#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i4n n GLY 3 N 0.00 1.08 0.04 7.55 0.00 -1.26 -5.04 105.19 107.56 3i4n n GLY 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3i4n n GLY 3 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3i4n n GLN 4 N -1.62 0.00 -1.20 1.61 6.02 -1.26 -4.71 117.38 116.22 3i4n n GLN 4 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3i4n n GLN 4 Cb 0.00 -0.04 0.00 0.00 1.02 0.00 0.00 30.24 31.22 3i4n n GLN 4 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 3i4n n GLN 5 N -0.20 -3.40 -2.51 -1.09 7.27 -1.26 -4.95 117.38 111.23 3i4n n GLN 5 Ca 0.00 2.48 -0.36 0.00 0.07 0.00 0.00 57.00 59.20 3i4n n GLN 5 Cb 0.10 -2.76 -0.03 0.00 2.41 0.00 0.00 30.24 29.95 3i4n n GLN 5 CO 0.00 0.00 0.00 -0.47 0.07 0.00 0.00 177.06 176.66 3i4n s TYR 6 N -2.22 3.11 -0.02 3.69 5.04 -1.26 -5.06 117.35 120.63 3i4n s TYR 6 Ca 0.00 1.61 -0.00 0.00 -2.44 0.00 0.00 57.07 56.23 3i4n s TYR 6 Cb 0.00 -3.13 0.03 0.00 0.35 0.00 0.00 41.96 39.21 3i4n s TYR 6 CO 0.00 -0.80 0.04 -1.54 -1.34 0.00 0.00 175.55 171.91 3i4n s SER 7 N -1.71 0.05 0.00 4.32 1.04 -1.26 -4.99 113.70 111.14 3i4n s SER 7 Ca 0.62 0.06 0.08 0.00 0.48 0.00 0.00 55.95 57.19 3i4n s SER 7 Cb -0.20 -0.04 0.46 0.00 0.10 0.00 0.00 66.02 66.33 3i4n s SER 7 CO 0.25 -0.12 0.87 -1.54 0.98 0.00 0.00 173.24 173.67 3i4n n SER 8 N 4.11 0.00 -4.55 7.02 3.41 -1.26 -4.73 113.62 117.62 3i4n n SER 8 Ca -0.27 -0.42 -0.39 0.00 -0.26 0.00 0.00 58.87 57.53 3i4n n SER 8 Cb 0.51 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.42 3i4n n SER 8 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i4n n ALA 9 N -0.86 0.99 -1.46 7.33 0.00 -1.26 -4.88 120.51 120.36 3i4n n ALA 9 Ca 0.06 -0.69 -0.50 0.00 0.00 0.00 0.00 53.44 52.30 3i4n n ALA 9 Cb 0.03 -3.04 -0.04 0.00 0.00 0.00 0.00 19.45 16.39 3i4n n ALA 9 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3i4n n PRO 10 N 8.87 0.27 -4.45 0.00 -0.04 -1.26 -4.89 135.00 133.49 3i4n n PRO 10 Ca 0.38 0.09 -0.34 0.00 -0.04 0.00 0.00 63.50 63.59 3i4n n PRO 10 Cb 0.47 -1.31 -0.11 0.00 -0.04 0.00 0.00 33.50 32.51 3i4n n PRO 10 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3i4n s LEU 11 N 1.76 3.37 0.37 1.53 2.96 -1.26 -5.10 118.68 122.30 3i4n s LEU 11 Ca 0.71 0.02 -0.02 0.00 -0.22 0.00 0.00 54.13 54.62 3i4n s LEU 11 Cb -0.98 -1.77 0.01 0.00 0.50 0.00 0.00 46.19 43.95 3i4n s LEU 11 CO 0.56 0.32 0.52 -0.13 -1.32 0.00 0.00 176.35 176.30 3i4n s ARG 12 N -0.52 2.02 0.07 1.98 0.52 -1.26 -5.17 118.95 116.59 3i4n s ARG 12 Ca 0.08 -1.80 0.07 0.00 -0.52 0.00 0.00 55.73 53.56 3i4n s ARG 12 Cb -0.12 0.47 -0.04 0.00 0.52 0.00 0.00 34.95 35.78 3i4n s ARG 12 CO 0.02 -0.85 -0.13 0.95 0.02 0.00 0.00 175.30 175.31 3i4n s THR 13 N -2.81 3.17 0.14 0.02 -4.23 -1.26 -5.09 115.64 105.58 3i4n s THR 13 Ca 0.30 -1.18 -0.31 0.00 -1.18 0.00 0.00 61.69 59.31 3i4n s THR 13 Cb -0.01 -2.42 -0.09 0.00 1.34 0.00 0.00 72.50 71.33 3i4n s THR 13 CO 0.21 0.23 1.43 -0.69 -0.54 0.00 0.00 174.62 175.26 3i4n s VAL 14 N -1.07 3.10 -0.14 2.29 1.01 -1.26 -4.91 120.40 119.43 3i4n s VAL 14 Ca 0.18 0.81 -0.05 0.00 0.00 0.00 0.00 61.98 62.91 3i4n s VAL 14 Cb -0.11 -3.52 -0.06 0.00 0.00 0.00 0.00 36.38 32.69 3i4n s VAL 14 CO 0.09 0.07 -0.16 0.29 0.00 0.00 0.00 175.10 175.39 3i4n n LYS 15 N 3.78 0.30 -4.31 2.72 4.76 -1.26 -5.02 118.16 119.13 3i4n n LYS 15 Ca 0.11 0.12 -0.24 0.00 -2.87 0.00 0.00 58.31 55.43 3i4n n LYS 15 Cb 0.41 -1.04 -0.08 0.00 -1.84 0.00 0.00 35.03 32.48 3i4n n LYS 15 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3i4n s GLU 16 N -2.25 2.13 -0.10 1.97 2.02 -1.26 -4.07 118.70 117.14 3i4n s GLU 16 Ca -0.19 -1.62 -0.03 0.00 0.02 0.00 0.00 54.97 53.15 3i4n s GLU 16 Cb 0.07 -2.01 0.04 0.00 0.10 0.00 0.00 34.13 32.33 3i4n s GLU 16 CO 0.25 0.23 0.06 0.08 0.02 0.00 0.00 175.26 175.90 3i4n s VAL 17 N -2.45 0.03 -0.37 2.63 1.01 -0.97 -4.94 120.40 115.34 3i4n s VAL 17 Ca 0.34 0.10 -0.11 0.00 0.00 0.00 0.00 61.98 62.30 3i4n s VAL 17 Cb -0.03 -0.43 0.02 0.00 0.00 0.00 0.00 36.38 35.94 3i4n s VAL 17 CO 0.19 0.00 0.21 -1.10 0.00 0.00 0.00 175.10 174.41 3i4n s GLN 18 N 2.10 2.94 -0.15 2.72 -1.52 -1.26 -0.83 119.66 123.67 3i4n s GLN 18 Ca 0.03 -1.00 -0.20 0.00 -1.95 0.00 0.00 55.36 52.24 3i4n s GLN 18 Cb -0.14 -3.74 -0.03 0.00 -0.22 0.00 0.00 33.01 28.87 3i4n s GLN 18 CO -0.06 -0.66 0.56 -0.06 -0.25 0.00 0.00 175.29 174.82 3i4n s PHE 19 N 1.58 3.45 0.00 0.91 0.40 -0.80 -5.02 117.98 118.51 3i4n s PHE 19 Ca 0.03 0.92 0.00 0.00 -0.60 0.00 0.00 56.93 57.28 3i4n s PHE 19 Cb -0.19 -2.68 0.00 0.00 0.51 0.00 0.00 43.02 40.66 3i4n s PHE 19 CO 0.07 0.01 0.00 0.41 0.70 0.00 0.00 175.22 176.41 3i4n n GLY 20 N 3.53 5.40 2.93 4.36 0.00 -1.26 -3.61 105.19 116.54 3i4n n GLY 20 Ca -0.04 -1.39 -0.13 0.00 0.00 0.00 0.00 46.02 44.45 3i4n n GLY 20 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i4n s LEU 21 N 0.00 0.98 0.53 0.99 1.43 0.16 -4.26 118.68 118.51 3i4n s LEU 21 Ca 0.00 0.26 -0.21 0.00 -1.03 0.00 0.00 54.13 53.14 3i4n s LEU 21 Cb 0.00 0.33 -0.06 0.00 0.03 0.00 0.00 46.19 46.49 3i4n s LEU 21 CO 0.00 -0.12 1.20 0.49 0.23 0.00 0.00 176.35 178.16 3i4n n PHE 22 N 3.89 1.76 -3.73 0.29 3.01 -1.26 -4.70 117.46 116.72 3i4n n PHE 22 Ca -0.23 0.45 -0.36 0.00 1.01 0.00 0.00 57.45 58.33 3i4n n PHE 22 Cb 0.54 -2.29 -0.09 0.00 -0.01 0.00 0.00 39.48 37.62 3i4n n PHE 22 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3i4n s SER 23 N -0.95 6.00 0.55 4.37 1.04 -1.26 -4.92 113.70 118.54 3i4n s SER 23 Ca 0.71 0.11 0.00 0.00 0.48 0.00 0.00 55.95 57.25 3i4n s SER 23 Cb -0.44 -2.07 0.00 0.00 0.10 0.00 0.00 66.02 63.61 3i4n s SER 23 CO 0.50 0.10 0.90 -2.65 0.98 0.00 0.00 173.24 173.07 3i4n n PRO 24 N 4.07 0.02 -0.02 4.02 -0.02 -1.26 0.11 135.00 141.92 3i4n n PRO 24 Ca -0.15 0.79 -0.22 0.00 -2.02 0.00 0.00 63.50 61.90 3i4n n PRO 24 Cb 0.52 -2.43 -0.13 0.00 -0.02 0.00 0.00 33.50 31.44 3i4n n PRO 24 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3i4n h GLU 25 N 0.00 0.20 -0.23 -0.52 3.07 -1.97 -3.29 114.58 111.84 3i4n h GLU 25 Ca 0.00 -0.34 0.06 0.00 -0.50 0.00 0.00 59.36 58.58 3i4n h GLU 25 Cb 1.81 0.13 -0.07 0.00 -0.84 0.00 0.00 28.75 29.77 3i4n h GLU 25 CO 0.00 1.16 -0.29 1.49 -1.40 0.00 0.00 179.01 179.97 3i4n h GLU 26 N -0.29 -0.30 -1.46 2.33 4.81 0.36 1.43 114.58 121.46 3i4n h GLU 26 Ca -0.38 0.02 0.42 0.00 -0.13 0.00 0.00 59.36 59.30 3i4n h GLU 26 Cb 1.79 0.07 -0.06 0.00 0.63 0.00 0.00 28.75 31.18 3i4n h GLU 26 CO 0.01 -0.20 1.06 0.28 -0.73 0.00 0.00 179.01 179.43 3i4n h VAL 27 N -0.31 0.26 0.01 0.32 2.07 -1.57 0.29 116.25 117.32 3i4n h VAL 27 Ca 0.13 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.54 3i4n h VAL 27 Cb 0.51 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3i4n h VAL 27 CO -0.41 0.00 -0.61 0.03 0.02 0.00 0.00 177.57 176.60 3i4n h ARG 28 N 0.00 0.01 -0.19 1.57 3.08 0.15 -2.93 114.38 116.08 3i4n h ARG 28 Ca 0.69 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.77 3i4n h ARG 28 Cb 2.81 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 32.80 3i4n h ARG 28 CO -0.01 1.01 -0.37 0.00 -1.07 0.00 0.00 179.97 179.53 3i4n h ALA 29 N -0.21 -0.45 -0.83 0.04 0.00 0.37 -2.18 119.26 116.01 3i4n h ALA 29 Ca -0.16 0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.85 3i4n h ALA 29 Cb 1.17 0.72 -0.07 0.00 0.00 0.00 0.00 17.79 19.61 3i4n h ALA 29 CO -0.09 -0.85 0.48 0.82 0.00 0.00 0.00 179.25 179.62 3i4n h ILE 30 N -0.41 0.95 -3.78 0.00 2.04 -1.10 -3.45 117.51 111.75 3i4n h ILE 30 Ca 0.10 -0.29 -0.56 0.00 1.00 0.00 0.00 64.86 65.12 3i4n h ILE 30 Cb 0.58 0.04 0.13 0.00 -0.74 0.00 0.00 36.82 36.84 3i4n h ILE 30 CO -0.41 0.15 0.54 -0.24 0.00 0.00 0.00 178.15 178.19 3i4n n SER 31 N -4.71 2.64 -0.00 1.72 2.88 -0.82 -4.87 113.62 110.45 3i4n n SER 31 Ca 0.13 1.05 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 3i4n n SER 31 Cb 0.25 -1.54 -0.01 0.00 -0.75 0.00 0.00 64.21 62.16 3i4n n SER 31 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3i4n n VAL 32 N -0.56 0.01 -3.78 2.46 0.24 -1.15 -4.98 118.33 110.57 3i4n n VAL 32 Ca 0.08 -0.03 -0.36 0.00 -2.04 0.00 0.00 64.34 61.99 3i4n n VAL 32 Cb 0.42 0.23 -0.10 0.00 -1.47 0.00 0.00 33.84 32.92 3i4n n VAL 32 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i4n s ALA 33 N -2.06 3.47 0.20 2.33 0.00 -1.26 -4.80 121.76 119.64 3i4n s ALA 33 Ca -0.00 -0.89 0.08 0.00 0.00 0.00 0.00 51.96 51.15 3i4n s ALA 33 Cb 0.01 -2.17 0.08 0.00 0.00 0.00 0.00 23.12 21.03 3i4n s ALA 33 CO 0.04 -0.14 1.45 0.87 0.00 0.00 0.00 175.76 177.98 3i4n h LYS 34 N 7.41 0.02 -6.49 0.00 6.56 -1.86 -1.86 116.57 120.35 3i4n h LYS 34 Ca -0.38 -0.02 -0.38 0.00 -1.06 0.00 0.00 60.65 58.81 3i4n h LYS 34 Cb 1.17 0.01 0.01 0.00 -0.57 0.00 0.00 32.23 32.85 3i4n h LYS 34 CO 0.65 0.81 -1.10 -0.89 -2.06 0.00 0.00 179.45 176.87 3i4n n ILE 35 N -3.59 -4.47 -0.11 1.86 5.41 -1.24 -4.55 119.36 112.67 3i4n n ILE 35 Ca -0.01 0.10 -0.17 0.00 1.00 0.00 0.00 62.75 63.67 3i4n n ILE 35 Cb 0.77 -3.75 -0.06 0.00 -0.71 0.00 0.00 39.64 35.89 3i4n n ILE 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 3i4n n ARG 36 N -0.90 0.54 -1.37 0.38 1.74 -1.21 -4.77 116.66 111.07 3i4n n ARG 36 Ca -0.13 0.22 -0.33 0.00 -0.77 0.00 0.00 57.85 56.84 3i4n n ARG 36 Cb 0.67 -1.43 0.09 0.00 -1.02 0.00 0.00 32.46 30.77 3i4n n ARG 36 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3i4n s PHE 37 N -2.73 2.17 -0.16 -1.55 0.40 -1.26 -4.97 117.98 109.89 3i4n s PHE 37 Ca -0.32 1.62 0.14 0.00 -0.60 0.00 0.00 56.93 57.77 3i4n s PHE 37 Cb 0.08 -3.33 -0.20 0.00 0.51 0.00 0.00 43.02 40.08 3i4n s PHE 37 CO 0.44 -2.33 0.06 -0.35 0.70 0.00 0.00 175.22 173.74 3i4n n PRO 38 N -2.99 1.35 -1.64 0.24 -0.04 -1.26 -3.59 135.00 127.06 3i4n n PRO 38 Ca 0.12 -0.01 -0.39 0.00 -0.04 0.00 0.00 63.50 63.18 3i4n n PRO 38 Cb 0.51 -1.42 0.04 0.00 -0.04 0.00 0.00 33.50 32.60 3i4n n PRO 38 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3i4n n GLU 39 N -2.60 1.18 0.00 0.54 0.28 -1.26 -4.65 120.64 114.13 3i4n n GLU 39 Ca -0.26 0.44 0.00 0.00 -0.16 0.00 0.00 57.16 57.18 3i4n n GLU 39 Cb 1.02 -2.22 0.00 0.00 1.43 0.00 0.00 31.44 31.67 3i4n n GLU 39 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 3i4n n THR 40 N -1.27 0.00 0.00 3.84 -1.04 -1.26 -4.01 114.28 110.54 3i4n n THR 40 Ca 0.12 1.45 0.00 0.00 -2.04 0.00 0.00 64.05 63.57 3i4n n THR 40 Cb 0.45 -2.15 0.00 0.00 -1.82 0.00 0.00 70.33 66.81 3i4n n THR 40 CO 0.00 0.00 0.00 1.15 -0.64 0.00 0.00 175.07 175.58 3i4n n MET 41 N -2.41 0.00 -2.61 -2.82 0.00 -1.26 -4.17 117.12 103.84 3i4n n MET 41 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 57.70 57.66 3i4n n MET 41 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 33.22 33.19 3i4n n MET 41 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 3i4n n ASP 42 N 0.00 -2.63 -3.17 3.17 2.03 -1.15 -4.18 116.55 110.63 3i4n n ASP 42 Ca 0.00 1.37 -0.01 0.00 0.52 0.00 0.00 54.79 56.67 3i4n n ASP 42 Cb 0.00 -4.67 -0.00 0.00 -0.72 0.00 0.00 41.12 35.72 3i4n n ASP 42 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3i4n n GLU 43 N 1.87 0.00 -2.91 -0.67 1.02 0.77 -3.53 120.64 117.19 3i4n n GLU 43 Ca -0.30 -0.36 -0.10 0.00 -0.02 0.00 0.00 57.16 56.38 3i4n n GLU 43 Cb 0.46 -1.71 0.01 0.00 -0.02 0.00 0.00 31.44 30.19 3i4n n GLU 43 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 3i4n n THR 44 N 4.30-10.23 0.00 2.62 -1.04 -1.26 -3.04 114.28 105.63 3i4n n THR 44 Ca 0.01 0.98 0.00 0.00 -2.04 0.00 0.00 64.05 63.00 3i4n n THR 44 Cb 0.01 -6.69 0.00 0.00 -1.82 0.00 0.00 70.33 61.84 3i4n n THR 44 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i4n n GLN 45 N -0.04 0.00 -1.72 -2.82 6.02 -1.23 -4.90 117.38 112.70 3i4n n GLN 45 Ca 0.07 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.77 3i4n n GLN 45 Cb 0.40 -0.07 -0.04 0.00 1.02 0.00 0.00 30.24 31.54 3i4n n GLN 45 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3i4n s THR 46 N 0.00 3.13 -0.25 5.09 2.01 -1.17 -4.87 115.64 119.57 3i4n s THR 46 Ca 0.00 -0.01 -0.41 0.00 0.31 0.00 0.00 61.69 61.58 3i4n s THR 46 Cb 0.00 -3.32 -0.17 0.00 0.01 0.00 0.00 72.50 69.02 3i4n s THR 46 CO 0.00 -0.31 1.62 0.54 -0.69 0.00 0.00 174.62 175.78 3i4n n ARG 47 N 8.98 0.86 0.00 4.92 1.74 -1.26 -0.16 116.66 131.73 3i4n n ARG 47 Ca 0.37 0.31 0.00 0.00 -0.77 0.00 0.00 57.85 57.76 3i4n n ARG 47 Cb 0.50 -1.94 0.00 0.00 -1.02 0.00 0.00 32.46 30.00 3i4n n ARG 47 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3i4n n ALA 48 N 4.47 0.00 -3.71 7.54 0.00 -1.26 -4.81 120.51 122.73 3i4n n ALA 48 Ca 0.26 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.54 3i4n n ALA 48 Cb 0.10 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.39 3i4n n ALA 48 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3i4n s LYS 49 N -0.99 0.03 0.16 0.00 1.02 -1.26 -2.92 119.74 115.79 3i4n s LYS 49 Ca 0.00 0.41 -0.30 0.00 0.02 0.00 0.00 55.97 56.10 3i4n s LYS 49 Cb 0.00 -0.27 -0.08 0.00 -0.52 0.00 0.00 37.83 36.96 3i4n s LYS 49 CO 0.00 -0.24 1.26 0.42 -0.92 0.00 0.00 175.35 