ca 0.25 -0.87 -0.24 0.00 0.00 0.00 0.00 60.65 59.79 1mne s ILE 656 Cb -0.15 -1.63 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 1mne s ILE 656 CO 0.10 0.51 0.73 -0.51 0.00 0.00 0.00 174.94 175.76 1mne s ILE 657 N 0.68 5.02 0.18 2.92 2.07 -1.26 -0.93 121.20 129.89 1mne s ILE 657 Ca -0.12 1.49 0.03 0.00 -1.41 0.00 0.00 60.65 60.65 1mne s ILE 657 Cb -0.16 -4.06 -0.12 0.00 0.13 0.00 0.00 42.46 38.24 1mne s ILE 657 CO 0.02 0.23 1.42 1.55 -1.91 0.00 0.00 174.94 176.25 1mne h PRO 658 N 6.82 0.20 0.00 3.50 0.13 -1.89 -3.42 132.00 137.33 1mne h PRO 658 Ca -0.40 -0.20 -0.07 0.00 -0.87 0.00 0.00 66.00 64.47 1mne h PRO 658 Cb 1.19 0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1mne h PRO 658 CO 0.76 0.91 0.14 0.27 -0.23 0.00 0.00 178.00 179.84 1mne n ASN 659 N -3.70 -1.60 -0.30 1.44 0.23 -1.26 -2.05 115.26 108.01 1mne n ASN 659 Ca -0.03 -2.27 0.12 0.00 -0.53 0.00 0.00 54.58 51.87 1mne n ASN 659 Cb 0.76 2.71 0.20 0.00 -2.08 0.00 0.00 39.78 41.38 1mne n ASN 659 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1mne n ASN 660 N -1.48 1.34 -0.88 0.53 3.02 -1.26 -4.33 115.26 112.20 1mne n ASN 660 Ca -0.05 -1.07 0.05 0.00 -0.03 0.00 0.00 54.58 53.48 1mne n ASN 660 Cb 0.45 0.32 0.23 0.00 -0.61 0.00 0.00 39.78 40.17 1mne n ASN 660 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1mne n LYS 661 N -0.55 2.40 -2.61 3.52 5.02 -1.26 -4.95 118.16 119.74 1mne n LYS 661 Ca 0.10 -2.92 -0.14 0.00 -2.02 0.00 0.00 58.31 53.33 1mne n LYS 661 Cb 0.39 -1.80 -0.00 0.00 -0.02 0.00 0.00 35.03 33.60 1mne n LYS 661 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1mne n GLN 662 N -0.81 -2.52 -3.18 1.97 6.02 -1.26 -4.93 117.38 112.67 1mne n GLN 662 Ca 0.24 0.58 -0.24 0.00 -0.01 0.00 0.00 57.00 57.57 1mne n GLN 662 Cb 0.91 -5.20 -0.00 0.00 1.02 0.00 0.00 30.24 26.97 1mne n GLN 662 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1mne s LEU 663 N -5.77 3.85 0.14 1.08 1.43 -1.26 -4.92 118.68 113.23 1mne s LEU 663 Ca 0.07 0.42 0.01 0.00 -1.03 0.00 0.00 54.13 53.60 1mne s LEU 663 Cb -0.04 -3.29 -0.04 0.00 0.03 0.00 0.00 46.19 42.85 1mne s LEU 663 CO 0.09 -0.47 0.30 -2.16 0.23 0.00 0.00 176.35 174.34 1mne s PRO 664 N -4.43 3.47 -1.52 1.29 0.04 -1.26 -4.59 135.00 128.00 1mne s PRO 664 Ca 0.44 -0.47 -0.05 0.00 0.04 0.00 0.00 61.00 60.95 1mne s PRO 664 Cb -0.10 -2.94 0.02 0.00 0.04 0.00 0.00 34.50 31.51 1mne s PRO 664 CO 0.37 0.51 0.59 0.00 0.04 0.00 0.00 177.00 178.51 1mne n ALA 665 N -0.35 -0.99 -3.28 8.56 0.00 -1.26 -4.94 120.51 118.24 1mne n ALA 665 Ca -0.06 0.26 -0.23 0.00 0.00 0.00 0.00 53.44 53.41 1mne n ALA 665 Cb 0.53 -3.73 -0.08 0.00 0.00 0.00 0.00 19.45 16.17 1mne n ALA 665 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1mne n LYS 666 N -3.99 0.26 -3.17 0.00 4.76 -1.26 -5.08 118.16 109.68 1mne n LYS 666 Ca -0.10 -3.00 -0.44 0.00 -2.87 0.00 0.00 58.31 51.90 1mne n LYS 666 Cb 0.61 -1.62 -0.06 0.00 -1.84 0.00 0.00 35.03 32.13 1mne n LYS 666 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1mne s LEU 667 N 0.11 5.23 -0.38 -0.35 2.96 -1.26 -4.26 118.68 120.73 1mne s LEU 667 Ca 0.33 -1.18 -0.24 0.00 -0.22 0.00 0.00 54.13 52.82 1mne s LEU 667 Cb 0.04 -2.36 0.01 0.00 0.50 0.00 0.00 46.19 44.39 1mne s LEU 667 CO -0.17 -0.95 0.82 -1.61 -1.32 0.00 0.00 176.35 173.12 1mne s GLU 668 N 2.51 3.73 0.20 1.98 2.02 -0.87 -5.01 118.70 123.26 1mne s GLU 668 Ca 0.12 0.32 -0.16 0.00 0.02 0.00 0.00 54.97 55.27 1mne s GLU 668 Cb -0.22 -3.82 0.20 0.00 0.10 0.00 0.00 34.13 30.39 1mne s GLU 668 CO 0.09 -0.91 1.61 0.38 0.02 0.00 0.00 175.26 176.45 1mne h ASP 669 N 8.55 -0.78 0.49 -0.19 -0.00 -1.90 -2.08 116.42 120.52 1mne h ASP 669 Ca -0.24 0.20 -0.01 0.00 -0.00 0.00 0.00 57.03 56.97 1mne h ASP 669 Cb 1.09 0.45 -0.01 0.00 -0.00 0.00 0.00 39.33 40.86 1mne h ASP 669 CO 0.93 -0.25 -0.35 0.11 -0.00 0.00 0.00 179.24 179.68 1mne h LYS 670 N -0.06 -0.79 -1.00 4.15 1.57 -1.95 -2.52 116.57 115.97 1mne h LYS 670 Ca 0.28 0.05 0.25 0.00 -1.87 0.00 0.00 60.65 59.37 1mne h LYS 670 Cb 0.50 0.18 -0.08 0.00 0.08 0.00 0.00 32.23 32.91 1mne h LYS 670 CO -0.66 -0.53 0.66 0.28 -0.57 0.00 0.00 179.45 178.64 1mne h VAL 671 N -0.82 0.56 0.16 0.50 2.07 -1.74 -0.85 116.25 116.14 1mne h VAL 671 Ca -0.05 -0.11 -0.34 0.00 0.82 0.00 0.00 66.70 67.01 1mne h VAL 671 Cb 0.69 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1mne h VAL 671 CO 0.02 0.06 -1.73 0.58 0.02 0.00 0.00 177.57 176.52 1mne h VAL 672 N 0.33 0.94 -0.36 2.57 2.07 -1.28 -3.17 116.25 117.35 1mne h VAL 672 Ca 0.54 -2.56 -0.16 0.00 0.82 0.00 0.00 66.70 65.34 1mne h VAL 672 Cb 1.49 2.72 -0.00 0.00 -1.52 0.00 0.00 31.29 33.98 1mne h VAL 672 CO -0.21 0.84 -0.39 -0.07 0.02 0.00 0.00 177.57 177.76 1mne h LEU 673 N 0.09 0.96 -1.63 2.57 3.38 -1.05 0.82 115.31 120.46 1mne h LEU 673 Ca -0.33 -0.48 0.12 0.00 0.09 0.00 0.00 57.88 57.28 1mne h LEU 673 Cb 2.07 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 42.51 1mne h LEU 673 CO 0.16 1.24 0.44 0.44 0.09 0.00 0.00 178.44 180.81 1mne h ASP 674 N 0.70 0.36 -0.07 -0.43 3.45 -1.28 0.12 116.42 119.28 1mne h ASP 674 Ca 0.05 0.01 -0.12 0.00 0.43 0.00 0.00 57.03 57.40 1mne h ASP 674 Cb 0.99 -0.06 0.01 0.00 -0.56 0.00 0.00 39.33 39.70 1mne h ASP 674 CO 0.10 0.21 -0.44 1.56 -1.57 0.00 0.00 179.24 179.09 1mne h GLN 675 N 0.40 0.42 0.00 3.56 4.20 -1.37 -2.38 115.11 119.94 1mne h GLN 675 Ca 0.31 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1mne h GLN 675 Cb 0.66 0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.52 1mne h GLN 675 CO -0.09 1.00 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.96 1mne h LEU 676 N -0.04 0.00 -0.27 1.46 3.38 0.71 -0.84 115.31 119.71 1mne h LEU 676 Ca -0.04 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.73 1mne h LEU 676 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1mne h LEU 676 CO 0.09 0.05 -0.83 0.03 0.09 0.00 0.00 178.44 177.87 1mne h ARG 677 N 0.00 0.46 -0.04 1.13 3.08 -0.52 -2.70 114.38 115.79 1mne h ARG 677 Ca -0.00 -0.43 -0.13 0.00 0.07 0.00 0.00 59.98 59.49 1mne h ARG 677 Cb 0.14 0.10 0.01 0.00 0.08 0.00 0.00 29.97 30.30 1mne h ARG 677 CO 0.01 1.07 -0.49 0.00 -1.07 0.00 0.00 179.97 179.49 1mne n ASN 679 N -4.29 0.00 0.00 0.00 0.23 -0.74 -4.64 115.26 105.81 1mne n ASN 679 Ca -0.09 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 52.96 1mne n ASN 679 Cb 0.60 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.30 1mne n ASN 679 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1mne n GLY 680 N 0.76 1.59 0.33 4.83 0.00 -1.22 -4.89 105.19 106.58 1mne n GLY 680 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.25 1mne n GLY 680 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1mne h VAL 681 N 0.00 1.12 0.00 1.61 2.07 -1.85 -1.93 116.25 117.27 1mne h VAL 681 Ca 0.00 -0.25 -0.19 0.00 0.82 0.00 0.00 66.70 67.09 1mne h VAL 681 Cb 0.00 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 1mne h VAL 681 CO 0.00 0.13 -0.86 -0.07 0.02 0.00 0.00 177.57 176.79 1mne h LEU 682 N 0.71 0.12 -0.13 2.57 3.38 -1.82 -2.64 115.31 117.51 1mne h LEU 682 Ca 0.21 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 1mne h LEU 682 Cb -0.03 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 40.69 1mne h LEU 682 CO -0.05 0.92 -0.51 -0.08 0.09 0.00 0.00 178.44 178.81 1mne h GLU 683 N 0.05 0.58 -0.53 1.13 4.81 -1.75 -1.67 114.58 117.19 1mne h GLU 683 Ca -0.03 -0.45 0.11 0.00 -0.13 0.00 0.00 59.36 58.86 1mne h GLU 683 Cb 1.50 0.09 -0.11 0.00 0.63 0.00 0.00 28.75 30.86 1mne h GLU 683 CO 0.12 1.07 -0.20 0.78 -0.73 0.00 0.00 179.01 180.05 1mne h GLY 684 N 0.21 0.21 0.78 1.92 0.00 -1.33 0.11 103.07 104.97 1mne h GLY 684 Ca -0.03 0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.56 1mne h GLY 684 CO 0.11 -0.22 -0.25 -2.22 0.00 0.00 0.00 176.54 173.96 1mne h ILE 685 N -0.08 0.46 -0.82 2.60 2.04 -1.42 -0.43 117.51 119.86 1mne h ILE 685 Ca 0.25 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.28 1mne h ILE 685 Cb 0.46 0.46 -0.15 0.00 -0.74 0.00 0.00 36.82 36.86 1mne h ILE 685 CO -0.59 0.00 -0.16 0.03 0.00 0.00 0.00 178.15 177.44 1mne h ARG 686 N -0.58 0.02 -0.03 2.37 3.08 0.07 0.51 114.38 119.82 1mne h ARG 686 Ca -0.02 -0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.83 1mne h ARG 686 Cb 0.51 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 1mne h ARG 686 CO -0.02 0.01 -0.82 0.82 -1.07 0.00 0.00 179.97 178.89 1mne h ILE 687 N 0.02 1.41 -0.14 2.04 2.04 -0.75 -2.91 117.51 119.23 1mne h ILE 687 Ca 0.41 -2.34 -0.17 0.00 1.00 0.00 0.00 64.86 63.77 1mne h ILE 687 Cb 0.66 2.28 -0.01 0.00 -0.74 0.00 0.00 36.82 39.01 1mne h ILE 687 CO -0.82 0.69 -0.61 0.74 0.00 0.00 0.00 178.15 178.15 1mne h THR 688 N 0.21 1.34 -0.85 -0.27 2.02 0.10 -3.12 112.91 112.36 1mne h THR 688 Ca -0.05 -1.92 0.11 0.00 0.77 0.00 0.00 66.41 65.33 1mne h THR 688 Cb 1.42 1.90 -0.06 0.00 -1.74 0.00 0.00 68.15 69.67 1mne h THR 688 CO 0.14 0.59 0.55 -0.09 0.37 0.00 0.00 175.52 177.07 1mne h ARG 689 N 0.35 0.74 -0.14 6.66 2.43 -0.03 0.18 114.38 124.57 1mne h ARG 689 Ca -0.01 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 1mne h ARG 689 Cb 1.16 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.53 1mne h ARG 689 CO 0.11 0.49 -0.16 0.87 -1.51 0.00 0.00 179.97 179.78 1mne h LYS 690 N 0.77 0.22 0.00 0.20 1.57 -1.44 -3.42 116.57 114.46 1mne h LYS 690 Ca 0.40 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1mne h LYS 690 Cb 0.51 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1mne h LYS 690 CO -0.17 0.38 0.00 0.41 -0.57 0.00 0.00 179.45 179.51 1mne n GLY 691 N -0.83 1.10 2.50 3.86 0.00 0.62 -4.98 105.19 107.46 1mne n GLY 691 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 1mne n GLY 691 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mne n PHE 692 N 0.00 0.49 -0.28 1.61 3.72 -1.25 -4.62 117.46 117.12 1mne n PHE 692 Ca 0.00 -3.65 -0.01 0.00 -0.05 0.00 0.00 57.45 53.75 1mne n PHE 692 Cb 0.00 -0.09 0.19 0.00 -0.94 0.00 0.00 39.48 38.64 1mne n PHE 692 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1mne h PRO 693 N 5.27 1.13 -5.44 -1.08 0.13 -1.66 -3.41 132.00 126.94 1mne h PRO 693 Ca 0.21 -0.07 -0.61 0.00 -0.87 0.00 0.00 66.00 64.66 1mne h PRO 693 Cb 0.85 -0.25 -0.12 0.00 0.13 0.00 0.00 31.00 31.61 1mne h PRO 693 CO 0.50 0.76 -0.03 -0.80 -0.23 0.00 0.00 178.00 178.19 1mne s ASN 694 N -6.27 6.50 -0.35 1.44 0.02 -1.17 -4.83 114.94 110.27 1mne s ASN 694 Ca -0.12 0.60 -0.00 0.00 -1.02 0.00 0.00 52.86 52.31 1mne s ASN 694 Cb 0.18 -2.28 0.13 0.00 0.02 0.00 0.00 41.25 39.29 1mne s ASN 694 CO 0.80 -0.23 0.19 -0.13 0.02 0.00 0.00 177.10 177.75 1mne s ARG 695 N 1.96 0.62 0.07 -0.60 0.52 -1.26 0.13 118.95 120.39 1mne s ARG 695 Ca 0.22 -1.27 -0.10 0.00 -0.52 0.00 0.00 55.73 54.06 1mne s ARG 695 Cb -0.15 -1.51 -0.06 0.00 0.52 0.00 0.00 