175.87 3i4n s ILE 50 N 1.69 3.47 -0.65 2.17 1.01 -1.26 -4.81 121.20 122.82 3i4n s ILE 50 Ca -0.03 1.17 -0.26 0.00 0.00 0.00 0.00 60.65 61.54 3i4n s ILE 50 Cb -0.12 -3.75 -0.23 0.00 0.01 0.00 0.00 42.46 38.37 3i4n s ILE 50 CO -0.05 0.16 1.85 0.61 0.00 0.00 0.00 174.94 177.51 3i4n n GLY 51 N 2.55 1.13 0.51 6.18 0.00 -1.26 -3.68 105.19 110.61 3i4n n GLY 51 Ca 0.06 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.25 3i4n n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4n n GLY 52 N 5.18 -0.42 3.57 -0.02 0.00 -1.26 -4.74 105.19 107.49 3i4n n GLY 52 Ca 0.46 0.09 -0.23 0.00 0.00 0.00 0.00 46.02 46.34 3i4n n GLY 52 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3i4n s LEU 53 N -2.76 2.92 0.00 0.99 0.20 -1.24 -3.30 118.68 115.49 3i4n s LEU 53 Ca 0.00 -0.83 0.00 0.00 0.69 0.00 0.00 54.13 53.99 3i4n s LEU 53 Cb 0.00 -1.43 0.00 0.00 -0.43 0.00 0.00 46.19 44.33 3i4n s LEU 53 CO 0.00 0.01 0.00 -0.46 -0.29 0.00 0.00 176.35 175.61 3i4n n ASN 54 N -0.78 -2.84 -0.25 3.68 0.23 -1.26 -4.30 115.26 109.74 3i4n n ASN 54 Ca -0.06 0.52 -0.01 0.00 -0.53 0.00 0.00 54.58 54.50 3i4n n ASN 54 Cb 0.60 -0.82 0.00 0.00 -2.08 0.00 0.00 39.78 37.47 3i4n n ASN 54 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 3i4n n ASP 55 N 1.81 -1.50 -0.83 0.53 2.03 -1.26 -4.76 116.55 112.57 3i4n n ASP 55 Ca 0.00 -0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.30 3i4n n ASP 55 Cb 0.00 -0.79 0.00 0.00 -0.72 0.00 0.00 41.12 39.61 3i4n n ASP 55 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 3i4n n PRO 56 N -1.07 0.88 0.00 -0.67 -0.02 -1.26 -4.33 135.00 128.53 3i4n n PRO 56 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 3i4n n PRO 56 Cb 0.51 -1.19 0.00 0.00 -0.02 0.00 0.00 33.50 32.80 3i4n n PRO 56 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3i4n n ARG 57 N 0.39 0.00 -0.31 -0.52 1.74 -1.26 -4.77 116.66 111.93 3i4n n ARG 57 Ca 0.00 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.04 3i4n n ARG 57 Cb 0.36 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 31.84 3i4n n ARG 57 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3i4n n LEU 58 N 0.00 0.00 0.00 0.55 4.77 -1.26 -4.03 117.00 117.03 3i4n n LEU 58 Ca 0.00 -0.10 -0.13 0.00 -0.03 0.00 0.00 56.01 55.75 3i4n n LEU 58 Cb 0.00 -0.31 0.12 0.00 -2.33 0.00 0.00 43.42 40.91 3i4n n LEU 58 CO 0.00 -1.66 0.14 0.61 -1.33 0.00 0.00 177.39 175.16 3i4n n GLY 59 N 0.49 -2.27 3.32 -0.72 0.00 -1.26 -4.66 105.19 100.09 3i4n n GLY 59 Ca 0.02 -0.74 -0.21 0.00 0.00 0.00 0.00 46.02 45.09 3i4n n GLY 59 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i4n n SER 60 N -2.05 -0.38 -4.58 1.61 3.41 -1.26 -4.35 113.62 106.02 3i4n n SER 60 Ca 0.06 -3.25 -0.30 0.00 -0.26 0.00 0.00 58.87 55.12 3i4n n SER 60 Cb 0.25 1.60 -0.09 0.00 -0.26 0.00 0.00 64.21 65.72 3i4n n SER 60 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3i4n s ILE 61 N -3.34 1.22 -0.93 -1.33 1.01 -1.26 -4.85 121.20 111.72 3i4n s ILE 61 Ca 0.37 -2.00 -0.03 0.00 0.00 0.00 0.00 60.65 58.99 3i4n s ILE 61 Cb 0.02 -2.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.03 3i4n s ILE 61 CO 0.27 0.00 0.80 -0.67 0.00 0.00 0.00 174.94 175.34 3i4n n ASP 62 N -1.17 -4.69 -2.87 3.58 -0.08 -1.26 -4.15 116.55 105.91 3i4n n ASP 62 Ca -0.12 -0.58 -0.05 0.00 -1.51 0.00 0.00 54.79 52.53 3i4n n ASP 62 Cb 0.67 -4.47 0.00 0.00 2.34 0.00 0.00 41.12 39.66 3i4n n ASP 62 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 3i4n n ARG 63 N -3.18 -0.36 -3.63 -0.67 1.85 -1.26 -4.88 116.66 104.52 3i4n n ARG 63 Ca -0.12 0.05 -0.25 0.00 -1.00 0.00 0.00 57.85 56.54 3i4n n ARG 63 Cb 0.62 -0.29 -0.17 0.00 -1.05 0.00 0.00 32.46 31.57 3i4n n ARG 63 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 3i4n s ASN 64 N -2.52 2.06 0.02 2.89 0.01 -1.26 -5.04 114.94 111.10 3i4n s ASN 64 Ca 0.01 -0.44 -0.04 0.00 -0.71 0.00 0.00 52.86 51.68 3i4n s ASN 64 Cb -0.01 -0.24 -0.01 0.00 0.41 0.00 0.00 41.25 41.41 3i4n s ASN 64 CO 0.16 -0.32 0.51 0.18 -1.51 0.00 0.00 177.10 176.12 3i4n n LEU 65 N 5.27 -0.14 -2.79 0.60 4.77 -1.26 -4.50 117.00 118.95 3i4n n LEU 65 Ca -0.06 0.55 -0.33 0.00 -0.03 0.00 0.00 56.01 56.13 3i4n n LEU 65 Cb 0.49 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.36 3i4n n LEU 65 CO 0.09 -0.35 0.16 0.29 -1.33 0.00 0.00 177.39 176.25 3i4n n LYS 66 N -3.09 0.00 0.00 3.23 5.02 -1.26 -3.78 118.16 118.28 3i4n n LYS 66 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3i4n n LYS 66 Cb 0.04 -0.77 0.00 0.00 -0.02 0.00 0.00 35.03 34.27 3i4n n LYS 66 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i4n n GLN 68 N 0.00 -4.82 0.00 0.00 6.02 -1.26 -3.23 117.38 114.09 3i4n n GLN 68 Ca 0.00 0.55 0.00 0.00 -0.01 0.00 0.00 57.00 57.54 3i4n n GLN 68 Cb 0.00 -4.73 0.00 0.00 1.02 0.00 0.00 30.24 26.53 3i4n n GLN 68 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 3i4n n THR 69 N -3.61 0.00 0.32 5.09 -1.04 -1.26 -4.41 114.28 109.38 3i4n n THR 69 Ca -0.09 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 61.94 3i4n n THR 69 Cb 0.58 0.00 0.11 0.00 -1.82 0.00 0.00 70.33 69.20 3i4n n THR 69 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i4n n GLN 71 N -2.52 0.00 -0.08 0.00 10.64 -1.25 -4.76 117.38 119.41 3i4n n GLN 71 Ca -0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 3i4n n GLN 71 Cb 0.90 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.28 3i4n n GLN 71 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 3i4n n GLU 72 N 8.81 0.00 -1.73 2.61 -0.58 -1.26 -4.49 120.64 124.00 3i4n n GLU 72 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3i4n n GLU 72 Cb 0.00 -3.16 0.00 0.00 -0.57 0.00 0.00 31.44 27.71 3i4n n GLU 72 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i4n n GLY 73 N -2.00 -2.25 3.88 0.62 0.00 -1.25 -4.47 105.19 99.71 3i4n n GLY 73 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3i4n n GLY 73 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3i4n n MET 74 N 1.12 0.00 -1.56 1.61 2.81 -1.26 -4.17 117.12 115.67 3i4n n MET 74 Ca 0.00 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.47 3i4n n MET 74 Cb 0.00 0.00 -0.04 0.00 -0.71 0.00 0.00 33.22 32.47 3i4n n MET 74 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3i4n n ASN 75 N 1.54 2.70 0.00 7.83 2.85 -1.26 -2.36 115.26 126.56 3i4n n ASN 75 Ca 0.00 0.02 0.00 0.00 -0.11 0.00 0.00 54.58 54.49 3i4n n ASN 75 Cb 0.00 -1.50 0.00 0.00 1.24 0.00 0.00 39.78 39.52 3i4n n ASN 75 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 3i4n n GLU 76 N 8.74 0.00 -1.97 1.20 4.07 -1.26 -4.97 120.64 126.45 3i4n n GLU 76 Ca 0.35 0.00 -0.26 0.00 -0.06 0.00 0.00 57.16 57.19 3i4n n GLU 76 Cb 0.43 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.76 3i4n n GLU 76 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3i4n n PRO 78 N 8.88 -1.83 -1.62 0.00 -0.04 -1.26 -4.85 135.00 134.27 3i4n n PRO 78 Ca 0.40 -0.07 -0.36 0.00 -0.04 0.00 0.00 63.50 63.43 3i4n n PRO 78 Cb 0.47 -0.08 0.08 0.00 -0.04 0.00 0.00 33.50 33.92 3i4n n PRO 78 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3i4n s GLY 79 N -2.21 2.64 -0.32 0.55 0.00 -1.26 -4.77 107.32 101.95 3i4n s GLY 79 Ca 0.03 1.07 0.02 0.00 0.00 0.00 0.00 44.72 45.85 3i4n s GLY 79 CO 0.03 1.49 0.04 0.30 0.00 0.00 0.00 173.10 174.96 3i4n s HIS 80 N -1.64 3.08 0.32 1.90 3.76 -1.26 -4.91 115.29 116.53 3i4n s HIS 80 Ca 0.79 -2.53 -0.29 0.00 -0.15 0.00 0.00 55.06 52.88 3i4n s HIS 80 Cb -0.34 -2.43 -0.11 0.00 1.11 0.00 0.00 32.58 30.81 3i4n s HIS 80 CO 0.42 -0.91 1.50 -0.06 -0.85 0.00 0.00 174.74 174.83 3i4n s PHE 81 N 1.14 2.76 0.46 1.40 0.40 -1.26 -4.24 117.98 118.65 3i4n s PHE 81 Ca 0.08 1.03 0.01 0.00 -0.60 0.00 0.00 56.93 57.44 3i4n s PHE 81 Cb -0.19 -3.97 0.01 0.00 0.51 0.00 0.00 43.02 39.38 3i4n s PHE 81 CO -0.12 -3.05 0.06 0.41 0.70 0.00 0.00 175.22 173.22 3i4n n GLY 82 N 1.40 3.49 3.05 4.36 0.00 -0.86 -2.95 105.19 113.68 3i4n n GLY 82 Ca 0.04 -2.34 -0.21 0.00 0.00 0.00 0.00 46.02 43.51 3i4n n GLY 82 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3i4n n HIS 83 N -1.22 -0.34 -3.02 1.61 1.44 -0.70 0.13 115.22 113.13 3i4n n HIS 83 Ca -0.16 -2.53 0.02 0.00 -2.01 0.00 0.00 57.72 53.04 3i4n n HIS 83 Cb 0.57 0.15 -0.00 0.00 0.12 0.00 0.00 29.99 30.83 3i4n n HIS 83 CO 0.00 0.00 0.00 -1.50 -2.81 0.00 0.00 176.34 172.03 3i4n s ILE 84 N -3.13 -0.55 -0.44 0.61 2.07 -0.79 -3.95 121.20 115.02 3i4n s ILE 84 Ca 0.29 0.00 -0.42 0.00 -1.41 0.00 0.00 60.65 59.11 3i4n s ILE 84 Cb 0.01 -0.17 -0.17 0.00 0.13 0.00 0.00 42.46 42.27 3i4n s ILE 84 CO 0.20 0.00 1.99 0.47 -1.91 0.00 0.00 174.94 175.69 3i4n n ASP 85 N 4.38 1.35 -3.20 4.50 8.00 -1.26 -3.02 116.55 127.29 3i4n n ASP 85 Ca 0.08 0.78 -0.18 0.00 0.71 0.00 0.00 54.79 56.18 3i4n n ASP 85 Cb 0.59 -1.00 0.17 0.00 -0.02 0.00 0.00 41.12 40.86 3i4n n ASP 85 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3i4n n LEU 86 N 6.98 0.00 -0.10 0.64 4.77 -0.78 -4.93 117.00 123.58 3i4n n LEU 86 Ca 0.43 -0.51 -0.14 0.00 -0.03 0.00 0.00 56.01 55.76 3i4n n LEU 86 Cb 0.03 -0.63 -0.05 0.00 -2.33 0.00 0.00 43.42 40.44 3i4n n LEU 86 CO 0.85 -2.32 -0.76 0.00 -1.33 0.00 0.00 177.39 173.83 3i4n n ALA 87 N -4.52 0.84 -2.94 -1.18 0.00 -1.26 -5.00 120.51 106.44 3i4n n ALA 87 Ca -0.11 -0.75 -0.10 0.00 0.00 0.00 0.00 53.44 52.47 3i4n n ALA 87 Cb 0.35 -0.02 -0.12 0.00 0.00 0.00 0.00 19.45 19.66 3i4n n ALA 87 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3i4n s LYS 88 N -2.60 0.23 0.18 0.00 1.02 -1.26 -5.01 119.74 112.30 3i4n s LYS 88 Ca -0.28 -0.44 -0.31 0.00 0.02 0.00 0.00 55.97 54.96 3i4n s LYS 88 Cb 0.06 0.07 -0.16 0.00 -0.52 0.00 0.00 37.83 37.28 3i4n s LYS 88 CO 0.41 -0.03 0.95 -0.35 -0.92 0.00 0.00 175.35 175.41 3i4n n PRO 89 N 2.02 0.76 -4.22 -1.68 -0.04 -1.26 -4.97 135.00 125.60 3i4n n PRO 89 Ca -0.21 0.27 -0.20 0.00 -0.04 0.00 0.00 63.50 63.32 3i4n n PRO 89 Cb 0.56 -1.61 -0.12 0.00 -0.04 0.00 0.00 33.50 32.29 3i4n n PRO 89 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3i4n s VAL 90 N -0.56 1.38 0.38 0.52 1.01 -1.01 -4.61 120.40 117.51 3i4n s VAL 90 Ca 0.70 -1.45 -0.25 0.00 0.00 0.00 0.00 61.98 60.98 3i4n s VAL 90 Cb -0.89 -1.32 -0.09 0.00 0.00 0.00 0.00 36.38 34.08 3i4n s VAL 90 CO 0.55 -0.18 1.08 -0.36 0.00 0.00 0.00 175.10 176.19 3i4n s PHE 91 N -1.34 3.29 -0.69 5.22 0.08 -1.26 -1.25 117.98 122.03 3i4n s PHE 91 Ca 0.03 1.64 -0.25 0.00 0.12 0.00 0.00 56.93 58.47 3i4n s PHE 91 Cb -0.09 -3.21 0.05 0.00 -0.57 0.00 0.00 43.02 39.19 3i4n s PHE 91 CO 0.03 -0.76 1.12 -1.58 -0.10 0.00 0.00 175.22 173.94 3i4n s HIS 92 N -1.51 2.48 0.04 0.36 5.65 -1.18 -4.79 115.29 116.34 3i4n s HIS 92 Ca 0.55 -0.27 0.01 0.00 0.25 0.00 0.00 55.06 55.60 3i4n s HIS 92 Cb -0.26 -4.46 0.11 0.00 -1.18 0.00 0.00 32.58 26.79 3i4n s HIS 92 CO 0.33 -1.85 0.18 0.28 -0.65 0.00 0.00 174.74 173.02 3i4n n VAL 93 N 6.17 -0.05 0.05 0.89 0.31 -1.26 0.14 118.33 124.58 3i4n n VAL 93 Ca -0.00 0.24 -0.07 0.00 -0.01 0.00 0.00 64.34 64.50 3i4n n VAL 93 Cb 0.47 -0.37 -0.12 0.00 -0.91 0.00 0.00 33.84 32.91 3i4n n VAL 93 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3i4n h GLY 94 N 0.00 0.01 1.54 2.92 0.00 -1.91 -3.35 103.07 102.27 3i4n h GLY 94 Ca 0.08 -0.02 -0.27 0.00 0.00 0.00 0.00 47.33 47.12 3i4n h GLY 94 CO -0.10 0.01 -1.32 0.74 0.00 0.00 0.00 176.54 175.88 3i4n h PHE 95 N 0.00 0.34 -0.02 5.60 0.05 0.90 -3.39 116.94 120.41 3i4n h PHE 95 Ca -0.05 -0.25 0.00 0.00 3.82 0.00 0.00 57.97 61.50 3i4n h PHE 95 Cb 1.81 -0.01 -0.00 0.00 2.00 0.00 0.00 35.95 39.74 3i4n h PHE 95 CO 0.00 1.23 -0.01 -0.89 -0.18 0.00 0.00 178.31 178.46 3i4n n ILE 96 N -3.43 -0.01 -0.30 -0.55 5.41 -0.83 0.18 119.36 119.83 3i4n n ILE 96 Ca -0.10 0.04 0.12 0.00 1.00 0.00 0.00 62.75 63.81 3i4n n ILE 96 Cb 1.01 -0.05 0.27 0.00 -0.71 0.00 0.00 39.64 40.17 3i4n n ILE 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4n h ALA 97 N 0.01 1.19 0.00 -1.39 0.00 -1.85 0.28 119.26 117.51 3i4n h ALA 97 Ca 0.00 0.24 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 3i4n h ALA 97 Cb 0.01 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3i4n h ALA 97 CO -0.02 -0.47 -0.64 -0.22 0.00 0.00 0.00 179.25 177.90 3i4n h LYS 98 N 0.17 0.00 -0.57 0.00 3.64 0.15 -2.09 116.57 117.87 3i4n h LYS 98 Ca 0.54 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.83 3i4n h LYS 98 Cb 1.07 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.87 3i4n h LYS 98 CO -0.68 0.64 0.02 0.82 -2.27 0.00 0.00 179.45 177.97 3i4n h ILE 99 N 0.00 1.26 0.34 2.00 2.04 0.02 0.12 117.51 123.28 3i4n h ILE 99 Ca -0.01 -1.08 -0.02 0.00 1.00 0.00 0.00 64.86 64.75 3i4n h ILE 99 Cb 1.44 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 3i4n h ILE 99 CO 0.08 0.39 -0.16 0.50 0.00 0.00 0.00 178.15 178.96 3i4n h LYS 100 N 0.90 -0.44 0.00 2.37 3.64 -1.09 -2.59 116.57 119.37 3i4n h LYS 100 Ca 0.17 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3i4n h LYS 100 Cb 0.50 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 3i4n h LYS 100 CO 0.02 -0.15 0.10 0.87 -2.27 0.00 0.00 179.45 178.02 3i4n h LYS 101 N -0.70 0.00 0.15 1.90 1.57 -1.06 -0.36 116.57 118.07 3i4n h LYS 101 Ca -0.05 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.41 3i4n h LYS 101 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 3i4n h LYS 101 CO 0.08 0.00 -1.64 0.28 -0.57 0.00 0.00 179.45 177.60 3i4n h VAL 102 N 0.00 0.93 -0.21 0.50 2.07 -0.56 -3.24 116.25 115.73 3i4n h VAL 102 Ca 0.00 -2.43 -0.00 0.00 0.82 0.00 0.00 66.70 65.08 3i4n h VAL 102 Cb 0.19 2.