34.95 33.75 1mne s ARG 695 CO 0.09 -1.15 0.39 0.42 0.02 0.00 0.00 175.30 175.07 1mne s ILE 696 N 1.19 5.11 0.09 1.52 1.01 -0.33 -4.82 121.20 124.97 1mne s ILE 696 Ca 0.16 0.44 -0.31 0.00 0.00 0.00 0.00 60.65 60.93 1mne s ILE 696 Cb -0.21 -3.64 -0.08 0.00 0.01 0.00 0.00 42.46 38.53 1mne s ILE 696 CO -0.08 0.30 1.54 -0.63 0.00 0.00 0.00 174.94 176.07 1mne s ILE 697 N -1.38 3.09 0.19 2.92 -1.09 -1.26 0.20 121.20 123.86 1mne s ILE 697 Ca 0.32 0.66 -0.21 0.00 -2.23 0.00 0.00 60.65 59.20 1mne s ILE 697 Cb -0.14 -3.42 0.13 0.00 -1.58 0.00 0.00 42.46 37.45 1mne s ILE 697 CO 0.18 0.02 1.58 1.88 -1.23 0.00 0.00 174.94 177.37 1mne h TYR 698 N 7.55 -0.96 -0.89 3.97 -1.99 -1.78 -1.72 116.97 121.15 1mne h TYR 698 Ca -0.42 0.08 0.09 0.00 2.00 0.00 0.00 58.73 60.48 1mne h TYR 698 Cb 1.20 0.52 -0.06 0.00 2.00 0.00 0.00 36.73 40.38 1mne h TYR 698 CO 0.72 -0.39 0.58 0.00 -0.00 0.00 0.00 178.16 179.07 1mne h ALA 699 N 1.02 1.60 -0.57 3.88 0.00 -1.88 -2.40 119.26 120.92 1mne h ALA 699 Ca 0.24 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 1mne h ALA 699 Cb 0.56 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1mne h ALA 699 CO -0.72 0.23 -0.07 -0.44 0.00 0.00 0.00 179.25 178.25 1mne h ASP 700 N 0.92 1.05 0.05 0.00 3.45 -1.72 -2.70 116.42 117.48 1mne h ASP 700 Ca 0.40 -0.33 0.02 0.00 0.43 0.00 0.00 57.03 57.55 1mne h ASP 700 Cb 0.34 -0.28 -0.03 0.00 -0.56 0.00 0.00 39.33 38.80 1mne h ASP 700 CO -0.17 1.14 -0.15 0.15 -1.57 0.00 0.00 179.24 178.64 1mne h PHE 701 N 0.94 -0.39 -0.96 4.55 3.57 -0.98 -2.77 116.94 120.90 1mne h PHE 701 Ca 0.15 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.74 1mne h PHE 701 Cb 0.64 0.17 -0.07 0.00 2.79 0.00 0.00 35.95 39.48 1mne h PHE 701 CO 0.04 -0.22 0.62 0.28 -2.23 0.00 0.00 178.31 176.80 1mne h VAL 702 N -0.28 1.03 -0.65 1.41 2.07 -1.53 0.44 116.25 118.73 1mne h VAL 702 Ca 0.03 -0.36 0.09 0.00 0.82 0.00 0.00 66.70 67.28 1mne h VAL 702 Cb 0.31 -0.12 -0.07 0.00 -1.52 0.00 0.00 31.29 29.90 1mne h VAL 702 CO -0.11 0.19 0.29 0.50 0.02 0.00 0.00 177.57 178.46 1mne h LYS 703 N 1.05 0.49 0.09 1.57 3.11 -1.18 0.77 116.57 122.47 1mne h LYS 703 Ca 0.43 -0.03 -0.33 0.00 -2.81 0.00 0.00 60.65 57.91 1mne h LYS 703 Cb 0.28 -0.11 -0.02 0.00 -1.00 0.00 0.00 32.23 31.38 1mne h LYS 703 CO -0.18 0.33 -1.79 -0.09 -2.81 0.00 0.00 179.45 174.90 1mne h ARG 704 N 0.51 0.20 -0.02 1.90 2.43 -1.40 -3.38 114.38 114.62 1mne h ARG 704 Ca 0.32 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1mne h ARG 704 Cb 0.36 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1mne h ARG 704 CO -0.28 1.01 -0.34 0.66 -1.51 0.00 0.00 179.97 179.50 1mne n TYR 705 N -3.37 0.00 0.00 2.20 4.01 0.15 -4.47 117.16 115.68 1mne n TYR 705 Ca -0.24 0.00 0.21 0.00 -0.16 0.00 0.00 57.90 57.72 1mne n TYR 705 Cb 1.05 -0.01 0.71 0.00 -0.31 0.00 0.00 39.34 40.78 1mne n TYR 705 CO 0.00 0.00 0.00 0.10 -0.46 0.00 0.00 176.86 176.50 1mne h TYR 706 N 2.95 0.00 0.00 -0.72 -0.00 0.38 -2.27 116.97 117.32 1mne h TYR 706 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1mne h TYR 706 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.53 1mne h TYR 706 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 178.16 179.63 1mne n LEU 707 N -4.24 0.00 0.02 0.10 -0.00 -1.26 -3.85 117.00 107.77 1mne n LEU 707 Ca 0.10 0.15 -0.09 0.00 -0.00 0.00 0.00 56.01 56.17 1mne n LEU 707 Cb 0.64 -0.15 -0.13 0.00 -0.00 0.00 0.00 43.42 43.78 1mne n LEU 707 CO 0.35 -0.00 -0.23 -0.07 -0.00 0.00 0.00 177.39 177.44 1mne h LEU 708 N 0.00 0.05 -8.30 1.47 3.38 -1.65 -3.43 115.31 106.83 1mne h LEU 708 Ca 0.00 -0.08 -0.68 0.00 0.09 0.00 0.00 57.88 57.21 1mne h LEU 708 Cb 0.15 -0.02 -0.28 0.00 0.09 0.00 0.00 40.66 40.60 1mne h LEU 708 CO 0.00 1.06 -0.63 0.00 0.09 0.00 0.00 178.44 178.96 1mne s ALA 709 N -2.65 3.01 -0.41 1.53 0.00 -1.25 -4.87 121.76 117.12 1mne s ALA 709 Ca -0.03 -1.54 -0.27 0.00 0.00 0.00 0.00 51.96 50.11 1mne s ALA 709 Cb 0.09 -2.13 -0.07 0.00 0.00 0.00 0.00 23.12 21.01 1mne s ALA 709 CO 0.83 -1.04 2.36 -2.30 0.00 0.00 0.00 175.76 175.61 1mne n PRO 710 N 4.82 1.30 0.02 0.00 -0.02 -1.26 -3.50 135.00 136.36 1mne n PRO 710 Ca -0.14 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 1mne n PRO 710 Cb 0.47 -3.29 0.00 0.00 -0.02 0.00 0.00 33.50 30.66 1mne n PRO 710 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1mne n ASN 711 N 14.24 -0.31 -4.89 2.55 3.02 -1.26 -5.11 115.26 123.50 1mne n ASN 711 Ca 0.36 0.43 -0.24 0.00 -0.03 0.00 0.00 54.58 55.10 1mne n ASN 711 Cb 0.49 0.66 -0.04 0.00 -0.61 0.00 0.00 39.78 40.29 1mne n ASN 711 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1mne s VAL 712 N -1.80 4.92 0.05 2.41 1.01 -1.23 -5.13 120.40 120.64 1mne s VAL 712 Ca 0.00 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 60.96 1mne s VAL 712 Cb 0.00 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1mne s VAL 712 CO 0.00 -0.22 0.16 -2.16 0.00 0.00 0.00 175.10 172.87 1mne s PRO 713 N -3.56 3.24 0.14 2.72 0.04 -1.26 -4.79 135.00 131.53 1mne s PRO 713 Ca 0.33 -0.51 -0.17 0.00 0.04 0.00 0.00 61.00 60.69 1mne s PRO 713 Cb -0.09 -2.94 0.01 0.00 0.04 0.00 0.00 34.50 31.52 1mne s PRO 713 CO 0.27 0.61 1.78 0.00 0.04 0.00 0.00 177.00 179.69 1mne h ARG 714 N 3.29 0.34 -6.74 4.56 3.08 -1.91 -3.42 114.38 113.59 1mne h ARG 714 Ca -0.46 -0.02 -0.50 0.00 0.07 0.00 0.00 59.98 59.07 1mne h ARG 714 Cb 1.17 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.14 1mne h ARG 714 CO 0.71 0.23 0.04 0.16 -1.07 0.00 0.00 179.97 180.04 1mne s ASP 715 N -5.42 6.48 0.00 7.04 -4.77 -1.26 -4.13 116.67 114.61 1mne s ASP 715 Ca -0.13 0.99 0.00 0.00 -3.30 0.00 0.00 52.55 50.11 1mne s ASP 715 Cb 0.10 -2.26 0.00 0.00 -1.09 0.00 0.00 42.92 39.67 1mne s ASP 715 CO 0.71 -0.35 0.00 0.00 0.70 0.00 0.00 175.17 176.23 1mne n ALA 716 N -1.27 0.00 0.09 2.11 0.00 -1.26 -5.02 120.51 115.15 1mne n ALA 716 Ca 0.01 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.53 1mne n ALA 716 Cb 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.98 1mne n ALA 716 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1mne h GLU 717 N 0.00 0.00 -2.02 0.00 -0.00 -1.99 -3.37 114.58 107.20 1mne h GLU 717 Ca 0.00 0.00 -0.71 0.00 -0.00 0.00 0.00 59.36 58.65 1mne h GLU 717 Cb 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 28.75 28.50 1mne h GLU 717 CO 0.00 0.10 0.93 -3.47 -0.00 0.00 0.00 179.01 176.57 1mne n ASP 718 N -2.77 7.29 -0.22 3.06 -0.08 -1.26 -4.82 116.55 117.75 1mne n ASP 718 Ca -0.03 -3.67 0.01 0.00 -1.51 0.00 0.00 54.79 49.59 1mne n ASP 718 Cb 0.64 -1.12 0.10 0.00 2.34 0.00 0.00 41.12 43.08 1mne n ASP 718 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1mne h SER 719 N 3.09 -0.39 -0.98 1.67 0.02 -1.94 0.23 113.55 115.25 1mne h SER 719 Ca 0.53 0.17 0.05 0.00 -0.84 0.00 0.00 61.79 61.70 1mne h SER 719 Cb 0.20 0.33 -0.06 0.00 0.14 0.00 0.00 62.40 63.01 1mne h SER 719 CO 1.30 -0.16 0.64 1.56 -1.14 0.00 0.00 176.83 179.02 1mne h GLN 720 N 0.07 1.16 -0.62 3.45 4.20 -1.89 0.47 115.11 121.96 1mne h GLN 720 Ca 0.34 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.89 1mne h GLN 720 Cb 0.55 -0.26 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 1mne h GLN 