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.65 3i4n h VAL 102 CO 0.00 0.79 0.13 0.00 0.02 0.00 0.00 177.57 178.51 3i4n h GLU 104 N 0.26 0.00 0.00 0.00 5.08 -1.23 0.37 114.58 119.06 3i4n h GLU 104 Ca 0.08 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.29 3i4n h GLU 104 Cb 0.02 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 3i4n h GLU 104 CO -0.01 0.00 -2.12 0.00 -1.00 0.00 0.00 179.01 175.88 3i4n s VAL 106 N -3.05 1.74 0.17 0.00 1.01 0.12 -3.95 120.40 116.45 3i4n s VAL 106 Ca -0.09 -1.71 -0.13 0.00 0.00 0.00 0.00 61.98 60.06 3i4n s VAL 106 Cb 0.10 -1.68 -0.07 0.00 0.00 0.00 0.00 36.38 34.74 3i4n s VAL 106 CO 0.84 -0.18 0.55 0.00 0.00 0.00 0.00 175.10 176.31 3i4n n MET 108 N 0.51 -0.42 0.00 0.00 0.00 -1.26 -2.22 117.12 113.73 3i4n n MET 108 Ca -0.04 -0.29 0.00 0.00 0.00 0.00 0.00 57.70 57.37 3i4n n MET 108 Cb 0.52 -0.21 0.00 0.00 0.00 0.00 0.00 33.22 33.53 3i4n n MET 108 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 3i4n n HIS 109 N -2.39 0.00 -0.09 2.03 8.25 -1.26 -3.95 115.22 117.81 3i4n n HIS 109 Ca 0.02 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.32 3i4n n HIS 109 Cb 0.09 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.13 3i4n n HIS 109 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3i4n n GLY 111 N 2.15 0.99 3.59 0.00 0.00 -0.94 -4.60 105.19 106.37 3i4n n GLY 111 Ca -0.34 -0.42 -0.25 0.00 0.00 0.00 0.00 46.02 45.01 3i4n n GLY 111 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3i4n s LYS 112 N -2.91 1.96 1.16 1.61 2.20 -1.26 -2.84 119.74 119.66 3i4n s LYS 112 Ca 0.00 -1.84 -0.17 0.00 -0.36 0.00 0.00 55.97 53.59 3i4n s LYS 112 Cb 0.00 -1.82 0.21 0.00 -1.51 0.00 0.00 37.83 34.71 3i4n s LYS 112 CO 0.00 0.13 0.41 1.28 -0.36 0.00 0.00 175.35 176.81 3i4n n LEU 113 N -0.88 -1.50 0.00 5.43 4.77 -1.26 -3.12 117.00 120.44 3i4n n LEU 113 Ca -0.05 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.54 3i4n n LEU 113 Cb 0.63 -0.92 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 3i4n n LEU 113 CO 0.43 -3.50 0.38 0.18 -1.33 0.00 0.00 177.39 173.56 3i4n n LEU 114 N -2.72 1.28 -3.27 2.23 4.77 -1.25 -4.64 117.00 113.39 3i4n n LEU 114 Ca 0.05 -1.28 -0.07 0.00 -0.03 0.00 0.00 56.01 54.69 3i4n n LEU 114 Cb 0.51 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.55 3i4n n LEU 114 CO 0.39 0.32 -0.02 -0.76 -1.33 0.00 0.00 177.39 175.99 3i4n s LEU 115 N -0.58 -0.90 0.73 2.23 1.43 -1.26 -4.95 118.68 115.38 3i4n s LEU 115 Ca 0.00 -0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 52.12 3i4n s LEU 115 Cb 0.00 1.33 0.03 0.00 0.03 0.00 0.00 46.19 47.58 3i4n s LEU 115 CO 0.00 -0.25 1.12 -1.81 0.23 0.00 0.00 176.35 175.64 3i4n s ASP 116 N 1.96 5.21 0.65 2.29 1.01 -1.26 -4.83 116.67 121.70 3i4n s ASP 116 Ca 0.14 1.04 0.21 0.00 0.71 0.00 0.00 52.55 54.66 3i4n s ASP 116 Cb -0.10 -1.76 1.14 0.00 1.01 0.00 0.00 42.92 43.21 3i4n s ASP 116 CO -0.13 -1.48 1.64 -0.33 0.21 0.00 0.00 175.17 175.08 3i4n h GLU 117 N -0.76 0.00 -1.03 8.23 3.07 -1.96 0.69 114.58 122.81 3i4n h GLU 117 Ca -0.45 0.00 0.26 0.00 -0.50 0.00 0.00 59.36 58.67 3i4n h GLU 117 Cb 1.27 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 29.09 3i4n h GLU 117 CO 0.64 0.00 0.66 0.45 -1.40 0.00 0.00 179.01 179.37 3i4n h HIS 118 N 0.00 0.67 -3.08 4.33 3.86 -2.01 -3.04 115.15 115.89 3i4n h HIS 118 Ca 0.00 0.02 -0.73 0.00 -1.16 0.00 0.00 60.37 58.50 3i4n h HIS 118 Cb 1.04 -0.20 -0.22 0.00 1.06 0.00 0.00 27.41 29.10 3i4n h HIS 118 CO 0.00 0.07 0.13 1.21 0.86 0.00 0.00 177.93 180.19 3i4n s ASN 119 N -5.28 6.36 0.16 2.45 3.84 0.24 -4.84 114.94 117.87 3i4n s ASN 119 Ca -0.09 -1.84 -0.11 0.00 0.21 0.00 0.00 52.86 51.03 3i4n s ASN 119 Cb 0.25 -2.28 0.18 0.00 -0.55 0.00 0.00 41.25 38.86 3i4n s ASN 119 CO 0.80 -0.95 1.04 1.21 -2.79 0.00 0.00 177.10 176.41 3i4n n GLU 120 N 5.64 -0.14 -0.10 0.43 2.13 -1.15 0.12 120.64 127.58 3i4n n GLU 120 Ca -0.02 1.03 0.26 0.00 0.66 0.00 0.00 57.16 59.10 3i4n n GLU 120 Cb 0.44 -1.53 0.67 0.00 0.27 0.00 0.00 31.44 31.28 3i4n n GLU 120 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 3i4n h LEU 121 N 0.00 0.00 -0.18 4.31 3.38 -1.92 0.57 115.31 121.47 3i4n h LEU 121 Ca 0.25 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 3i4n h LEU 121 Cb 0.41 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3i4n h LEU 121 CO -0.67 0.00 -0.26 -0.03 0.09 0.00 0.00 178.44 177.57 3i4n h MET 122 N 0.00 0.48 -0.17 1.13 4.05 0.62 -3.21 114.93 117.83 3i4n h MET 122 Ca 0.37 -0.29 0.05 0.00 -0.28 0.00 0.00 59.70 59.56 3i4n h MET 122 Cb 1.88 0.03 -0.06 0.00 -0.80 0.00 0.00 31.60 32.65 3i4n h MET 122 CO -0.00 0.88 -0.24 0.00 0.23 0.00 0.00 176.91 177.78 3i4n h ARG 123 N 0.13 -0.27 -0.93 0.39 3.08 0.09 0.15 114.38 117.02 3i4n h ARG 123 Ca 0.02 0.02 0.29 0.00 0.07 0.00 0.00 59.98 60.37 3i4n h ARG 123 Cb 0.83 0.06 -0.17 0.00 0.08 0.00 0.00 29.97 30.77 3i4n h ARG 123 CO 0.06 -0.18 0.13 1.04 -1.07 0.00 0.00 179.97 179.95 3i4n n GLN 124 N -5.37 -0.07 0.02 0.04 6.02 -1.04 0.10 117.38 117.08 3i4n n GLN 124 Ca -0.02 1.37 -0.19 0.00 -0.01 0.00 0.00 57.00 58.15 3i4n n GLN 124 Cb 0.28 -2.23 -0.10 0.00 1.02 0.00 0.00 30.24 29.21 3i4n n GLN 124 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3i4n h ALA 125 N 1.86 0.12 0.00 -1.58 0.00 -1.03 -3.16 119.26 115.46 3i4n h ALA 125 Ca 0.61 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3i4n h ALA 125 Cb 1.37 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.20 3i4n h ALA 125 CO -0.84 0.56 0.00 1.28 0.00 0.00 0.00 179.25 180.26 3i4n n LEU 126 N -4.00 0.18 0.00 0.00 4.77 0.28 -1.06 117.00 117.17 3i4n n LEU 126 Ca -0.10 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 3i4n n LEU 126 Cb 0.79 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 3i4n n LEU 126 CO 0.52 0.04 -0.27 0.00 -1.33 0.00 0.00 177.39 176.36 3i4n n ALA 127 N -0.01 1.45 -1.50 -1.18 0.00 -0.90 -4.92 120.51 113.45 3i4n n ALA 127 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 3i4n n ALA 127 Cb 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.39 3i4n n ALA 127 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3i4n n ILE 128 N -1.00 0.45 -1.44 0.00 5.41 -0.22 -4.83 119.36 117.74 3i4n n ILE 128 Ca 0.00 -0.46 -0.49 0.00 1.00 0.00 0.00 62.75 62.81 3i4n n ILE 128 Cb 0.00 -2.05 -0.08 0.00 -0.71 0.00 0.00 39.64 36.80 3i4n n ILE 128 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 3i4n n LYS 129 N 8.10 0.78 0.00 0.38 5.02 -1.26 -4.12 118.16 127.06 3i4n n LYS 129 Ca 0.43 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.90 3i4n n LYS 129 Cb 0.46 -2.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.15 3i4n n LYS 129 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3i4n n ASP 130 N 10.40 0.00 -0.21 4.39 -0.08 -1.26 -4.94 116.55 124.84 3i4n n ASP 130 Ca 0.46 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.74 3i4n n ASP 130 Cb 0.21 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.67 3i4n n ASP 130 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3i4n n SER 131 N 0.00 0.03 0.05 1.67 3.41 -1.26 -1.34 113.62 116.18 3i4n n SER 131 Ca 0.00 -0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 3i4n n SER 131 Cb 0.00 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 3i4n n SER 131 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3i4n n LYS 132 N -0.09 0.00 0.24 4.33 5.02 -1.26 -4.26 118.16 122.14 3i4n n LYS 132 Ca 0.00 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.39 3i4n n LYS 132 Cb 0.01 -0.20 0.59 0.00 -0.02 0.00 0.00 35.03 35.40 3i4n n LYS 132 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 3i4n h LYS 133 N 0.00 0.00 0.43 1.97 1.57 -1.86 -1.77 116.57 116.91 3i4n h LYS 133 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3i4n h LYS 133 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3i4n h LYS 133 CO 0.00 0.20 -0.21 -0.09 -0.57 0.00 0.00 179.45 178.78 3i4n h ARG 134 N 0.00 -0.56 0.00 3.15 2.43 -1.36 -1.96 114.38 116.08 3i4n h ARG 134 Ca -0.00 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3i4n h ARG 134 Cb 0.49 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 3i4n h ARG 134 CO 0.03 -0.37 0.29 0.34 -1.51 0.00 0.00 179.97 178.75 3i4n n PHE 135 N -4.58 0.12 -0.01 2.20 7.35 -1.08 0.88 117.46 122.34 3i4n n PHE 135 Ca -0.07 0.06 -0.21 0.00 -0.76 0.00 0.00 57.45 56.47 3i4n n PHE 135 Cb 0.23 -0.35 -0.13 0.00 0.35 0.00 0.00 39.48 39.57 3i4n n PHE 135 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3i4n h ALA 136 N 0.99 0.21 -0.11 3.13 0.00 -0.97 -3.12 119.26 119.39 3i4n h ALA 136 Ca 0.00 -1.11 -0.05 0.00 0.00 0.00 0.00 54.91 53.75 3i4n h ALA 136 Cb 0.59 0.52 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3i4n h ALA 136 CO 0.00 0.82 -0.12 0.00 0.00 0.00 0.00 179.25 179.95 3i4n h ALA 137 N -0.10 0.16 -0.48 0.00 0.00 0.13 -3.09 119.26 115.88 3i4n h ALA 137 Ca -0.31 -0.31 0.10 0.00 0.00 0.00 0.00 54.91 54.38 3i4n h ALA 137 Cb 1.68 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 19.35 3i4n h ALA 137 CO 0.02 0.02 -0.17 0.82 0.00 0.00 0.00 179.25 179.93 3i4n h ILE 138 N -0.14 0.43 0.14 0.00 2.04 -0.75 -2.13 117.51 117.09 3i4n h ILE 138 Ca 0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 3i4n h ILE 138 Cb 0.65 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 3i4n h ILE 138 CO 0.03 0.00 -0.09 -0.25 0.00 0.00 0.00 178.15 177.84 3i4n h TRP 139 N -0.06 -0.24 -1.69 1.37 7.01 -1.58 -2.66 115.95 118.11 3i4n h TRP 139 Ca 0.23 -0.00 0.49 0.00 2.11 0.00 0.00 58.89 61.72 3i4n h TRP 139 Cb 0.42 0.08 -0.07 0.00 -2.10 0.00 0.00 29.16 27.49 3i4n h TRP 139 CO -0.45 -0.13 1.22 1.15 -2.79 0.00 0.00 178.44 177.44 3i4n h THR 140 N -0.21 0.15 0.31 2.65 2.02 -1.48 -0.35 112.91 116.00 3i4n h THR 140 Ca -0.02 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 3i4n h THR 140 Cb 0.17 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 3i4n h THR 140 CO 0.02 0.00 -0.15 -0.07 0.37 0.00 0.00 175.52 175.69 3i4n h LEU 141 N 0.00 -0.35 -1.98 2.58 3.38 -1.05 -3.36 115.31 114.53 3i4n h LEU 141 Ca 0.80 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.61 3i4n h LEU 141 Cb 3.23 0.09 0.00 0.00 0.09 0.00 0.00 40.66 44.07 3i4n h LEU 141 CO -0.01 0.11 0.00 0.00 0.09 0.00 0.00 178.44 178.64 3i4n n LYS 143 N 1.11 1.10 -0.03 0.00 2.85 -0.22 -3.31 118.16 119.66 3i4n n LYS 143 Ca 0.19 -0.13 -0.07 0.00 -1.05 0.00 0.00 58.31 57.25 3i4n n LYS 143 Cb 0.49 -1.14 -0.02 0.00 -0.65 0.00 0.00 35.03 33.71 3i4n n LYS 143 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 3i4n n THR 144 N -0.31 1.00 -1.81 0.58 -1.04 -1.25 -4.97 114.28 106.48 3i4n n THR 144 Ca 0.01 0.09 -0.42 0.00 -2.04 0.00 0.00 64.05 61.69 3i4n n THR 144 Cb 0.09 -1.78 -0.03 0.00 -1.82 0.00 0.00 70.33 66.79 3i4n n THR 144 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3i4n s LYS 145 N -2.29 3.89 -0.30 -2.82 -0.14 -1.21 -4.90 119.74 111.98 3i4n s LYS 145 Ca -0.13 2.23 0.07 0.00 -1.36 0.00 0.00 55.97 56.79 3i4n s LYS 145 Cb 0.04 -4.14 0.45 0.00 -1.68 0.00 0.00 37.83 32.50 3i4n s LYS 145 CO 0.18 -1.22 1.26 -1.33 -0.76 0.00 0.00 175.35 173.48 3i4n n MET 146 N 7.71 3.05 -3.26 1.68 2.81 -1.26 -4.91 117.12 122.94 3i4n n MET 146 Ca 0.21 -3.89 -0.05 0.00 -1.81 0.00 0.00 57.70 52.16 3i4n n MET 146 Cb 0.43 -2.12 -0.04 0.00 -0.71 0.00 0.00 33.22 30.78 3i4n n MET 146 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3i4n s VAL 147 N -4.26 -0.75 -0.87 2.03 1.01 -1.26 0.77 120.40 117.09 3i4n s VAL 147 Ca 0.49 -0.21 -0.23 0.00 0.00 0.00 0.00 61.98 62.03 3i4n s VAL 147 Cb 0.41 -0.99 -0.19 0.00 0.00 0.00 0.00 36.38 35.61 3i4n s VAL 147 CO 0.01 -0.20 2.14 0.00 0.00 0.00 0.00 175.10 177.05 3i4n s GLU 149 N 8.26 1.63 0.00 0.00 2.02 -1.26 -2.84 118.70 126.51 3i4n s GLU 149 Ca 0.83 1.77 0.00 0.00 0.02 0.00 0.00 54.97 57.59 3i4n s GLU 149 Cb -0.14 -1.77 0.00 0.00 0.10 0.00 0.00 34.13 32.32 3i4n s GLU 149 CO 0.16 -2.22 0.30 2.41 0.02 0.00 0.00 175.26 175.92 3i4n n THR 150 N -3.28 0.00 -3.49 3.63 -1.04 -1.26 -4.59 114.28 104.25 3i4n n THR 150 Ca 0.14 -0.30 -0.14 0.00 -2.04 0.00 0.00 64.05 61.71 3i4n n THR 150 Cb 0.50 1.41 -0.11 0.00 -1.82 0.00 0.00 70.33 70.31 3i4n n THR 150 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 3i4n s ASP 151 N -0.00 0.70 0.02 8.00 1.01 -1.26 -2.69 116.67 122.45 3i4n s ASP 151 Ca 0.00 0.17 0.01 0.00 0.71 0.00 0.00 52.55 53.44 3i4n s ASP 151 Cb 0.00 0.74 -0.02 0.00 1.01 0.00 0.00 42.92 44.65 3i4n s ASP 151 CO 0.00 -0.29 -0.05 -0.69 0.21 0.00 0.00 175.17 174.34 3i4n s VAL 152 N 2.43 0.36 -0.92 -1.27 1.01 0.11 -4.92 120.40 117.20 3i4n s VAL 152 Ca 0.07 -0.75 -0.26 0.00 0.00 0.00 0.00 61.98 61.05 3i4n s VAL 152 Cb -0.15 -0.42 -0.15 0.00 0.00 0.00 0.00 36.38 35.67 3i4n s VAL 152 CO -0.12 -0.26 2.23 -2.16 0.00 0.00 0.00 175.10 174.78 3i4n s PRO 153 N -1.07 1.66 0.60 2.72 0.04 -1.26 -0.64 135.00 137.04 3i4n s PRO 153 Ca -0.08 -0.01 -0.03 0.00 0.04 0.00 0.00 61.00 60.93 3i4n s PRO 153 Cb -0.07 -4.91 0.05 0.00 0.04 0.00 0.00 34.50 29.60 3i4n s PRO 153 CO -0.00 -4.60 0.10 -1.13 0.04 0.00 0.00 177.00 171.41 3i4n n SER 154 N 18.07 -2.20 0.07 6.66 3.41 -1.25 -4.72 113.62 133.65 3i4n n SER 154 Ca 0.44 -0.10 0.21 0.00 -0.26 0.00 0.00 58.87 59.16 3i4n n SER 154 Cb 0.45 -0.54 0.74 0.00 -0.26 0.00 0.00 64.21 64.60 3i4n n SER 154 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3i4n h GLU 155 N 0.00 0.00 -7.63 4.33 5.08 -1.91 -3.42 114.58 111.03 3i4n h GLU 155 Ca -0.05 0.00 -0.42 0.00 -1.00 0.00 0.00 59.36 57.89 3i4n h GLU 155 Cb 0.16 0.00 0.19 0.00 0.50 0.00 0.00 28.75 29.59 3i4n h GLU 155 CO 0.03 0.00 0.27 -0.51 -1.00 0.00 0.00 179.01 177.80 3i4n s ASP 156 N -5.38 1.71 0.10 1.42 1.01 -1.26 -4.92 116.67 109.35 3i4n s ASP 156 Ca -0.04 0.34 -0.29 0.00 0.71 0.00 0.00 52.55 53.27 3i4n s ASP 156 Cb 0.16 -0.40 -0.16 0.00 1.01 0.00 0.00 42.92 43.53 3i4n s ASP 156 CO 0.57 -3.61 0.67 -0.90 0.21 0.00 0.00 175.17 172.11 3i4n n ASP 157 N -4.37 -0.64 0.00 0.27 5.75 -1.26 -4.68 116.55 111.62 3i4n n ASP 157 Ca 0.16 1.02 0.02 0.00 -0.01 0.00 0.00 54.79 55.97 3i4n n ASP 157 Cb 0.59 -0.83 0.13 0.00 -1.03 0.00 0.00 41.12 39.98 3i4n n ASP 157 CO 0.00 0.00 0.00 -0.81 -0.11 0.00 0.00 177.20 176.28 3i4n n PRO 158 N 1.08 0.36 0.00 0.11 -0.04 -1.26 -0.33 135.00 134.92 3i4n n PRO 158 Ca 0.17 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.74 3i4n n PRO 158 Cb 0.16 -1.19 0.08 0.00 -0.04 0.00 0.00 33.50 32.51 3i4n n PRO 158 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3i4n n THR 159 N -0.69 0.00 -3.68 0.52 -1.04 -1.26 -4.59 114.28 103.54 3i4n n THR 159 Ca 0.03 -0.35 -0.27 0.00 -2.04 0.00 0.00 64.05 61.42 3i4n n THR 159 Cb 0.01 1.27 -0.11 0.00 -1.82 0.00 0.00 70.33 69.69 3i4n n THR 159 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i4n n GLN 160 N 0.49 1.23 -1.97 -2.82 1.13 0.55 -5.11 117.38 110.88 3i4n n GLN 160 Ca 0.12 -3.98 -0.34 0.00 -1.94 0.00 0.00 57.00 50.85 3i4n n GLN 160 Cb 0.51 -2.03 0.03 0.00 0.11 0.00 0.00 30.24 28.86 3i4n n GLN 160 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3i4n s LEU 161 N -0.94 3.55 0.14 1.08 1.43 -1.26 -3.95 118.68 118.73 3i4n s LEU 161 Ca 0.29 2.09 0.05 0.00 -1.03 0.00 0.00 54.13 55.53 3i4n s LEU 161 Cb 0.00 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.61 3i4n s LEU 161 CO -0.17 -1.47 -0.11 -0.69 0.23 0.00 0.00 176.35 174.13 3i4n s VAL 162 N -2.07 1.22 0.61 -1.59 1.01 0.18 -4.81 120.40 114.96 3i4n s VAL 162 Ca 0.70 -1.94 0.06 0.00 0.00 0.00 0.00 61.98 60.80 3i4n s VAL 162 Cb -0.22 -1.72 0.10 0.00 0.00 0.00 0.00 36.38 34.53 3i4n s VAL 162 CO 0.35 -0.63 0.85 -0.94 0.00 0.00 0.00 175.10 174.72 3i4n s SER 163 N -2.92 4.88 0.00 3.32 1.04 -1.26 -0.71 113.70 118.05 3i4n s SER 163 Ca 0.14 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.92 3i4n s SER 163 Cb -0.00 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.24 3i4n s SER 163 CO 0.02 -1.48 0.00 -2.11 0.98 0.00 0.00 173.24 170.64 3i4n n ARG 164 N -2.42 0.00 -0.36 4.02 1.85 -1.09 -4.92 116.66 113.73 3i4n n ARG 164 Ca 0.15 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.70 3i4n n ARG 164 Cb 0.61 0.00 0.29 0.00 -1.05 0.00 0.00 32.46 32.31 3i4n n ARG 164 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 3i4n s GLY 165 N 0.00 1.43 0.00 2.89 0.00 -1.26 -4.95 107.32 105.43 3i4n s GLY 165 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.08 3i4n s GLY 165 CO 0.00 0.31 0.00 0.61 0.00 0.00 0.00 173.10 174.02 3i4n n GLY 166 N 1.43 2.54 1.21 0.20 0.00 -1.26 -4.15 105.19 105.15 3i4n n GLY 166 Ca 0.10 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.27 3i4n n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4n n GLY 168 N 1.79 1.12 2.40 0.00 0.00 -1.13 -4.47 105.19 104.90 3i4n n GLY 168 Ca 0.00 -0.61 -0.44 0.00 0.00 0.00 0.00 46.02 44.97 3i4n n GLY 168 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3i4n n ASN 169 N 1.04 0.63 -4.18 1.61 3.02 -1.26 -3.25 115.26 112.87 3i4n n ASN 169 Ca 0.18 0.59 -0.35 0.00 -0.03 0.00 0.00 54.58 54.97 3i4n n ASN 169 Cb 0.50 -0.63 0.07 0.00 -0.61 0.00 0.00 39.78 39.11 3i4n n ASN 169 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3i4n n THR 170 N 4.01 0.02 -4.12 3.41 -1.04 -1.26 -3.86 114.28 111.44 3i4n n THR 170 Ca 0.33 -0.37 -0.33 0.00 -2.04 0.00 0.00 64.05 61.64 3i4n n THR 170 Cb -0.03 -0.26 -0.16 0.00 -1.82 0.00 0.00 70.33 68.06 3i4n n THR 170 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 3i4n s GLN 171 N -2.66 2.94 0.03 -2.82 -0.21 0.23 -4.87 119.66 112.30 3i4n s GLN 171 Ca 0.47 -0.85 -0.30 0.00 0.02 0.00 0.00 55.36 54.70 3i4n s GLN 171 Cb -0.20 -2.57 -0.06 0.00 1.00 0.00 0.00 33.01 31.18 3i4n s GLN 171 CO 0.76 -0.23 1.43 -1.25 -2.12 0.00 0.00 175.29 173.89 3i4n s PRO 172 N 1.29 4.28 0.17 2.91 0.04 -1.26 -4.70 135.00 137.73 3i4n s PRO 172 Ca 0.04 2.03 -0.32 0.00 0.04 0.00 0.00 61.00 62.80 3i4n s PRO 172 Cb -0.13 -3.50 -0.12 0.00 0.04 0.00 0.00 34.50 30.79 3i4n s PRO 172 CO -0.13 -0.56 1.75 2.41 0.04 0.00 0.00 177.00 180.52 3i4n n THR 173 N 4.51 0.14 -3.65 1.26 -1.04 -1.22 -4.56 114.28 109.73 3i4n n THR 173 Ca 0.13 -0.02 -0.20 0.00 -2.04 0.00 0.00 64.05 61.92 3i4n n THR 173 Cb 0.43 -1.99 -0.01 0.00 -1.82 0.00 0.00 70.33 66.94 3i4n n THR 173 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 3i4n s ILE 174 N 1.74 4.47 -0.07 12.58 1.01 -1.26 -2.68 121.20 136.99 3i4n s ILE 174 Ca 0.78 -1.00 -0.26 0.00 0.00 0.00 0.00 60.65 60.17 3i4n s ILE 174 Cb -0.52 -3.56 0.06 0.00 0.01 0.00 0.00 42.46 38.45 3i4n s ILE 174 CO 0.35 -0.22 0.59 0.00 0.00 0.00 0.00 174.94 175.66 3i4n s ARG 175 N -4.10 0.93 0.52 2.79 1.70 -0.62 -4.98 118.95 115.18 3i4n s ARG 175 Ca 0.41 0.24 -0.18 0.00 -0.47 0.00 0.00 55.73 55.73 3i4n s ARG 175 Cb -0.09 0.43 -0.07 0.00 -0.57 0.00 0.00 34.95 34.65 3i4n s ARG 175 CO 0.30 -0.26 1.02 0.21 -1.08 0.00 0.00 175.30 175.49 3i4n s LYS 176 N -1.02 3.75 -0.29 3.89 2.20 -1.26 -2.88 119.74 124.13 3i4n s LYS 176 Ca -0.10 1.19 -0.16 0.00 -0.36 0.00 0.00 55.97 56.54 3i4n s LYS 176 Cb -0.02 -2.10 0.15 0.00 -1.51 0.00 0.00 37.83 34.36 3i4n s LYS 176 CO 0.07 -0.45 0.99 0.34 -0.36 0.00 0.00 175.35 175.95 3i4n s ASP 177 N -2.49 -0.50 0.51 1.43 -1.08 -1.17 -4.96 116.67 108.41 3i4n s ASP 177 Ca 0.64 0.77 0.00 0.00 -0.52 0.00 0.00 52.55 53.44 3i4n s ASP 177 Cb -0.14 1.32 0.00 0.00 -1.46 0.00 0.00 42.92 42.65 3i4n s ASP 177 CO 0.26 -0.12 0.00 0.61 0.52 0.00 0.00 175.17 176.45 3i4n n GLY 178 N 4.03 2.66 1.67 2.66 0.00 -1.26 -0.96 105.19 113.99 3i4n n GLY 178 Ca -0.16 -0.06 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 3i4n n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i4n n LEU 179 N 0.00 5.32 -3.75 0.99 4.77 -1.26 -4.96 117.00 118.12 3i4n n LEU 179 Ca 0.00 -3.91 -0.13 0.00 -0.03 0.00 0.00 56.01 51.94 3i4n n LEU 179 Cb 0.00 -0.70 -0.10 0.00 -2.33 0.00 0.00 43.42 40.29 3i4n n LEU 179 CO 0.00 1.33 0.04 -0.54 -1.33 0.00 0.00 177.39 176.89 3i4n s LYS 180 N -3.38 0.55 0.29 3.23 1.02 -0.14 -4.83 119.74 116.47 3i4n s LYS 180 Ca 0.51 0.21 0.02 0.00 0.02 0.00 0.00 55.97 56.73 3i4n s LYS 180 Cb 0.44 0.25 -0.03 0.00 -0.52 0.00 0.00 37.83 37.97 3i4n s LYS 180 CO 0.03 -0.11 0.45 -0.51 -0.92 0.00 0.00 175.35 174.28 3i4n s LEU 181 N -0.48 4.17 -0.10 3.17 1.43 -1.26 -3.02 118.68 122.58 3i4n s LEU 181 Ca -0.06 0.28 -0.19 0.00 -1.03 0.00 0.00 54.13 53.14 3i4n s LEU 181 Cb -0.04 -3.11 0.04 0.00 0.03 0.00 0.00 46.19 43.12 3i4n s LEU 181 CO 0.02 -0.17 0.46 -0.69 0.23 0.00 0.00 176.35 176.20 3i4n s VAL 182 N -2.13 0.02 0.14 -1.59 1.01 -1.14 -2.06 120.40 114.65 3i4n s VAL 182 Ca 0.37 -0.16 -0.00 0.00 0.00 0.00 0.00 61.98 62.19 3i4n s VAL 182 Cb -0.09 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 3i4n s VAL 182 CO 0.32 -0.09 0.03 -0.83 0.00 0.00 0.00 175.10 174.53 3i4n s GLY 183 N -0.57 1.03 -0.10 4.51 0.00 -1.21 -1.59 107.32 109.39 3i4n s GLY 183 Ca -0.07 -1.49 0.01 0.00 0.00 0.00 0.00 44.72 43.17 3i4n s GLY 183 CO 0.04 -1.42 -0.11 -1.35 0.00 0.00 0.00 173.10 170.26 3i4n s SER 184 N -3.08 2.14 0.29 1.64 1.04 -1.09 -2.93 113.70 111.71 3i4n s SER 184 Ca 0.23 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.32 3i4n s SER 184 Cb 0.07 -0.91 0.00 0.00 0.10 0.00 0.00 66.02 65.28 3i4n s SER 184 CO 0.02 -0.04 0.00 0.79 0.98 0.00 0.00 173.24 174.99 3i4n n TRP 185 N 4.43 -2.78 0.00 5.02 8.01 -1.25 -3.37 117.44 127.50 3i4n n TRP 185 Ca -0.18 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.01 3i4n n TRP 185 Cb 0.51 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.81 3i4n n TRP 185 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 3i4n n LYS 186 N -0.83 0.00 -0.11 -0.99 5.02 -1.26 -2.85 118.16 117.14 3i4n n LYS 186 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3i4n n LYS 186 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 3i4n n LYS 186 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 3i4n n LYS 187 N 0.00 0.00 -0.57 1.97 3.00 -1.26 -4.38 118.16 116.92 3i4n n LYS 187 Ca 0.00 0.04 0.07 0.00 -0.00 0.00 0.00 58.31 58.42 3i4n n LYS 187 Cb 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 35.03 34.90 3i4n n LYS 187 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 3i4n n ASP 188 N -0.05 -3.45 -3.20 3.14 8.00 -1.26 -3.59 116.55 116.14 3i4n n ASP 188 Ca 0.00 0.40 0.01 0.00 0.71 0.00 0.00 54.79 55.90 3i4n n ASP 188 Cb 0.01 -1.85 -0.01 0.00 -0.02 0.00 0.00 41.12 39.25 3i4n n ASP 188 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3i4n s ARG 189 N -2.41 0.71 0.00 -1.24 3.52 -1.26 -2.97 118.95 115.29 3i4n s ARG 189 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 55.73 55.61 3i4n s ARG 189 Cb 0.00 0.10 0.00 0.00 -1.56 0.00 0.00 34.95 33.49 3i4n s ARG 189 CO 0.00 -1.14 0.00 0.00 -0.81 0.00 0.00 175.30 173.35 3i4n n ALA 190 N 4.80 0.00 -0.77 6.12 0.00 -1.26 -4.98 120.51 124.42 3i4n n ALA 190 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3i4n n ALA 190 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 3i4n n ALA 190 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3i4n n THR 191 N -2.02 0.00 -3.22 0.00 -1.04 -1.26 -5.01 114.28 101.73 3i4n n THR 191 Ca 0.00 0.12 -0.00 0.00 -2.04 0.00 0.00 64.05 62.12 3i4n n THR 191 Cb 0.00 -0.68 -0.03 0.00 -1.82 0.00 0.00 70.33 67.79 3i4n n THR 191 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 3i4n s GLY 192 N -1.33 -0.83 0.31 3.41 0.00 -1.26 -5.15 107.32 102.46 3i4n s GLY 192 Ca 0.00 1.42 0.00 0.00 0.00 0.00 0.00 44.72 46.14 3i4n s GLY 192 CO 0.00 3.19 0.00 1.22 0.00 0.00 0.00 173.10 177.51 3i4n n ASP 193 N 5.41 -4.01 0.00 1.64 8.00 -1.26 -4.72 116.55 121.60 3i4n n ASP 193 Ca -0.01 0.71 0.00 0.00 0.71 0.00 0.00 54.79 56.20 3i4n n ASP 193 Cb 0.51 -3.26 0.00 0.00 -0.02 0.00 0.00 41.12 38.35 3i4n n ASP 193 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i4n n ALA 194 N -3.56 0.00 -0.71 2.24 0.00 -1.26 -4.66 120.51 112.56 3i4n n ALA 194 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3i4n n ALA 194 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 3i4n n ALA 194 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3i4n n ASP 195 N 4.04 0.00 -3.11 0.00 10.43 -1.16 -4.71 116.55 122.04 3i4n n ASP 195 Ca 0.00 0.00 -0.09 0.00 2.57 0.00 0.00 54.79 57.27 3i4n n ASP 195 Cb 0.00 0.00 0.09 0.00 1.84 0.00 0.00 41.12 43.05 3i4n n ASP 195 CO 0.00 0.00 0.00 -1.84 -1.07 0.00 0.00 177.20 174.29 3i4n n GLU 196 N 0.00 -2.12 -0.31 -1.24 0.00 -1.26 -4.53 120.64 111.17 3i4n n GLU 196 Ca 0.00 -0.43 -0.25 0.00 0.00 0.00 0.00 57.16 56.49 3i4n n GLU 196 Cb 0.00 -0.62 0.24 0.00 0.00 0.00 0.00 31.44 31.06 3i4n n GLU 196 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 3i4n n PRO 197 N -2.56 -3.62 -2.94 3.44 -0.04 -1.26 -4.68 135.00 123.34 3i4n n PRO 197 Ca 0.04 -1.18 -0.15 0.00 -0.04 0.00 0.00 63.50 62.18 3i4n n PRO 197 Cb 0.18 -1.72 -0.00 0.00 -0.04 0.00 0.00 33.50 31.91 3i4n n PRO 197 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3i4n n GLU 198 N -4.17 0.73 -1.71 0.54 2.13 -1.13 -4.91 120.64 112.12 3i4n n GLU 198 Ca 0.11 -2.36 -0.42 0.00 0.66 0.00 0.00 57.16 55.15 3i4n n GLU 198 Cb 0.49 -1.37 -0.03 0.00 0.27 0.00 0.00 31.44 30.80 3i4n n GLU 198 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3i4n s LEU 199 N -0.84 4.41 0.02 4.31 1.43 -1.26 -3.76 118.68 122.99 3i4n s LEU 199 Ca 0.33 2.73 0.01 0.00 -1.03 0.00 0.00 54.13 56.17 3i4n s LEU 199 Cb 0.20 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.85 3i4n s LEU 199 CO -0.19 -1.02 -0.05 -0.60 0.23 0.00 0.00 176.35 174.73 3i4n s ARG 200 N 3.21 0.36 0.28 1.70 3.52 -1.15 -5.06 118.95 121.81 3i4n s ARG 200 Ca 0.83 -0.48 -0.23 0.00 -0.13 