720 CO -0.60 0.77 0.05 -0.22 -0.67 0.00 0.00 178.83 178.16 1mne h LYS 721 N 1.20 1.06 0.38 1.46 3.64 -1.02 -2.83 116.57 120.46 1mne h LYS 721 Ca 0.40 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1mne h LYS 721 Cb 0.07 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1mne h LYS 721 CO -0.14 1.01 -0.18 0.00 -2.27 0.00 0.00 179.45 177.87 1mne h ALA 722 N 1.01 -0.51 -1.36 5.00 0.00 -0.10 -1.83 119.26 121.46 1mne h ALA 722 Ca 0.18 -0.18 0.42 0.00 0.00 0.00 0.00 54.91 55.32 1mne h ALA 722 Cb 0.51 0.20 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 1mne h ALA 722 CO 0.02 -0.63 0.92 1.15 0.00 0.00 0.00 179.25 180.72 1mne h THR 723 N -0.83 0.22 0.12 0.00 2.02 -0.13 0.43 112.91 114.74 1mne h THR 723 Ca -0.05 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 1mne h THR 723 Cb 0.53 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 1mne h THR 723 CO 0.09 0.02 -0.06 -0.78 0.37 0.00 0.00 175.52 175.16 1mne h ASP 724 N 0.11 -0.14 -0.86 4.18 -0.00 -1.26 -2.55 116.42 115.90 1mne h ASP 724 Ca 0.76 -0.34 0.11 0.00 -0.00 0.00 0.00 57.03 57.57 1mne h ASP 724 Cb 2.55 0.04 -0.06 0.00 -0.00 0.00 0.00 39.33 41.85 1mne h ASP 724 CO -0.26 0.29 0.56 0.00 -0.00 0.00 0.00 179.24 179.83 1mne h ALA 725 N 0.19 1.74 0.23 -0.78 0.00 0.66 0.44 119.26 121.74 1mne h ALA 725 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1mne h ALA 725 Cb 0.47 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1mne h ALA 725 CO 0.03 0.06 -0.11 0.28 0.00 0.00 0.00 179.25 179.51 1mne h VAL 726 N 0.77 0.75 -1.14 0.00 2.07 -1.19 0.45 116.25 117.97 1mne h VAL 726 Ca 0.41 -0.91 0.33 0.00 0.82 0.00 0.00 66.70 67.35 1mne h VAL 726 Cb 0.53 1.20 -0.11 0.00 -1.52 0.00 0.00 31.29 31.39 1mne h VAL 726 CO -0.18 0.17 0.73 -0.07 0.02 0.00 0.00 177.57 178.24 1mne h LEU 727 N -0.83 0.37 -0.05 2.57 -0.00 -1.19 0.24 115.31 116.41 1mne h LEU 727 Ca -0.03 0.10 -0.06 0.00 -0.00 0.00 0.00 57.88 57.90 1mne h LEU 727 Cb 0.51 0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.23 1mne h LEU 727 CO 0.05 -0.02 -0.19 0.50 -0.00 0.00 0.00 178.44 178.79 1mne h LYS 728 N 0.28 0.22 -0.03 1.13 3.64 0.10 -0.85 116.57 121.05 1mne h LYS 728 Ca 0.68 -0.17 0.01 0.00 -1.27 0.00 0.00 60.65 59.90 1mne h LYS 728 Cb 1.89 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.73 1mne h LYS 728 CO -0.34 0.80 -0.11 1.25 -2.27 0.00 0.00 179.45 178.77 1mne h HIS 729 N -0.31 -0.33 -0.16 1.91 2.76 0.23 0.15 115.15 119.39 1mne h HIS 729 Ca -0.01 0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.22 1mne h HIS 729 Cb 0.82 0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.92 1mne h HIS 729 CO 0.13 -0.11 0.34 -0.07 -1.30 0.00 0.00 177.93 176.92 1mne h LEU 730 N -0.12 0.00 -1.64 0.26 3.38 -0.76 -3.46 115.31 112.98 1mne h LEU 730 Ca 0.01 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.77 1mne h LEU 730 Cb 0.14 0.00 0.10 0.00 0.09 0.00 0.00 40.66 40.99 1mne h LEU 730 CO -0.09 0.00 -0.46 -3.20 0.09 0.00 0.00 178.44 174.78 1mne n ASN 731 N -3.28 -2.46 -4.77 -0.43 4.05 0.04 -5.00 115.26 103.41 1mne n ASN 731 Ca 0.01 -0.37 -0.39 0.00 0.45 0.00 0.00 54.58 54.29 1mne n ASN 731 Cb 0.44 -3.34 -0.06 0.00 1.23 0.00 0.00 39.78 38.05 1mne n ASN 731 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1mne s ILE 732 N -3.22 4.20 -0.28 -1.44 1.01 -0.38 -4.99 121.20 116.09 1mne s ILE 732 Ca 0.06 1.88 -0.28 0.00 0.00 0.00 0.00 60.65 62.31 1mne s ILE 732 Cb -0.03 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 1mne s ILE 732 CO 0.45 0.36 2.03 -0.62 0.00 0.00 0.00 174.94 177.15 1mne s ASP 733 N -1.36 5.62 0.61 3.58 3.68 -1.26 -4.83 116.67 122.71 1mne s ASP 733 Ca 0.44 1.58 0.14 0.00 2.13 0.00 0.00 52.55 56.84 1mne s ASP 733 Cb -0.22 -2.52 0.50 0.00 -1.45 0.00 0.00 42.92 39.23 1mne s ASP 733 CO 0.27 -1.88 1.13 -2.65 0.13 0.00 0.00 175.17 172.17 1mne n PRO 734 N 8.62 0.02 0.21 4.34 -0.02 -1.26 0.29 135.00 147.20 1mne n PRO 734 Ca 0.27 0.96 0.10 0.00 -2.02 0.00 0.00 63.50 62.80 1mne n PRO 734 Cb 0.46 -2.46 0.23 0.00 -0.02 0.00 0.00 33.50 31.71 1mne n PRO 734 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1mne h GLU 735 N 0.00 0.00 0.00 -0.52 5.08 -2.03 -3.32 114.58 113.80 1mne h GLU 735 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1mne h GLU 735 Cb 2.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.69 1mne h GLU 735 CO -0.00 0.17 0.00 1.04 -1.00 0.00 0.00 179.01 179.22 1mne n GLN 736 N -3.17 0.05 -3.66 2.33 1.13 0.83 -4.87 117.38 110.01 1mne n GLN 736 Ca 0.03 0.09 -0.12 0.00 -1.94 0.00 0.00 57.00 55.06 1mne n GLN 736 Cb 0.55 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 29.34 1mne n GLN 736 CO 0.00 0.00 0.00 1.52 -1.44 0.00 0.00 177.06 177.14 1mne s TYR 737 N -2.94 -0.22 -0.02 1.08 -0.85 -1.25 0.42 117.35 113.58 1mne s TYR 737 Ca 0.13 0.04 0.04 0.00 -0.52 0.00 0.00 57.07 56.76 1mne s TYR 737 Cb 0.15 0.22 -0.01 0.00 0.38 0.00 0.00 41.96 42.71 1mne s TYR 737 CO 0.42 -0.63 -0.14 1.03 -1.52 0.00 0.00 175.55 174.72 1mne s ARG 738 N -3.13 1.17 -0.32 -3.49 1.81 0.20 -4.91 118.95 110.27 1mne s ARG 738 Ca -0.01 -0.48 -0.24 0.00 -1.72 0.00 0.00 55.73 53.28 1mne s ARG 738 Cb 0.01 -1.11 0.00 0.00 -0.45 0.00 0.00 34.95 33.40 1mne s ARG 738 CO -0.07 0.27 0.80 -0.06 -0.68 0.00 0.00 175.30 175.56 1mne s PHE 739 N -0.23 3.18 0.36 -0.53 0.40 -1.26 0.19 117.98 120.09 1mne s PHE 739 Ca 0.03 0.78 0.01 0.00 -0.60 0.00 0.00 56.93 57.15 1mne s PHE 739 Cb -0.06 -3.29 -0.02 0.00 0.51 0.00 0.00 43.02 40.15 1mne s PHE 739 CO -0.00 -0.62 0.56 0.20 0.70 0.00 0.00 175.22 176.06 1mne s GLY 740 N 1.68 1.41 0.35 4.36 0.00 0.26 -4.76 107.32 110.61 1mne s GLY 740 Ca 0.33 -1.02 0.03 0.00 0.00 0.00 0.00 44.72 44.06 1mne s GLY 740 CO 0.14 -0.94 2.01 -2.22 0.00 0.00 0.00 173.10 172.09 1mne h ILE 741 N 0.71 1.14 0.00 0.90 5.03 -1.89 -3.36 117.51 120.04 1mne h ILE 741 Ca -0.49 -0.29 -0.12 0.00 -0.12 0.00 0.00 64.86 63.85 1mne h ILE 741 Cb 1.23 0.23 -0.02 0.00 -3.03 0.00 0.00 36.82 35.23 1mne h ILE 741 CO 0.60 0.15 -1.42 0.41 -0.68 0.00 0.00 178.15 177.21 1mne n THR 742 N -4.45 0.42 -4.19 -0.27 -1.04 -1.26 -5.03 114.28 98.47 1mne n THR 742 Ca 0.07 -0.14 -0.29 0.00 -2.04 0.00 0.00 64.05 61.65 1mne n THR 742 Cb 0.07 -1.09 -0.08 0.00 -1.82 0.00 0.00 70.33 67.40 1mne n THR 742 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1mne s LYS 743 N -2.14 2.36 -0.13 -2.82 1.02 -1.26 -2.15 119.74 114.63 1mne s LYS 743 Ca -0.10 -1.00 -0.14 0.00 0.02 0.00 0.00 55.97 54.75 1mne s LYS 743 Cb 0.03 -2.40 -0.05 0.00 -0.52 0.00 0.00 37.83 34.90 1mne s LYS 743 CO 0.16 0.50 0.32 -1.50 -0.92 0.00 0.00 175.35 173.90 1mne s ILE 744 N -1.44 5.27 -0.22 2.17 -1.16 0.52 0.89 121.20 127.22 1mne s ILE 744 Ca 0.25 0.61 -0.14 0.00 -0.51 0.00 0.00 60.65 60.86 1mne s ILE 744 Cb -0.11 -3.64 -0.04 0.00 0.61 0.00 0.00 42.46 39.28 1mne s ILE 744 CO 0.17 0.44 0.31 -0.36 -2.81 0.00 0.00 174.94 172.69 1mne s PHE 745 N 0.08 3.33 0.10 3.50 0.40 0.50 -1.18 117.98 124.71 1mne s PHE 745 Ca 0.18 0.45 0.07 0.00 -0.60 0.00 0.00 56.93 57.04 1mne s PHE 745 Cb -0.14 -2.45 -0.04 0.00 0.51 0.00 0.00 43.02 40.91 1mne s PHE 745 CO 0.06 -0.02 -0.10 -0.06 0.70 0.00 0.00 175.22 175.80 1mne s PHE 746 N 1.34 2.74 0.44 0.36 0.08 0.35 