0.00 0.00 55.73 55.73 3i4n s ARG 200 Cb -0.45 -0.15 -0.09 0.00 -1.56 0.00 0.00 34.95 32.70 3i4n s ARG 200 CO 0.38 0.02 0.83 0.08 -0.81 0.00 0.00 175.30 175.80 3i4n s VAL 201 N -0.93 4.40 -0.62 7.11 1.01 -1.26 -3.33 120.40 126.78 3i4n s VAL 201 Ca -0.08 1.54 -0.14 0.00 0.00 0.00 0.00 61.98 63.30 3i4n s VAL 201 Cb -0.07 -3.92 0.16 0.00 0.00 0.00 0.00 36.38 32.55 3i4n s VAL 201 CO -0.00 0.16 0.56 -0.76 0.00 0.00 0.00 175.10 175.06 3i4n s LEU 202 N -2.05 6.27 0.53 3.92 1.43 -0.87 -5.01 118.68 122.90 3i4n s LEU 202 Ca 0.47 -2.11 -0.22 0.00 -1.03 0.00 0.00 54.13 51.24 3i4n s LEU 202 Cb -0.17 -2.17 -0.05 0.00 0.03 0.00 0.00 46.19 43.82 3i4n s LEU 202 CO 0.22 -0.74 1.34 -0.94 0.23 0.00 0.00 176.35 176.46 3i4n s SER 203 N 2.95 5.41 0.14 2.29 1.04 -1.26 -4.44 113.70 119.82 3i4n s SER 203 Ca 0.08 2.71 -0.26 0.00 0.48 0.00 0.00 55.95 58.97 3i4n s SER 203 Cb -0.23 -2.63 -0.02 0.00 0.10 0.00 0.00 66.02 63.23 3i4n s SER 203 CO -0.01 -1.47 1.61 0.71 0.98 0.00 0.00 173.24 175.06 3i4n h THR 204 N 1.54 0.30 -0.65 2.02 1.35 -1.97 -1.32 112.91 114.17 3i4n h THR 204 Ca -0.51 0.00 0.13 0.00 -0.55 0.00 0.00 66.41 65.48 3i4n h THR 204 Cb 1.29 0.30 -0.12 0.00 -1.73 0.00 0.00 68.15 67.88 3i4n h THR 204 CO 0.58 0.00 -0.18 -0.33 -0.25 0.00 0.00 175.52 175.33 3i4n h GLU 205 N -0.40 -0.02 -0.00 4.72 5.08 -1.91 0.16 114.58 122.22 3i4n h GLU 205 Ca 0.09 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 3i4n h GLU 205 Cb 0.54 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 3i4n h GLU 205 CO -0.34 -0.01 -0.15 1.49 -1.00 0.00 0.00 179.01 178.99 3i4n h GLU 206 N -0.02 -0.18 -0.24 2.33 4.81 -1.64 -1.31 114.58 118.34 3i4n h GLU 206 Ca 0.31 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.61 3i4n h GLU 206 Cb 0.49 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.85 3i4n h GLU 206 CO -0.68 -0.12 -0.19 0.82 -0.73 0.00 0.00 179.01 178.11 3i4n h ILE 207 N -0.19 0.49 -0.38 2.32 1.08 -0.57 -1.56 117.51 118.71 3i4n h ILE 207 Ca 0.00 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.55 3i4n h ILE 207 Cb 0.20 0.49 -0.07 0.00 -3.07 0.00 0.00 36.82 34.37 3i4n h ILE 207 CO -0.10 0.00 -0.11 0.25 -0.69 0.00 0.00 178.15 177.49 3i4n h LEU 208 N -0.18 -0.41 -0.37 1.44 6.46 -0.61 0.31 115.31 121.94 3i4n h LEU 208 Ca 0.13 0.12 0.02 0.00 -0.12 0.00 0.00 57.88 58.03 3i4n h LEU 208 Cb 0.39 0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 40.55 3i4n h LEU 208 CO -0.35 -0.15 0.21 -1.13 -0.62 0.00 0.00 178.44 176.41 3i4n h ASN 209 N -0.03 0.34 0.16 1.25 -0.73 -0.82 0.11 115.58 115.87 3i4n h ASN 209 Ca 0.18 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.35 3i4n h ASN 209 Cb 0.31 -0.07 -0.00 0.00 0.27 0.00 0.00 38.32 38.83 3i4n h ASN 209 CO -0.41 0.25 -0.04 0.40 -0.37 0.00 0.00 177.43 177.26 3i4n h ILE 210 N 0.44 0.45 0.14 2.57 2.04 -0.49 -2.12 117.51 120.55 3i4n h ILE 210 Ca 0.15 -0.20 -0.20 0.00 1.00 0.00 0.00 64.86 65.61 3i4n h ILE 210 Cb 0.01 1.13 0.02 0.00 -0.74 0.00 0.00 36.82 37.24 3i4n h ILE 210 CO -0.07 0.04 -0.88 -0.26 0.00 0.00 0.00 178.15 176.98 3i4n h PHE 211 N 0.00 0.52 -0.97 1.37 -1.00 0.37 -3.18 116.94 114.06 3i4n h PHE 211 Ca -0.00 -0.38 0.13 0.00 2.81 0.00 0.00 57.97 60.53 3i4n h PHE 211 Cb 0.13 -0.02 -0.08 0.00 3.61 0.00 0.00 35.95 39.59 3i4n h PHE 211 CO 0.00 1.34 0.61 0.87 -1.61 0.00 0.00 178.31 179.52 3i4n h LYS 212 N -0.38 0.87 0.00 1.51 1.57 -0.22 0.24 116.57 120.16 3i4n h LYS 212 Ca -0.16 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 3i4n h LYS 212 Cb 1.65 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 33.76 3i4n h LYS 212 CO 0.14 0.57 -0.06 0.45 -0.57 0.00 0.00 179.45 179.98 3i4n h HIS 213 N 0.89 0.00 -2.11 -1.35 3.86 -1.49 -3.45 115.15 111.50 3i4n h HIS 213 Ca 0.49 0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 59.07 3i4n h HIS 213 Cb 0.58 0.00 0.07 0.00 1.06 0.00 0.00 27.41 29.12 3i4n h HIS 213 CO -0.00 0.06 0.51 -0.89 0.86 0.00 0.00 177.93 178.47 3i4n n ILE 214 N -3.18 0.46 -1.52 2.45 5.41 0.84 -4.75 119.36 119.07 3i4n n ILE 214 Ca 0.00 -0.12 -0.42 0.00 1.00 0.00 0.00 62.75 63.22 3i4n n ILE 214 Cb 0.34 -1.13 0.01 0.00 -0.71 0.00 0.00 39.64 38.14 3i4n n ILE 214 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 3i4n n SER 215 N 2.49 0.06 -0.05 4.38 2.88 -1.13 -4.76 113.62 117.49 3i4n n SER 215 Ca 0.16 0.99 -0.00 0.00 -1.33 0.00 0.00 58.87 58.68 3i4n n SER 215 Cb 0.26 -1.21 0.28 0.00 -0.75 0.00 0.00 64.21 62.79 3i4n n SER 215 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 3i4n h VAL 216 N 1.16 1.19 -0.00 2.46 2.07 -1.94 0.23 116.25 121.41 3i4n h VAL 216 Ca -0.41 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.43 3i4n h VAL 216 Cb 1.37 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 3i4n h VAL 216 CO 0.54 0.25 -0.31 1.17 0.02 0.00 0.00 177.57 179.24 3i4n n LYS 217 N -4.32 0.25 0.04 1.57 4.81 -1.26 -3.28 118.16 115.97 3i4n n LYS 217 Ca 0.03 -0.12 -0.15 0.00 -0.87 0.00 0.00 58.31 57.19 3i4n n LYS 217 Cb 0.20 -1.50 -0.14 0.00 0.02 0.00 0.00 35.03 33.61 3i4n n LYS 217 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 3i4n h ASP 218 N 0.30 0.30 0.02 3.14 3.32 -1.33 0.12 116.42 122.29 3i4n h ASP 218 Ca 0.00 -0.48 0.01 0.00 0.02 0.00 0.00 57.03 56.59 3i4n h ASP 218 Cb 0.48 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.89 3i4n h ASP 218 CO 0.00 1.41 -0.37 -0.26 -1.72 0.00 0.00 179.24 178.30 3i4n h PHE 219 N 0.05 -1.09 -0.51 4.55 0.05 -0.64 0.74 116.94 120.10 3i4n h PHE 219 Ca -0.27 0.03 0.10 0.00 3.82 0.00 0.00 57.97 61.65 3i4n h PHE 219 Cb 2.01 0.47 -0.10 0.00 2.00 0.00 0.00 35.95 40.32 3i4n h PHE 219 CO 0.05 -0.40 -0.29 1.15 -0.18 0.00 0.00 178.31 178.64 3i4n h THR 220 N -0.48 0.24 -0.60 -1.55 2.02 -1.62 -1.84 112.91 109.08 3i4n h THR 220 Ca 0.01 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.31 3i4n h THR 220 Cb 0.50 0.24 -0.11 0.00 -1.74 0.00 0.00 68.15 67.05 3i4n h THR 220 CO -0.24 0.00 -0.07 0.28 0.37 0.00 0.00 175.52 175.87 3i4n h SER 221 N -0.17 -0.39 0.00 4.18 0.02 0.06 -3.39 113.55 113.85 3i4n h SER 221 Ca 0.22 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 3i4n h SER 221 Cb 0.52 0.31 0.00 0.00 0.14 0.00 0.00 62.40 63.37 3i4n h SER 221 CO -0.61 -0.15 0.00 0.18 -1.14 0.00 0.00 176.83 175.11 3i4n n LEU 222 N -5.34 0.00 -2.32 5.07 4.77 0.18 -4.75 117.00 114.62 3i4n n LEU 222 Ca 0.08 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.72 3i4n n LEU 222 Cb 0.33 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.49 3i4n n LEU 222 CO 0.09 -0.04 1.25 0.61 -1.33 0.00 0.00 177.39 177.97 3i4n n GLY 223 N 2.64 5.94 0.00 -0.72 0.00 -1.25 -4.72 105.19 107.08 3i4n n GLY 223 Ca 0.00 -2.38 0.00 0.00 0.00 0.00 0.00 46.02 43.64 3i4n n GLY 223 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i4n n PHE 224 N -0.86 0.00 -3.52 1.61 3.01 -1.11 -4.28 117.46 112.31 3i4n n PHE 224 Ca 0.59 0.00 -0.00 0.00 1.01 0.00 0.00 57.45 59.05 3i4n n PHE 224 Cb 0.68 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 40.11 3i4n n PHE 224 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 3i4n s ASN 225 N -0.04 -0.63 0.62 4.37 2.47 -1.13 -4.66 114.94 115.93 3i4n s ASN 225 Ca 0.00 0.92 0.30 0.00 0.42 0.00 0.00 52.86 54.50 3i4n s ASN 225 Cb 0.00 1.57 1.67 0.00 -1.45 0.00 0.00 41.25 43.03 3i4n s ASN 225 CO 0.00 -0.13 2.02 -0.08 -3.72 0.00 0.00 177.10 175.19 3i4n h GLU 226 N 7.05 0.00 0.00 0.43 4.81 -1.88 -1.91 114.58 123.09 3i4n h GLU 226 Ca -0.21 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.79 3i4n h GLU 226 Cb 1.14 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.48 3i4n h GLU 226 CO 0.13 0.00 -1.98 0.28 -0.73 0.00 0.00 179.01 176.71 3i4n n VAL 227 N -3.49 0.87 0.04 0.32 0.31 -1.26 -4.77 118.33 110.35 3i4n n VAL 227 Ca 0.02 -0.59 0.02 0.00 -0.01 0.00 0.00 64.34 63.78 3i4n n VAL 227 Cb 0.41 -0.49 -0.03 0.00 -0.91 0.00 0.00 33.84 32.82 3i4n n VAL 227 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3i4n n PHE 228 N -2.48 0.00 -3.11 3.52 0.99 -1.20 -4.94 117.46 110.24 3i4n n PHE 228 Ca -0.21 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 57.11 3i4n n PHE 228 Cb 0.90 -0.06 -0.04 0.00 -1.00 0.00 0.00 39.48 39.28 3i4n n PHE 228 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 3i4n s SER 229 N -2.15 -0.11 -0.35 4.37 1.04 -0.72 0.36 113.70 116.14 3i4n s SER 229 Ca -0.01 -1.97 -0.22 0.00 0.48 0.00 0.00 55.95 54.23 3i4n s SER 229 Cb 0.02 0.98 0.00 0.00 0.10 0.00 0.00 66.02 67.13 3i4n s SER 229 CO 0.15 -0.14 0.70 -0.13 0.98 0.00 0.00 173.24 174.81 3i4n s ARG 230 N 0.87 3.76 0.17 4.02 0.52 -1.23 -2.85 118.95 124.21 3i4n s ARG 230 Ca 0.26 0.23 0.09 0.00 -0.52 0.00 0.00 55.73 55.80 3i4n s ARG 230 Cb -0.03 -3.79 0.62 0.00 0.52 0.00 0.00 34.95 32.27 3i4n s ARG 230 CO -0.09 -0.75 0.75 -2.30 0.02 0.00 0.00 175.30 172.93 3i4n n PRO 231 N 6.18 -0.03 0.00 3.54 -0.02 -1.26 0.17 135.00 143.58 3i4n n PRO 231 Ca 0.01 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3i4n n PRO 231 Cb 0.48 -1.17 0.00 0.00 -0.02 0.00 0.00 33.50 32.79 3i4n n PRO 231 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3i4n n GLU 232 N -4.12 0.00 -0.02 -0.52 0.28 -1.26 0.32 120.64 115.32 3i4n n GLU 232 Ca 0.17 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 57.17 3i4n n GLU 232 Cb 0.59 -1.29 -0.07 0.00 1.43 0.00 0.00 31.44 32.11 3i4n n GLU 232 CO 0.00 0.00 0.00 0.91 -0.16 0.00 0.00 177.13 177.88 3i4n n TRP 233 N -0.71 0.00 0.01 -1.84 8.01 0.46 -4.41 117.44 118.96 3i4n n TRP 233 Ca 0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 3i4n n TRP 233 Cb 0.00 -0.31 0.03 0.00 -2.01 0.00 0.00 31.31 29.01 3i4n n TRP 233 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.69 175.35 3i4n n MET 234 N -2.09 0.01 -4.62 -0.99 2.81 0.15 -4.06 117.12 108.33 3i4n n MET 234 Ca -0.08 0.26 -0.33 0.00 -1.81 0.00 0.00 57.70 55.74 3i4n n MET 234 Cb 0.53 -1.80 -0.13 0.00 -0.71 0.00 0.00 33.22 31.12 3i4n n MET 234 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3i4n s ILE 235 N -2.54 3.51 -0.12 2.02 1.01 -1.26 -3.11 121.20 120.72 3i4n s ILE 235 Ca -0.00 -0.52 -0.25 0.00 0.00 0.00 0.00 60.65 59.88 3i4n s ILE 235 Cb 0.00 -2.48 -0.02 0.00 0.01 0.00 0.00 42.46 39.97 3i4n s ILE 235 CO 0.01 0.54 0.81 -0.76 0.00 0.00 0.00 174.94 175.54 3i4n s LEU 236 N -0.08 4.24 -0.12 2.97 1.43 -0.38 -4.92 118.68 121.82 3i4n s LEU 236 Ca -0.00 1.23 -0.03 0.00 -1.03 0.00 0.00 54.13 54.30 3i4n s LEU 236 Cb -0.13 -3.23 -0.06 0.00 0.03 0.00 0.00 46.19 42.80 3i4n s LEU 236 CO 0.03 -0.30 -0.14 0.41 0.23 0.00 0.00 176.35 176.58 3i4n n THR 237 N 4.37 0.67 -4.62 5.49 -1.04 -1.26 -2.40 114.28 115.49 3i4n n THR 237 Ca 0.03 -0.20 -0.28 0.00 -2.04 0.00 0.00 64.05 61.55 3i4n n THR 237 Cb 0.50 -1.37 -0.14 0.00 -1.82 0.00 0.00 70.33 67.50 3i4n n THR 237 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i4n s LEU 239 N -1.57 3.58 0.01 0.00 2.96 -1.17 -4.88 118.68 117.62 3i4n s LEU 239 Ca 0.11 -0.73 -0.30 0.00 -0.22 0.00 0.00 54.13 52.99 3i4n s LEU 239 Cb -0.10 -1.81 -0.07 0.00 0.50 0.00 0.00 46.19 44.72 3i4n s LEU 239 CO 0.04 -0.16 1.64 -2.16 -1.32 0.00 0.00 176.35 174.38 3i4n s PRO 240 N 1.45 4.20 -0.47 0.98 0.04 -1.26 -1.88 135.00 138.05 3i4n s PRO 240 Ca 0.02 2.24 -0.15 0.00 0.04 0.00 0.00 61.00 63.15 3i4n s PRO 240 Cb -0.17 -3.77 0.08 0.00 0.04 0.00 0.00 34.50 30.68 3i4n s PRO 240 CO 0.00 -0.77 0.40 0.08 0.04 0.00 0.00 177.00 176.75 3i4n s VAL 241 N 3.23 5.17 0.37 -0.36 1.01 0.36 -4.96 120.40 125.21 3i4n s VAL 241 Ca 0.73 -1.12 -0.28 0.00 0.00 0.00 0.00 61.98 61.31 3i4n s VAL 241 Cb -0.36 -4.11 -0.11 0.00 0.00 0.00 0.00 36.38 31.79 3i4n s VAL 241 CO 0.31 -0.60 1.36 -0.81 0.00 0.00 0.00 175.10 175.36 3i4n n PRO 242 N 5.19 2.30 -2.26 2.72 -0.04 -1.26 -2.02 135.00 139.63 3i4n n PRO 242 Ca -0.12 0.81 -0.26 0.00 -0.04 0.00 0.00 63.50 63.88 3i4n n PRO 242 Cb 0.43 -2.47 0.06 0.00 -0.04 0.00 0.00 33.50 31.48 3i4n n PRO 242 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3i4n s PRO 243 N -2.02 2.42 0.03 0.54 0.04 -1.26 -4.87 135.00 129.88 3i4n s PRO 243 Ca 0.55 -0.18 -0.06 0.00 0.04 0.00 0.00 61.00 61.35 3i4n s PRO 243 Cb -0.52 -2.20 -0.01 0.00 0.04 0.00 0.00 34.50 31.80 3i4n s PRO 243 CO 0.62 -1.07 0.47 -0.35 0.04 0.00 0.00 177.00 176.71 3i4n n PRO 244 N -2.82 -0.08 -0.30 0.56 -0.04 -1.26 -1.20 135.00 129.87 3i4n n PRO 244 Ca 0.07 0.46 0.34 0.00 -0.04 0.00 0.00 63.50 64.33 3i4n n PRO 244 Cb 0.60 -0.69 0.63 0.00 -0.04 0.00 0.00 33.50 34.00 3i4n n PRO 244 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 3i4n h PRO 245 N 0.00 0.00 0.20 0.54 0.11 -1.95 0.58 132.00 131.49 3i4n h PRO 245 Ca 0.03 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.81 3i4n h PRO 245 Cb 0.07 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.20 3i4n h PRO 245 CO -0.17 0.00 -1.55 0.28 -0.21 0.00 0.00 178.00 176.35 3i4n h VAL 246 N 0.00 1.18 -2.19 3.15 2.07 -1.52 -3.38 116.25 115.57 3i4n h VAL 246 Ca 0.56 -2.70 -0.57 0.00 0.82 0.00 0.00 66.70 64.80 3i4n h VAL 246 Cb 2.72 2.91 -0.41 0.00 -1.52 0.00 0.00 31.29 34.98 3i4n h VAL 246 CO -0.01 0.84 -0.75 -2.11 0.02 0.00 0.00 177.57 175.56 3i4n n ARG 247 N -3.62 2.44 -0.96 1.57 1.85 0.16 -5.03 116.66 113.08 3i4n n ARG 247 Ca -0.18 -4.43 -0.34 0.00 -1.00 0.00 0.00 57.85 51.90 3i4n n ARG 247 Cb 1.08 -2.07 0.10 0.00 -1.05 0.00 0.00 32.46 30.53 3i4n n ARG 247 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 3i4n n PRO 248 N 0.34 -0.08 -3.84 2.89 -0.04 0.10 -4.25 135.00 130.12 3i4n n PRO 248 Ca 0.29 0.02 -0.35 0.00 -0.04 0.00 0.00 63.50 63.42 3i4n n PRO 248 Cb 0.45 -1.87 -0.13 0.00 -0.04 0.00 0.00 33.50 31.91 3i4n n PRO 248 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3i4n s SER 249 N -1.85 5.11 -1.10 3.54 1.04 -1.26 -2.19 113.70 116.99 3i4n s SER 249 Ca 0.60 -1.93 -0.24 0.00 0.48 0.00 0.00 55.95 54.86 3i4n s SER 249 Cb -0.26 -1.77 -0.14 0.00 0.10 0.00 0.00 66.02 63.95 3i4n s SER 249 CO 0.64 -0.47 1.97 -0.38 0.98 0.00 0.00 173.24 175.98 3i4n n ILE 250 N 4.54 1.39 -2.22 -1.02 5.41 -1.26 -4.68 119.36 121.52 3i4n n ILE 250 Ca -0.03 -1.43 -0.42 0.00 1.00 0.00 0.00 62.75 61.87 3i4n n ILE 250 Cb 0.42 -2.13 -0.03 0.00 -0.71 0.00 0.00 39.64 37.19 3i4n n ILE 250 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3i4n s SER 251 N 6.88 6.02 -1.01 4.38 1.04 -1.26 -3.86 113.70 125.90 3i4n s SER 251 Ca 0.71 0.79 -0.23 0.00 0.48 0.00 0.00 55.95 57.69 3i4n s SER 251 Cb -0.00 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.59 3i4n s SER 251 CO 0.15 -1.70 1.70 -0.36 0.98 0.00 0.00 173.24 174.02 3i4n s PHE 252 N 6.47 2.23 0.00 5.02 0.40 -0.97 -4.83 117.98 126.30 3i4n s PHE 252 Ca 0.66 -0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.73 3i4n s PHE 252 Cb -0.15 -4.41 0.00 0.00 0.51 0.00 0.00 43.02 38.97 3i4n s PHE 252 CO 0.30 -1.80 0.00 0.09 0.70 0.00 0.00 175.22 174.51 3i4n n ASN 253 N 11.18 0.00 -3.91 1.36 3.02 -1.26 -4.27 115.26 121.37 3i4n n ASN 253 Ca 0.38 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.82 3i4n n ASN 253 Cb 0.49 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.53 3i4n n ASN 253 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3i4n s GLU 254 N 0.00 0.14 -1.77 3.52 2.02 -1.26 -4.80 118.70 116.55 3i4n s GLU 254 Ca 0.00 -0.24 0.00 0.00 0.02 0.00 0.00 54.97 54.75 3i4n s GLU 254 Cb 0.00 0.05 0.00 0.00 0.10 0.00 0.00 34.13 34.28 3i4n s GLU 254 CO 0.00 -0.02 0.00 -1.13 0.02 0.00 0.00 175.26 174.13 3i4n n SER 255 N 2.45 -5.38 -4.35 -0.19 3.41 -1.26 -4.98 113.62 103.32 3i4n n SER 255 Ca -0.17 0.41 -0.30 0.00 -0.26 0.00 0.00 58.87 58.55 3i4n n SER 255 Cb 0.58 -4.35 -0.14 0.00 -0.26 0.00 0.00 64.21 60.04 3i4n n SER 255 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3i4n s GLN 256 N -3.39 1.71 1.11 4.33 -0.21 -1.26 -5.12 119.66 116.83 3i4n s GLN 256 Ca 0.00 -1.16 -0.18 0.00 0.02 0.00 0.00 55.36 54.04 3i4n s GLN 256 Cb 0.00 -1.96 0.28 0.00 1.00 0.00 0.00 33.01 32.33 3i4n s GLN 256 CO 0.00 0.50 0.62 0.54 -2.12 0.00 0.00 175.29 174.83 3i4n n ARG 257 N 1.60 -3.63 0.00 2.91 1.74 -1.26 -3.91 116.66 114.11 3i4n n ARG 257 Ca -0.17 -1.05 0.00 0.00 -0.77 0.00 0.00 57.85 55.86 3i4n n ARG 257 Cb 0.52 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.50 3i4n n ARG 257 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i4n n GLY 258 N -3.89 -2.05 0.00 -0.13 0.00 -1.25 -2.29 105.19 95.57 3i4n n GLY 258 Ca 0.10 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.79 3i4n n GLY 258 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i4n n GLU 259 N 0.00 0.00 -1.31 1.61 -0.58 -1.26 -4.18 120.64 114.92 3i4n n GLU 259 Ca 0.00 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.39 3i4n n GLU 259 Cb 0.00 0.00 0.10 0.00 -0.57 0.00 0.00 31.44 30.97 3i4n n GLU 259 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 3i4n n ASP 260 N 0.28 0.68 -0.32 1.62 -0.08 -0.93 -4.82 116.55 112.98 3i4n n ASP 260 Ca 0.00 0.65 0.14 0.00 -1.51 0.00 0.00 54.79 54.07 3i4n n ASP 260 Cb 0.00 -1.44 0.37 0.00 2.34 0.00 0.00 41.12 42.39 3i4n n ASP 260 CO 0.00 0.00 0.00 -0.78 0.12 0.00 0.00 177.20 176.54 3i4n h ASP 261 N -0.38 0.68 0.52 1.67 -0.00 -1.88 -0.84 116.42 116.18 3i4n h ASP 261 Ca -0.47 0.07 -0.03 0.00 -0.00 0.00 0.00 57.03 56.61 3i4n h ASP 261 Cb 1.32 -0.05 0.01 0.00 -0.00 0.00 0.00 39.33 40.61 3i4n h ASP 261 CO 0.47 0.27 -0.25 0.25 -0.00 0.00 0.00 179.24 179.98 3i4n h LEU 262 N 0.68 -0.59 -1.69 2.28 6.46 -1.90 -2.70 115.31 117.86 3i4n h LEU 262 Ca 0.54 -0.06 0.43 0.00 -0.12 0.00 0.00 57.88 58.67 3i4n h LEU 262 Cb 0.94 0.15 -0.09 0.00 -0.73 0.00 0.00 40.66 40.93 3i4n h LEU 262 CO -0.30 -0.28 0.98 0.74 -0.62 0.00 0.00 178.44 178.97 3i4n h THR 263 N -0.91 0.20 0.37 1.05 2.02 -1.46 0.22 112.91 114.41 3i4n h THR 263 Ca -0.07 -0.03 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 3i4n h THR 263 Cb 0.61 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 3i4n h THR 263 CO 0.12 0.01 -0.18 -0.26 0.37 0.00 0.00 175.52 175.58 3i4n h PHE 264 N 0.08 -0.46 -0.35 3.16 0.05 -1.11 -2.31 116.94 116.01 3i4n h PHE 264 Ca 0.77 -0.01 0.10 0.00 3.82 0.00 0.00 57.97 62.65 3i4n h PHE 264 Cb 2.70 0.15 -0.01 0.00 2.00 0.00 0.00 35.95 40.79 3i4n h PHE 264 CO -0.00 -0.13 0.53 -0.22 -0.18 0.00 0.00 178.31 178.31 3i4n h LYS 265 N -0.96 0.00 0.06 1.51 1.63 -0.28 0.20 116.57 118.74 3i4n h LYS 265 Ca -0.05 0.00 -0.21 0.00 -0.85 0.00 0.00 60.65 59.54 3i4n h LYS 265 Cb 0.53 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.15 3i4n h LYS 265 CO 0.08 0.00 -1.08 -0.07 -3.45 0.00 0.00 179.45 174.94 3i4n h LEU 266 N 0.00 0.21 -1.74 5.20 3.38 -1.40 -2.57 115.31 118.39 3i4n h LEU 266 Ca 0.17 -0.79 0.17 0.00 0.09 0.00 0.00 57.88 57.52 3i4n h LEU 266 Cb 1.23 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.87 3i4n h LEU 266 CO -0.00 1.46 0.51 0.00 0.09 0.00 0.00 178.44 180.49 3i4n h ALA 267 N -0.15 2.33 0.54 1.53 0.00 -0.12 0.11 119.26 123.50 3i4n h ALA 267 Ca -0.25 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 3i4n h ALA 267 Cb 1.49 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.27 3i4n h ALA 267 CO -0.02 -0.55 -0.26 -0.44 0.00 0.00 0.00 179.25 177.98 3i4n h ASP 268 N 0.24 -0.61 -0.84 0.00 3.32 -0.94 -2.33 116.42 115.27 3i4n h ASP 268 Ca 0.36 0.02 0.17 0.00 0.02 0.00 0.00 57.03 57.60 3i4n h ASP 268 Cb 1.06 0.16 -0.16 0.00 0.22 0.00 0.00 39.33 40.61 3i4n h ASP 268 CO -0.08 -0.22 -0.22 0.40 -1.72 0.00 0.00 179.24 177.41 3i4n h ILE 269 N -1.16 0.16 0.40 0.35 2.04 -0.89 -0.73 117.51 117.69 3i4n h ILE 269 Ca -0.07 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 3i4n h ILE 269 Cb 0.55 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 3i4n h ILE 269 CO 0.12 0.00 -0.40 0.25 0.00 0.00 0.00 178.15 178.12 3i4n h LEU 270 N -0.00 -1.09 -0.43 1.44 5.85 -0.83 -1.80 115.31 118.45 3i4n h LEU 270 Ca 0.40 0.09 0.09 0.00 0.84 0.00 0.00 57.88 59.30 3i4n h LEU 270 Cb 0.61 0.36 -0.09 0.00 0.37 0.00 0.00 40.66 41.91 3i4n h LEU 270 CO -0.87 -0.55 -0.29 0.11 -0.34 0.00 0.00 178.44 176.50 3i4n h LYS 271 N -0.82 -0.20 0.00 1.25 1.57 -0.61 0.38 116.57 118.14 3i4n h LYS 271 Ca -0.03 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3i4n h LYS 271 Cb 0.73 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.09 3i4n h LYS 271 CO -0.06 -0.14 0.01 0.00 -0.57 0.00 0.00 179.45 178.70 3i4n n ALA 272 N -3.00 0.97 -0.08 3.86 0.00 -0.43 -1.05 120.51 120.78 3i4n n ALA 272 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.37 3i4n n ALA 272 Cb 0.33 -0.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.76 3i4n n ALA 272 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3i4n n ASN 273 N -1.50 1.84 -0.30 0.00 5.15 0.12 -3.75 115.26 116.82 3i4n n ASN 273 Ca -0.00 0.55 0.09 0.00 -0.60 0.00 0.00 54.58 54.62 3i4n n ASN 273 Cb 0.02 -0.87 0.25 0.00 -0.53 0.00 0.00 39.78 38.64 3i4n n ASN 273 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 3i4n h ILE 274 N -1.00 0.67 -0.35 -1.44 2.04 -0.45 0.47 117.51 117.45 3i4n h ILE 274 Ca -0.10 -0.20 0.08 0.00 1.00 0.00 0.00 64.86 65.64 3i4n h ILE 274 Cb 0.76 0.04 -0.08 0.00 -0.74 0.00 0.00 36.82 36.80 3i4n h ILE 274 CO -0.06 0.11 -0.17 0.77 0.00 0.00 0.00 178.15 178.80 3i4n h SER 275 N 0.58 -0.57 0.22 1.72 4.64 -1.27 -1.82 113.55 117.05 3i4n h SER 275 Ca 0.49 0.14 -0.01 0.00 -0.47 0.00 0.00 61.79 61.94 3i4n h SER 275 Cb 0.76 0.31 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 3i4n h SER 275 CO -0.40 -0.20 -0.17 0.25 -0.87 0.00 0.00 176.83 175.44 3i4n h LEU 276 N -0.11 -0.45 -1.01 5.97 5.85 -1.01 -2.96 115.31 121.59 3i4n h LEU 276 Ca 0.18 0.03 0.25 0.00 0.84 0.00 0.00 57.88 59.18 3i4n h LEU 276 Cb 0.38 0.14 -0.13 0.00 0.37 0.00 0.00 40.66 41.42 3i4n h LEU 276 CO -0.42 -0.24 0.60 -0.08 -0.34 0.00 0.00 178.44 177.95 3i4n h GLU 277 N -0.37 0.55 0.00 1.25 4.81 -1.30 0.51 114.58 120.02 3i4n h GLU 277 Ca -0.03 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3i4n h GLU 277 Cb 0.31 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.57 3i4n h GLU 277 CO 0.01 0.36 0.00 2.41 -0.73 0.00 0.00 179.01 181.06 3i4n n THR 278 N -4.89 0.08 0.46 0.32 -1.04 -0.69 -1.40 114.28 107.12 3i4n n THR 278 Ca 0.27 0.02 0.11 0.00 -2.04 0.00 0.00 64.05 62.41 3i4n n THR 278 Cb 0.76 -0.62 -0.08 0.00 -1.82 0.00 0.00 70.33 68.57 3i4n n THR 278 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3i4n n LEU 279 N -1.10 0.51 -0.04 -4.42 4.77 0.18 -4.04 117.00 112.86 3i4n n LEU 279 Ca 0.17 -0.13 -0.03 0.00 -0.03 0.00 0.00 56.01 55.99 3i4n n LEU 279 Cb 0.13 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 3i4n n LEU 279 CO 0.16 0.07 -0.26 -0.62 -1.33 0.00 0.00 177.39 175.41 3i4n n GLU 280 N -1.97 0.24 0.00 3.23 1.02 -0.79 -2.94 120.64 119.43 3i4n n GLU 280 Ca 0.00 0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 3i4n n GLU 280 Cb 0.46 -1.05 0.00 0.00 -0.02 0.00 0.00 31.44 30.82 3i4n n GLU 280 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3i4n n HIS 281 N -3.42 0.00 -3.21 -0.32 8.25 -0.49 -4.52 115.22 111.51 3i4n n HIS 281 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 3i4n n HIS 281 Cb 0.20 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.31 3i4n n HIS 281 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3i4n n ASN 282 N -0.69 0.00 -3.85 0.41 3.02 -1.26 -5.04 115.26 107.86 3i4n n ASN 282 Ca 0.00 -0.60 -0.11 0.00 -0.03 0.00 0.00 54.58 53.84 3i4n n ASN 282 Cb 0.00 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.06 3i4n n ASN 282 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3i4n n GLY 283 N 0.00 -0.24 3.42 7.41 0.00 -1.26 -4.79 105.19 109.72 3i4n n GLY 283 Ca 0.00 -0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 3i4n n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4n s ALA 284 N 0.00 3.48 0.00 4.61 0.00 -1.15 -4.82 121.76 123.88 3i4n s ALA 284 Ca 0.64 -2.69 -0.00 0.00 0.00 0.00 0.00 51.96 49.91 3i4n s ALA 284 Cb -0.41 -3.85 -0.01 0.00 0.00 0.00 0.00 23.12 18.85 3i4n s ALA 284 CO 0.28 -2.73 1.45 -0.35 0.00 0.00 0.00 175.76 174.41 3i4n n PRO 285 N 6.15 0.72 0.00 0.00 -0.04 -1.26 -4.87 135.00 135.71 3i4n n PRO 285 Ca 0.14 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 3i4n n PRO 285 Cb 0.47 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.75 3i4n n PRO 285 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3i4n n HIS 286 N 1.69 0.00 0.03 0.54 8.25 -1.26 -1.94 115.22 122.54 3i4n n HIS 286 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 3i4n n HIS 286 Cb 0.36 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.47 3i4n n HIS 286 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3i4n n HIS 287 N 0.00 0.00 0.00 4.41 8.25 -1.26 0.18 115.22 126.80 3i4n n HIS 287 Ca 0.00 -0.20 0.00 0.00 -0.26 0.00 0.00 57.72 57.26 3i4n n HIS 287 Cb 0.00 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 30.87 3i4n n HIS 287 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3i4n n ALA 288 N 1.45 1.82 0.00 -1.41 0.00 -0.82 -4.63 120.51 116.93 3i4n n ALA 288 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3i4n n ALA 288 Cb 0.13 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.57 3i4n n ALA 288 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3i4n h ILE 289 N 0.00 0.01 -1.12 0.00 2.04 0.18 -3.30 117.51 115.32 3i4n h ILE 289 Ca 0.00 -0.92 0.40 0.00 1.00 0.00 0.00 64.86 65.34 3i4n h ILE 289 Cb 0.00 0.02 -0.12 0.00 -0.74 0.00 0.00 36.82 35.97 3i4n h ILE 289 CO 0.00 0.00 0.71 -1.84 0.00 0.00 0.00 178.15 177.02 3i4n n GLU 290 N -4.86 -0.03 0.28 2.37 0.28 -1.24 0.39 120.64 117.83 3i4n n GLU 290 Ca -0.02 1.09 0.15 0.00 -0.16 0.00 0.00 57.16 58.22 3i4n n GLU 290 Cb 0.05 -2.11 0.83 0.00 1.43 0.00 0.00 31.44 31.64 3i4n n GLU 290 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 3i4n h GLU 291 N 0.00 0.00 -0.27 3.44 5.08 -1.82 -0.20 114.58 120.81 3i4n h GLU 291 Ca 0.75 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.11 3i4n h GLU 291 Cb 2.