0.62 117.98 123.91 1mne s PHE 746 Ca 0.15 -0.15 -0.04 0.00 0.12 0.00 0.00 56.93 57.00 1mne s PHE 746 Cb -0.14 -1.44 -0.04 0.00 -0.57 0.00 0.00 43.02 40.82 1mne s PHE 746 CO 0.07 0.42 0.73 1.03 -0.10 0.00 0.00 175.22 177.37 1mne s ARG 747 N -2.14 3.54 0.14 0.44 0.52 0.17 -2.78 118.95 118.84 1mne s ARG 747 Ca 0.21 0.09 -0.33 0.00 -0.52 0.00 0.00 55.73 55.18 1mne s ARG 747 Cb -0.11 -2.45 -0.13 0.00 0.52 0.00 0.00 34.95 32.78 1mne s ARG 747 CO 0.13 -0.11 1.65 0.00 0.02 0.00 0.00 175.30 177.00 1mne n ALA 748 N -2.07 1.59 0.00 2.13 0.00 -1.26 -1.68 120.51 119.21 1mne n ALA 748 Ca -0.01 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1mne n ALA 748 Cb 0.55 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.59 1mne n ALA 748 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mne n GLY 749 N 3.67 2.98 0.47 0.00 0.00 -0.87 -4.92 105.19 106.52 1mne n GLY 749 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 1mne n GLY 749 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1mne h GLN 750 N 1.04 -0.76 -0.65 1.61 5.75 -1.63 -2.29 115.11 118.18 1mne h GLN 750 Ca 0.00 0.05 0.11 0.00 -0.15 0.00 0.00 58.65 58.66 1mne h GLN 750 Cb 0.00 0.17 -0.08 0.00 1.07 0.00 0.00 27.48 28.64 1mne h GLN 750 CO 0.00 -0.50 0.23 1.25 -2.65 0.00 0.00 178.83 177.16 1mne h LEU 751 N -0.78 0.21 -1.50 -2.39 5.85 -1.92 -0.94 115.31 113.84 1mne h LEU 751 Ca -0.01 0.09 0.15 0.00 0.84 0.00 0.00 57.88 58.95 1mne h LEU 751 Cb 0.77 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.82 1mne h LEU 751 CO -0.23 0.11 0.52 0.00 -0.34 0.00 0.00 178.44 178.50 1mne h ALA 752 N 1.46 2.04 -0.00 1.25 0.00 -1.80 0.39 119.26 122.60 1mne h ALA 752 Ca 0.34 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 1mne h ALA 752 Cb 0.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1mne h ALA 752 CO -0.35 -0.25 -0.00 0.00 0.00 0.00 0.00 179.25 178.65 1mne h ARG 753 N 0.49 0.00 -0.42 0.00 -0.00 -0.76 -2.30 114.38 111.38 1mne h ARG 753 Ca 0.39 -0.00 0.09 0.00 -0.50 0.00 0.00 59.98 59.96 1mne h ARG 753 Cb 0.81 0.00 -0.09 0.00 0.00 0.00 0.00 29.97 30.69 1mne h ARG 753 CO -0.14 0.69 -0.25 0.82 0.00 0.00 0.00 179.97 181.09 1mne h ILE 754 N -0.69 0.33 0.00 2.04 2.04 -0.43 0.29 117.51 121.10 1mne h ILE 754 Ca -0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1mne h ILE 754 Cb 0.69 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1mne h ILE 754 CO 0.00 0.00 -0.01 -0.08 0.00 0.00 0.00 178.15 178.06 1mne h GLU 755 N -0.17 0.00 -0.27 2.37 4.57 -0.32 -1.03 114.58 119.74 1mne h GLU 755 Ca 0.20 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.38 1mne h GLU 755 Cb 0.48 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 1mne h GLU 755 CO -0.52 0.01 0.00 0.39 -1.18 0.00 0.00 179.01 177.71 1mne n GLU 756 N -3.79 1.56 -2.52 1.92 1.02 1.00 -4.92 120.64 114.91 1mne n GLU 756 Ca -0.03 -0.81 -0.23 0.00 -0.02 0.00 0.00 57.16 56.08 1mne n GLU 756 Cb 0.10 -1.21 0.04 0.00 -0.02 0.00 0.00 31.44 30.35 1mne n GLU 756 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1mne s ALA 757 N -1.69 3.64 0.44 0.62 0.00 -0.39 -5.02 121.76 119.35 1mne s ALA 757 Ca 0.15 -1.16 -0.00 0.00 0.00 0.00 0.00 51.96 50.95 1mne s ALA 757 Cb 0.08 -2.26 -0.01 0.00 0.00 0.00 0.00 23.12 20.93 1mne s ALA 757 CO 0.10 -0.89 0.66 1.03 0.00 0.00 0.00 175.76 176.66 1mne s ARG 758 N -4.90 3.17 0.00 0.00 0.52 -1.26 -5.09 118.95 111.38 1mne s ARG 758 Ca 0.57 -0.41 0.30 0.00 -0.52 0.00 0.00 55.73 55.67 1mne s ARG 758 Cb -0.10 -2.56 1.42 0.00 0.52 0.00 0.00 34.95 34.22 1mne s ARG 758 CO 0.41 -0.20 1.95 0.39 0.02 0.00 0.00 175.30 177.87