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.59 3i4n h GLU 291 CO -0.44 0.07 0.00 0.00 -1.00 0.00 0.00 179.01 177.63 3i4n n ALA 292 N -2.27 2.38 -0.06 3.43 0.00 1.27 -4.46 120.51 120.81 3i4n n ALA 292 Ca -0.02 -0.91 -0.04 0.00 0.00 0.00 0.00 53.44 52.47 3i4n n ALA 292 Cb 0.17 -0.64 -0.01 0.00 0.00 0.00 0.00 19.45 18.97 3i4n n ALA 292 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3i4n h GLU 293 N 3.38 0.00 0.00 0.00 4.81 -0.21 -3.35 114.58 119.21 3i4n h GLU 293 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3i4n h GLU 293 Cb 0.80 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.18 3i4n h GLU 293 CO 0.00 0.00 0.50 0.66 -0.73 0.00 0.00 179.01 179.44 3i4n h SER 294 N -0.89 0.00 -0.33 1.04 4.64 -1.70 1.64 113.55 117.96 3i4n h SER 294 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 3i4n h SER 294 Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 3i4n h SER 294 CO 0.00 0.00 -0.33 0.25 -0.87 0.00 0.00 176.83 175.88 3i4n h LEU 295 N 0.00 0.90 -0.20 5.97 5.85 -1.78 -0.35 115.31 125.70 3i4n h LEU 295 Ca 0.00 -0.38 -0.22 0.00 0.84 0.00 0.00 57.88 58.12 3i4n h LEU 295 Cb 1.00 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.79 3i4n h LEU 295 CO 0.00 1.15 -0.89 0.25 -0.34 0.00 0.00 178.44 178.61 3i4n h LEU 296 N 0.72 0.63 -1.72 2.25 5.85 0.22 -2.59 115.31 120.68 3i4n h LEU 296 Ca 0.07 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.32 3i4n h LEU 296 Cb 0.89 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3i4n h LEU 296 CO 0.08 1.26 0.18 -0.61 -0.34 0.00 0.00 178.44 179.01 3i4n h GLN 297 N 0.31 0.37 0.03 1.25 5.75 -1.24 -2.00 115.11 119.57 3i4n h GLN 297 Ca -0.07 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.40 3i4n h GLN 297 Cb 1.51 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.98 3i4n h GLN 297 CO 0.16 0.25 -0.01 0.35 -2.65 0.00 0.00 178.83 176.92 3i4n h PHE 298 N 0.38 -0.04 0.00 3.99 3.57 -0.79 -3.06 116.94 120.98 3i4n h PHE 298 Ca 0.10 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.60 3i4n h PHE 298 Cb -0.04 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.72 3i4n h PHE 298 CO 0.00 -0.02 0.00 0.72 -2.23 0.00 0.00 178.31 176.78 3i4n n HIS 299 N -2.16 0.00 0.00 0.41 8.25 -1.00 0.54 115.22 121.26 3i4n n HIS 299 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 3i4n n HIS 299 Cb 0.02 -0.49 0.00 0.00 1.12 0.00 0.00 29.99 30.64 3i4n n HIS 299 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3i4n n VAL 300 N -2.71 0.57 -0.10 1.59 0.31 -0.76 0.93 118.33 118.14 3i4n n VAL 300 Ca 0.00 0.28 -0.18 0.00 -0.01 0.00 0.00 64.34 64.43 3i4n n VAL 300 Cb 0.00 -1.28 -0.09 0.00 -0.91 0.00 0.00 33.84 31.56 3i4n n VAL 300 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i4n n ALA 301 N -1.03 1.58 0.16 3.52 0.00 0.12 -4.46 120.51 120.40 3i4n n ALA 301 Ca 0.00 -0.87 0.03 0.00 0.00 0.00 0.00 53.44 52.60 3i4n n ALA 301 Cb 0.14 0.12 0.22 0.00 0.00 0.00 0.00 19.45 19.92 3i4n n ALA 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n h THR 302 N -0.35 1.07 -0.64 0.00 1.03 0.40 -0.11 112.91 114.30 3i4n h THR 302 Ca -0.50 -1.90 0.11 0.00 -0.01 0.00 0.00 66.41 64.11 3i4n h THR 302 Cb 1.60 2.12 -0.04 0.00 -1.07 0.00 0.00 68.15 70.76 3i4n h THR 302 CO -0.19 0.49 0.43 0.22 -0.01 0.00 0.00 175.52 176.45 3i4n h TYR 303 N 0.00 0.44 0.05 0.00 3.20 0.33 -2.06 116.97 118.94 3i4n h TYR 303 Ca -0.00 0.01 -0.36 0.00 3.14 0.00 0.00 58.73 61.52 3i4n h TYR 303 Cb 1.08 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 39.16 3i4n h TYR 303 CO 0.00 0.20 -2.11 -1.33 -1.64 0.00 0.00 178.16 173.28 3i4n n MET 304 N -4.47 0.70 -3.71 1.82 2.81 -1.06 -2.53 117.12 110.67 3i4n n MET 304 Ca 0.11 0.21 -0.13 0.00 -1.81 0.00 0.00 57.70 56.08 3i4n n MET 304 Cb 0.41 -1.66 -0.13 0.00 -0.71 0.00 0.00 33.22 31.14 3i4n n MET 304 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3i4n s ASP 305 N -6.49 -0.11 0.00 7.83 -1.08 -0.08 -1.36 116.67 115.38 3i4n s ASP 305 Ca -0.20 0.54 0.06 0.00 -0.52 0.00 0.00 52.55 52.44 3i4n s ASP 305 Cb 0.07 0.48 0.03 0.00 -1.46 0.00 0.00 42.92 42.04 3i4n s ASP 305 CO 0.75 -0.18 0.63 -3.20 0.52 0.00 0.00 175.17 173.69 3i4n n ASN 306 N 4.50 1.34 -3.95 -0.34 2.85 -1.23 -3.46 115.26 114.97 3i4n n ASN 306 Ca -0.21 -1.17 -0.34 0.00 -0.11 0.00 0.00 54.58 52.75 3i4n n ASN 306 Cb 0.52 0.16 -0.06 0.00 1.24 0.00 0.00 39.78 41.64 3i4n n ASN 306 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3i4n n ASP 307 N 0.12 4.26 -1.06 1.20 8.00 -1.26 -4.67 116.55 123.15 3i4n n ASP 307 Ca 0.03 -3.23 0.00 0.00 0.71 0.00 0.00 54.79 52.30 3i4n n ASP 307 Cb 0.15 -0.98 0.00 0.00 -0.02 0.00 0.00 41.12 40.27 3i4n n ASP 307 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3i4n n ILE 308 N 1.88 0.00 -0.08 0.53 5.41 -1.26 -5.09 119.36 120.74 3i4n n ILE 308 Ca 0.24 0.00 -0.18 0.00 1.00 0.00 0.00 62.75 63.80 3i4n n ILE 308 Cb 0.37 -0.40 -0.12 0.00 -0.71 0.00 0.00 39.64 38.78 3i4n n ILE 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4n h ALA 309 N 0.52 0.14 0.00 -1.39 0.00 -2.00 -3.36 119.26 113.17 3i4n h ALA 309 Ca 0.00 -0.87 -0.34 0.00 0.00 0.00 0.00 54.91 53.70 3i4n h ALA 309 Cb 0.00 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3i4n h ALA 309 CO 0.00 0.38 1.46 0.41 0.00 0.00 0.00 179.25 181.50 3i4n n GLY 310 N 1.53 3.19 0.00 0.00 0.00 -1.26 -4.87 105.19 103.78 3i4n n GLY 310 Ca -0.21 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.70 3i4n n GLY 310 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3i4n n GLN 311 N 3.17 0.00 -0.51 1.61 6.02 -1.26 -4.81 117.38 121.60 3i4n n GLN 311 Ca 0.49 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.48 3i4n n GLN 311 Cb 0.49 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.75 3i4n n GLN 311 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 3i4n n PRO 312 N 0.00 0.00 -0.02 -1.09 -0.02 -1.26 -4.61 135.00 128.00 3i4n n PRO 312 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3i4n n PRO 312 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 3i4n n PRO 312 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3i4n n GLN 313 N -0.08 0.07 -3.44 -0.52 1.13 -1.26 -4.73 117.38 108.55 3i4n n GLN 313 Ca 0.00 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.98 3i4n n GLN 313 Cb 0.00 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 28.89 3i4n n GLN 313 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3i4n n ALA 314 N 1.56 -1.35 -1.61 -1.58 0.00 -1.26 -4.59 120.51 111.68 3i4n n ALA 314 Ca 0.00 -0.10 -0.42 0.00 0.00 0.00 0.00 53.44 52.92 3i4n n ALA 314 Cb 0.03 -0.39 -0.03 0.00 0.00 0.00 0.00 19.45 19.06 3i4n n ALA 314 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3i4n s LEU 315 N -4.49 3.43 -0.86 0.00 1.43 -1.26 -4.57 118.68 112.36 3i4n s LEU 315 Ca 0.07 1.77 -0.25 0.00 -1.03 0.00 0.00 54.13 54.68 3i4n s LEU 315 Cb -0.04 -3.38 -0.09 0.00 0.03 0.00 0.00 46.19 42.71 3i4n s LEU 315 CO 0.20 -2.08 2.14 -1.58 0.23 0.00 0.00 176.35 175.26 3i4n s GLN 316 N 6.60 2.12 0.00 1.70 -0.44 0.18 -4.71 119.66 125.11 3i4n s GLN 316 Ca 1.00 0.02 0.00 0.00 -2.50 0.00 0.00 55.36 53.88 3i4n s GLN 316 Cb -0.31 -4.95 0.00 0.00 -1.64 0.00 0.00 33.01 26.12 3i4n s GLN 316 CO 0.34 -3.88 0.00 1.63 0.50 0.00 0.00 175.29 173.87 3i4n n LYS 317 N 8.82 0.00 0.00 1.67 5.02 -1.26 -3.64 118.16 128.77 3i4n n LYS 317 Ca 0.43 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 3i4n n LYS 317 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.46 3i4n n LYS 317 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3i4n n SER 318 N 0.00 0.00 0.00 4.39 3.41 -1.26 -4.66 113.62 115.50 3i4n n SER 318 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3i4n n SER 318 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3i4n n SER 318 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i4n n GLY 319 N 0.00 2.94 3.40 5.00 0.00 -1.24 -5.05 105.19 110.24 3i4n n GLY 319 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 3i4n n GLY 319 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3i4n n ARG 320 N -0.58 0.31 0.08 1.61 0.63 -1.24 -4.58 116.66 112.90 3i4n n ARG 320 Ca 0.00 0.11 -0.10 0.00 -0.92 0.00 0.00 57.85 56.94 3i4n n ARG 320 Cb 0.00 -1.25 -0.08 0.00 0.45 0.00 0.00 32.46 31.58 3i4n n ARG 320 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 3i4n h PRO 321 N 0.81 0.15 -2.23 -0.14 0.11 -1.86 0.50 132.00 129.34 3i4n h PRO 321 Ca -0.36 -0.22 0.00 0.00 0.11 0.00 0.00 66.00 65.53 3i4n h PRO 321 Cb 1.42 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.60 3i4n h PRO 321 CO 0.52 1.04 0.00 1.55 -0.21 0.00 0.00 178.00 180.90 3i4n n VAL 322 N -3.53 -2.23 -1.55 3.15 3.14 -1.26 -4.18 118.33 111.87 3i4n n VAL 322 Ca -0.04 0.00 -0.40 0.00 -2.96 0.00 0.00 64.34 60.95 3i4n n VAL 322 Cb 0.91 -2.64 -0.04 0.00 -1.06 0.00 0.00 33.84 31.00 3i4n n VAL 322 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 3i4n n LYS 323 N 0.27 1.20 -1.47 1.45 4.01 -1.26 -4.86 118.16 117.50 3i4n n LYS 323 Ca 0.00 0.16 -0.33 0.00 -0.51 0.00 0.00 58.31 57.63 3i4n n LYS 323 Cb 0.00 -3.16 0.08 0.00 -0.51 0.00 0.00 35.03 31.44 3i4n n LYS 323 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 3i4n s SER 324 N 10.56 4.55 0.17 4.39 1.04 -1.26 -4.83 113.70 128.31 3i4n s SER 324 Ca 1.03 2.07 -0.17 0.00 0.48 0.00 0.00 55.95 59.35 3i4n s SER 324 Cb -0.36 -2.56 0.09 0.00 0.10 0.00 0.00 66.02 63.29 3i4n s SER 324 CO 0.32 -2.01 1.67 0.40 0.98 0.00 0.00 173.24 174.60 3i4n h ILE 325 N -0.48 0.59 -0.96 -1.02 2.04 -1.47 -0.47 117.51 115.75 3i4n h ILE 325 Ca -0.46 0.00 0.30 0.00 1.00 0.00 0.00 64.86 65.70 3i4n h ILE 325 Cb 1.26 0.59 -0.16 0.00 -0.74 0.00 0.00 36.82 37.76 3i4n h ILE 325 CO 0.51 0.00 0.36 0.08 0.00 0.00 0.00 178.15 179.10 3i4n h ARG 326 N -0.01 0.16 0.00 2.37 0.11 -1.51 1.05 114.38 116.54 3i4n h ARG 326 Ca 0.19 -0.01 -0.02 0.00 0.10 0.00 0.00 59.98 60.24 3i4n h ARG 326 Cb 0.30 -0.04 -0.00 0.00 1.11 0.00 0.00 29.97 31.34 3i4n h ARG 326 CO -0.41 0.11 -0.10 0.00 0.10 0.00 0.00 179.97 179.66 3i4n h ALA 327 N 1.88 1.72 0.00 0.08 0.00 -1.34 -1.53 119.26 120.07 3i4n h ALA 327 Ca 0.67 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.46 3i4n h ALA 327 Cb 1.52 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 3i4n h ALA 327 CO -0.71 0.13 -0.16 0.00 0.00 0.00 0.00 179.25 178.51 3i4n h ARG 328 N 0.00 0.00 0.00 0.00 3.08 0.13 -3.22 114.38 114.37 3i4n h ARG 328 Ca -0.00 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.73 3i4n h ARG 328 Cb 0.19 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.18 3i4n h ARG 328 CO 0.01 0.16 -2.21 1.28 -1.07 0.00 0.00 179.97 178.14 3i4n n LEU 329 N -3.71 0.00 -2.77 3.04 4.77 -0.70 -1.37 117.00 116.26 3i4n n LEU 329 Ca -0.02 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.67 3i4n n LEU 329 Cb 0.27 0.43 -0.01 0.00 -2.33 0.00 0.00 43.42 41.78 3i4n n LEU 329 CO 0.32 0.43 -0.10 1.17 -1.33 0.00 0.00 177.39 177.87 3i4n n LYS 330 N -2.64 0.00 -1.16 3.23 4.81 -0.66 -4.10 118.16 117.63 3i4n n LYS 330 Ca -0.28 0.00 -0.46 0.00 -0.87 0.00 0.00 58.31 56.70 3i4n n LYS 330 Cb 1.06 -0.64 -0.06 0.00 0.02 0.00 0.00 35.03 35.41 3i4n n LYS 330 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3i4n n GLY 331 N 1.35 -0.15 1.85 3.14 0.00 -1.26 -2.39 105.19 107.73 3i4n n GLY 331 Ca 0.10 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.72 3i4n n GLY 331 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3i4n n LYS 332 N 1.45 -5.16 0.00 1.61 3.00 -1.26 -4.46 118.16 113.34 3i4n n LYS 332 Ca 0.17 3.72 0.00 0.00 -0.00 0.00 0.00 58.31 62.19 3i4n n LYS 332 Cb 0.04 -4.09 0.00 0.00 0.00 0.00 0.00 35.03 30.98 3i4n n LYS 332 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3i4n n GLU 333 N 0.59 0.00 -2.53 1.64 -0.58 -1.26 -4.74 120.64 113.76 3i4n n GLU 333 Ca 0.00 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.39 3i4n n GLU 333 Cb 0.00 -0.34 -0.04 0.00 -0.57 0.00 0.00 31.44 30.50 3i4n n GLU 333 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 3i4n s GLY 334 N -0.56 2.60 0.36 0.62 0.00 -1.00 -4.57 107.32 104.76 3i4n s GLY 334 Ca 0.00 0.66 0.27 0.00 0.00 0.00 0.00 44.72 45.64 3i4n s GLY 334 CO 0.00 1.02 1.24 -2.13 0.00 0.00 0.00 173.10 173.23 3i4n n ARG 335 N -0.64 -0.03 0.00 2.90 3.00 -0.47 -0.07 116.66 121.35 3i4n n ARG 335 Ca 0.08 0.99 0.00 0.00 -0.00 0.00 0.00 57.85 58.92 3i4n n ARG 335 Cb 0.51 -1.97 0.00 0.00 0.00 0.00 0.00 32.46 31.00 3i4n n ARG 335 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 3i4n n ILE 336 N -4.25 0.00 -0.20 5.15 2.08 -1.26 -1.74 119.36 119.15 3i4n n ILE 336 Ca 0.32 0.32 -0.02 0.00 0.56 0.00 0.00 62.75 63.93 3i4n n ILE 336 Cb 1.27 -0.81 0.18 0.00 -0.75 0.00 0.00 39.64 39.53 3i4n n ILE 336 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 3i4n h ARG 337 N 0.00 0.97 -0.02 0.38 2.43 -1.68 -1.74 114.38 114.72 3i4n h ARG 337 Ca 0.00 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 3i4n h ARG 337 Cb 0.00 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 3i4n h ARG 337 CO 0.00 0.77 -0.32 0.41 -1.51 0.00 0.00 179.97 179.32 3i4n n GLY 338 N -1.05 0.28 0.00 2.80 0.00 0.89 -3.93 105.19 104.19 3i4n n GLY 338 Ca 0.06 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.44 3i4n n GLY 338 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3i4n n ASN 339 N 0.34 3.83 -0.03 1.61 3.02 -1.10 -4.62 115.26 118.32 3i4n n ASN 339 Ca 0.11 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.61 3i4n n ASN 339 Cb 0.50 0.60 -0.03 0.00 -0.61 0.00 0.00 39.78 40.23 3i4n n ASN 339 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3i4n n LEU 340 N -1.37 2.63 -0.16 3.41 4.77 -0.71 -4.52 117.00 121.05 3i4n n LEU 340 Ca 0.00 -0.03 0.15 0.00 -0.03 0.00 0.00 56.01 56.10 3i4n n LEU 340 Cb 0.17 -0.20 0.78 0.00 -2.33 0.00 0.00 43.42 41.84 3i4n n LEU 340 CO 0.00 0.56 1.01 0.23 -1.33 0.00 0.00 177.39 177.86 3i4n n MET 341 N -2.64 1.16 -3.47 3.23 2.81 -0.71 -4.57 117.12 112.94 3i4n n MET 341 Ca -0.12 -0.32 0.01 0.00 -1.81 0.00 0.00 57.70 55.46 3i4n n MET 341 Cb 0.64 -1.49 -0.05 0.00 -0.71 0.00 0.00 33.22 31.60 3i4n n MET 341 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3i4n s GLY 342 N -2.06 0.10 0.35 3.03 0.00 -1.25 -5.01 107.32 102.48 3i4n s GLY 342 Ca 0.43 3.34 0.03 0.00 0.00 0.00 0.00 44.72 48.52 3i4n s GLY 342 CO 0.37 3.01 0.09 0.54 0.00 0.00 0.00 173.10 177.11 3i4n s LYS 343 N 1.82 1.74 0.17 2.90 1.02 -1.26 -3.26 119.74 122.87 3i4n s LYS 343 Ca -0.05 -2.01 -0.06 0.00 0.02 0.00 0.00 55.97 53.88 3i4n s LYS 343 Cb -0.04 -0.73 -0.06 0.00 -0.52 0.00 0.00 37.83 36.49 3i4n s LYS 343 CO -0.15 -0.31 0.43 1.03 -0.92 0.00 0.00 175.35 175.43 3i4n s ARG 344 N -3.84 3.66 0.28 1.68 0.52 -1.26 -5.08 118.95 114.90 3i4n s ARG 344 Ca 0.31 -0.01 0.02 0.00 -0.52 0.00 0.00 55.73 55.53 3i4n s ARG 344 Cb 0.06 -2.79 -0.04 0.00 0.52 0.00 0.00 34.95 32.70 3i4n s ARG 344 CO 0.15 0.41 0.13 0.14 0.02 0.00 0.00 175.30 176.15 3i4n s VAL 345 N -1.73 0.42 0.46 3.52 -7.23 -1.26 -5.15 120.40 109.43 3i4n s VAL 345 Ca 0.43 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 3i4n s VAL 345 Cb -0.12 -2.56 0.00 0.00 0.56 0.00 0.00 36.38 34.26 3i4n s VAL 345 CO 0.24 0.00 0.68 -1.81 -0.31 0.00 0.00 175.10 173.90 3i4n s ASP 346 N -3.34 5.76 -0.88 4.85 1.01 -1.26 -4.58 116.67 118.22 3i4n s ASP 346 Ca 0.36 0.22 -0.04 0.00 0.71 0.00 0.00 52.55 53.80 3i4n s ASP 346 Cb 0.06 -1.42 -0.02 0.00 1.01 0.00 0.00 42.92 42.56 3i4n s ASP 346 CO 0.16 -0.75 0.75 0.49 0.21 0.00 0.00 175.17 176.02 3i4n n PHE 347 N -2.10 -2.59 -3.83 4.23 3.01 -1.26 -4.81 117.46 110.12 3i4n n PHE 347 Ca 0.02 0.94 -0.12 0.00 1.01 0.00 0.00 57.45 59.30 3i4n n PHE 347 Cb 0.58 -3.84 -0.09 0.00 -0.01 0.00 0.00 39.48 36.12 3i4n n PHE 347 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3i4n s SER 348 N -3.15 -0.06 -0.03 4.37 1.04 -1.26 -1.69 113.70 112.91 3i4n s SER 348 Ca 0.17 -0.08 -0.11 0.00 0.48 0.00 0.00 55.95 56.41 3i4n s SER 348 Cb -0.04 0.25 0.02 0.00 0.10 0.00 0.00 66.02 66.35 3i4n s SER 348 CO 0.78 -0.39 0.24 0.00 0.98 0.00 0.00 173.24 174.85 3i4n s ALA 349 N -1.33 -0.60 -0.08 5.32 0.00 0.10 -4.97 121.76 120.20 3i4n s ALA 349 Ca -0.14 0.27 -0.03 0.00 0.00 0.00 0.00 51.96 52.06 3i4n s ALA 349 Cb -0.07 -0.03 0.04 0.00 0.00 0.00 0.00 23.12 23.06 3i4n s ALA 349 CO 0.03 -0.21 0.17 0.50 0.00 0.00 0.00 175.76 176.25 3i4n s ARG 350 N -1.00 0.12 0.25 0.00 3.52 -1.26 -0.25 118.95 120.33 3i4n s ARG 350 Ca -0.11 0.43 -0.05 0.00 -0.13 0.00 0.00 55.73 55.87 3i4n s ARG 350 Cb -0.05 -0.17 0.02 0.00 -1.56 0.00 0.00 34.95 33.19 3i4n s ARG 350 CO 0.02 -0.17 0.41 0.25 -0.81 0.00 0.00 175.30 175.00 3i4n n THR 351 N 4.29 0.00 -3.02 4.11 -2.24 -1.19 -4.97 114.28 111.26 3i4n n THR 351 Ca -0.25 -0.97 -0.40 0.00 -2.27 0.00 0.00 64.05 60.16 3i4n n THR 351 Cb 0.52 0.70 -0.05 0.00 -2.10 0.00 0.00 70.33 69.40 3i4n n THR 351 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3i4n s VAL 352 N -2.57 4.83 -0.06 2.28 -7.23 -1.26 -1.78 120.40 114.61 3i4n s VAL 352 Ca 0.16 1.55 -0.16 0.00 -1.81 0.00 0.00 61.98 61.73 3i4n s VAL 352 Cb -0.02 -4.08 -0.05 0.00 0.56 0.00 0.00 36.38 32.79 3i4n s VAL 352 CO 0.11 0.34 0.41 0.27 -0.31 0.00 0.00 175.10 175.92 3i4n s ILE 353 N 0.15 5.12 -0.15 -0.62 -4.36 -0.45 -1.90 121.20 119.00 3i4n s ILE 353 Ca 0.38 0.82 -0.03 0.00 -0.26 0.00 0.00 60.65 61.56 3i4n s ILE 353 Cb -0.20 -3.73 0.05 0.00 1.25 0.00 0.00 42.46 39.84 3i4n s ILE 353 CO 0.21 0.47 0.05 -0.94 0.24 0.00 0.00 174.94 174.98 3i4n s SER 354 N -0.33 2.30 0.65 4.36 1.04 -0.62 -4.67 113.70 116.43 3i4n s SER 354 Ca 0.23 -0.53 -0.17 0.00 0.48 0.00 0.00 55.95 55.96 3i4n s SER 354 Cb -0.16 -0.41 -0.08 0.00 0.10 0.00 0.00 66.02 65.48 3i4n s SER 354 CO 0.11 -0.29 0.39 0.61 0.98 0.00 0.00 173.24 175.03 3i4n n GLY 355 N 5.17 -1.86 2.79 7.32 0.00 -1.26 -4.09 105.19 113.26 3i4n n GLY 355 Ca -0.07 -0.29 -0.15 0.00 0.00 0.00 0.00 46.02 45.51 3i4n n GLY 355 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i4n s ASP 356 N -1.27 0.10 -0.14 1.61 -1.08 -0.80 -4.88 116.67 110.20 3i4n s ASP 356 Ca 0.65 0.03 0.07 0.00 -0.52 0.00 0.00 52.55 52.77 3i4n s ASP 356 Cb -0.40 -0.08 0.44 0.00 -1.46 0.00 0.00 42.92 41.43 3i4n s ASP 356 CO 0.59 -0.11 1.22 -0.81 0.52 0.00 0.00 175.17 176.57 3i4n n PRO 357 N 4.04 3.01 -0.07 4.34 -0.04 -1.26 -3.92 135.00 141.10 3i4n n PRO 357 Ca -0.26 -1.72 0.02 0.00 -0.04 0.00 0.00 63.50 61.49 3i4n n PRO 357 Cb 0.51 -1.90 0.02 0.00 -0.04 0.00 0.00 33.50 32.10 3i4n n PRO 357 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3i4n n ASN 358 N 0.27 1.18 -4.60 3.54 3.02 -1.26 -4.59 115.26 112.83 3i4n n ASN 358 Ca 0.17 -1.85 -0.32 0.00 -0.03 0.00 0.00 54.58 52.55 3i4n n ASN 358 Cb 0.81 -0.09 -0.10 0.00 -0.61 0.00 0.00 39.78 39.79 3i4n n ASN 358 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3i4n s LEU 359 N -0.85 3.19 0.58 3.41 1.43 -1.26 -5.09 118.68 120.09 3i4n s LEU 359 Ca 0.05 -0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 52.82 3i4n s LEU 359 Cb 0.04 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 3i4n s LEU 359 CO 0.00 0.29 1.22 -1.61 0.23 0.00 0.00 176.35 176.48 3i4n s GLU 360 N -1.40 3.02 0.21 1.70 0.41 -1.26 -4.70 118.70 116.67 3i4n s GLU 360 Ca 0.17 1.87 -0.10 0.00 -0.41 0.00 0.00 54.97 56.51 3i4n s GLU 360 Cb -0.11 -1.98 0.29 0.00 -1.78 0.00 0.00 34.13 30.54 3i4n s GLU 360 CO 0.07 -1.18 1.25 -0.11 -0.49 0.00 0.00 175.26 174.80 3i4n n LEU 361 N -1.48 -0.39 0.00 1.80 7.94 -1.26 -0.11 117.00 123.50 3i4n n LEU 361 Ca 0.13 1.39 0.15 0.00 -1.11 0.00 0.00 56.01 56.57 3i4n n LEU 361 Cb 0.49 -0.37 0.89 0.00 0.53 0.00 0.00 43.42 44.96 3i4n n LEU 361 CO 0.45 -1.29 1.07 -0.90 -1.11 0.00 0.00 177.39 175.62 3i4n n ASP 362 N -5.25 0.00 -4.54 1.96 3.85 -1.26 -4.45 116.55 106.86 3i4n n ASP 362 Ca 0.11 -0.81 -0.28 0.00 -0.71 0.00 0.00 54.79 53.10 3i4n n ASP 362 Cb 0.36 -0.05 0.13 0.00 -1.35 0.00 0.00 41.12 40.21 3i4n n ASP 362 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 3i4n s GLN 363 N -2.11 1.40 -0.26 0.11 -0.21 0.85 0.13 119.66 119.56 3i4n s GLN 363 Ca 0.43 -0.38 -0.06 0.00 0.02 0.00 0.00 55.36 55.37 3i4n s GLN 363 Cb 0.21 -2.01 0.13 0.00 1.00 0.00 0.00 33.01 32.34 3i4n s GLN 363 CO 0.38 -1.85 0.53 0.54 -2.12 0.00 0.00 175.29 172.77 3i4n s VAL 364 N -3.57 -0.83 0.13 1.09 0.11 -0.62 -4.29 120.40 112.42 3i4n s VAL 364 Ca 0.67 0.04 -0.31 0.00 -2.93 0.00 0.00 61.98 59.45 3i4n s VAL 364 Cb -0.07 -0.87 -0.09 0.00 -1.53 0.00 0.00 36.38 33.82 3i4n s VAL 364 CO 0.49 0.00 1.44 -0.83 -3.33 0.00 0.00 175.10 172.87 3i4n s GLY 365 N 2.75 1.86 -0.06 6.54 0.00 0.38 -2.50 107.32 116.29 3i4n s GLY 365 Ca 0.04 1.20 0.04 0.00 0.00 0.00 0.00 44.72 46.00 3i4n s GLY 365 CO -0.17 2.43 -0.17 0.14 0.00 0.00 0.00 173.10 175.32 3i4n s VAL 366 N 1.07 1.49 0.28 1.40 1.01 -0.30 -2.51 120.40 122.85 3i4n s VAL 366 Ca 0.66 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.62 3i4n s VAL 366 Cb -0.39 -1.30 -0.10 0.00 0.00 0.00 0.00 36.38 34.59 3i4n s VAL 366 CO 0.31 0.43 1.43 -2.16 0.00 0.00 0.00 175.10 175.11 3i4n s PRO 367 N 0.22 4.25 0.64 2.72 0.04 -1.25 0.12 135.00 141.74 3i4n s PRO 367 Ca -0.09 2.34 0.32 0.00 0.04 0.00 0.00 61.00 63.61 3i4n s PRO 367 Cb -0.14 -3.08 1.75 0.00 0.04 0.00 0.00 34.50 33.07 3i4n s PRO 367 CO 0.04 -0.41 2.03 -0.22 0.04 0.00 0.00 177.00 178.48 3i4n h LYS 368 N 4.53 0.00 0.87 4.56 3.64 -1.57 -1.24 116.57 127.35 3i4n h LYS 368 Ca -0.47 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.87 3i4n h LYS 368 Cb 1.22 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.05 3i4n h LYS 368 CO 0.74 0.00 -0.42 1.03 -2.27 0.00 0.00 179.45 178.54 3i4n h SER 369 N 0.00 -0.99 0.01 4.20 0.87 -1.89 -2.94 113.55 112.81 3i4n h SER 369 Ca 0.05 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.59 3i4n h SER 369 Cb 0.59 0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.79 3i4n h SER 369 CO -0.00 -0.65 -0.14 0.40 -0.53 0.00 0.00 176.83 175.91 3i4n h ILE 370 N -1.27 1.19 0.00 2.23 2.04 -1.65 -1.59 117.51 118.47 3i4n h ILE 370 Ca -0.12 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 64.90 3i4n h ILE 370 Cb 0.90 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.20 3i4n h ILE 370 CO 0.20 0.26 0.00 0.00 0.00 0.00 0.00 178.15 178.61 3i4n h ALA 371 N 1.61 1.00 0.00 1.87 0.00 -1.22 0.11 119.26 122.63 3i4n h ALA 371 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3i4n h ALA 371 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3i4n h ALA 371 CO 0.02 0.00 -0.82 1.63 0.00 0.00 0.00 179.25 180.08 3i4n n LYS 372 N -2.71 1.68 -0.11 0.00 5.02 -0.63 -3.04 118.16 118.37 3i4n n LYS 372 Ca -0.01 -0.01 -0.22 0.00 -2.02 0.00 0.00 58.31 56.04 3i4n n LYS 372 Cb 0.11 -1.26 -0.10 0.00 -0.02 0.00 0.00 35.03 33.77 3i4n n LYS 372 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3i4n n THR 373 N -1.43 1.52 -2.67 -0.18 -1.04 -0.34 -4.90 114.28 105.25 3i4n n THR 373 Ca 0.03 -0.10 -0.42 0.00 -2.04 0.00 0.00 64.05 61.51 3i4n n THR 373 Cb 0.26 -2.04 -0.03 0.00 -1.82 0.00 0.00 70.33 66.70 3i4n n THR 373 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3i4n s LEU 374 N -7.80 4.39 0.00 -4.42 1.43 0.25 -5.04 118.68 107.48 3i4n s LEU 374 Ca -0.31 1.73 0.00 0.00 -1.03 0.00 0.00 54.13 54.53 3i4n s LEU 374 Cb 0.08 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.73 3i4n s LEU 374 CO 0.52 -0.27 0.00 0.35 0.23 0.00 0.00 176.35 177.18 3i4n n THR 375 N 3.76 0.00 -3.20 5.49 -2.24 -1.26 -2.70 114.28 114.13 3i4n n THR 375 Ca 0.06 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.88 3i4n n THR 375 Cb 0.50 -0.46 -0.03 0.00 -2.10 0.00 0.00 70.33 68.23 3i4n n THR 375 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3i4n s TYR 376 N 1.31 -0.20 -0.03 4.78 5.04 -0.75 -4.68 117.35 122.82 3i4n s TYR 376 Ca 0.00 0.31 -0.30 0.00 -2.44 0.00 0.00 57.07 54.64 3i4n s TYR 376 Cb 0.00 0.11 -0.06 0.00 0.35 0.00 0.00 41.96 42.36 3i4n s TYR 376 CO 0.00 -0.10 1.60 -1.25 -1.34 0.00 0.00 175.55 174.45 3i4n s PRO 377 N 2.36 4.20 0.00 4.97 0.04 -1.26 -1.69 135.00 143.63 3i4n s PRO 377 Ca -0.02 2.15 0.08 0.00 0.04 0.00 0.00 61.00 63.26 3i4n s PRO 377 Cb -0.04 -3.86 -0.02 0.00 0.04 0.00 0.00 34.50 30.62 3i4n s PRO 377 CO -0.14 -0.78 -0.26 -2.00 0.04 0.00 0.00 177.00 173.85 3i4n s GLU 378 N 3.57 1.98 0.07 4.56 2.12 -1.24 -4.91 118.70 124.86 3i4n s GLU 378 Ca 0.71 -0.99 -0.23 0.00 0.36 0.00 0.00 54.97 54.82 3i4n s GLU 378 Cb -0.33 -2.01 -0.06 0.00 0.26 0.00 0.00 34.13 31.99 3i4n s GLU 378 CO 0.29 0.54 0.68 0.08 -0.54 0.00 0.00 175.26 176.31 3i4n s VAL 379 N -0.68 4.68 -0.25 3.70 1.01 -1.26 -0.25 120.40 127.35 3i4n s VAL 379 Ca 0.11 1.46 -0.29 0.00 0.00 0.00 0.00 61.98 63.25 3i4n s VAL 379 Cb -0.10 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 3i4n s VAL 379 CO 0.00 0.46 1.66 -0.69 0.00 0.00 0.00 175.10 176.53 3i4n s VAL 380 N -0.63 3.64 -0.00 2.92 1.01 0.18 -4.90 120.40 122.62 3i4n s VAL 380 Ca 0.34 0.71 0.03 0.00 0.00 0.00 0.00 61.98 63.05 3i4n s VAL 380 Cb -0.20 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 3i4n s VAL 380 CO 0.21 -0.33 -0.09 -0.89 0.00 0.00 0.00 175.10 174.01 3i4n s THR 381 N 5.57 0.68 0.65 3.92 2.01 -1.26 -0.54 115.64 126.66 3i4n s THR 381 Ca 0.73 -0.39 0.18 0.00 0.31 0.00 0.00 61.69 62.52 3i4n s THR 381 Cb -0.24 -0.57 0.21 0.00 0.01 0.00 0.00 72.50 71.91 3i4n s THR 381 CO 0.31 0.17 1.49 1.55 -0.69 0.00 0.00 174.62 177.45 3i4n h PRO 382 N 5.88 0.00 0.87 4.92 0.13 -1.98 0.49 132.00 142.31 3i4n h PRO 382 Ca -0.31 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.78 3i4n h PRO 382 Cb 1.18 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.32 3i4n h PRO 382 CO 0.49 0.00 -0.42 1.88 -0.23 0.00 0.00 178.00 179.73 3i4n h TYR 383 N 0.00 -1.08 0.10 1.56 0.99 -1.96 -3.36 116.97 113.21 3i4n h TYR 383 Ca 0.10 -0.03 -0.34 0.00 2.00 0.00 0.00 58.73 60.46 3i4n h TYR 383 Cb 1.54 0.36 -0.02 0.00 1.00 0.00 0.00 36.73 39.61 3i4n h TYR 383 CO 0.00 -0.67 -1.84 -2.95 -0.00 0.00 0.00 178.16 172.70 3i4n h ASN 384 N -1.31 0.32 0.00 3.88 7.08 -1.30 -3.42 115.58 120.82 3i4n h ASN 384 Ca -0.12 -0.65 0.00 0.00 -3.08 0.00 0.00 56.30 52.45 3i4n h ASN 384 Cb 0.89 -0.10 0.00 0.00 -2.08 0.00 0.00 38.32 37.03 3i4n h ASN 384 CO 0.20 1.58 0.00 -0.38 -2.08 0.00 0.00 177.43 176.74 3i4n n ILE 385 N -3.37 0.00 0.36 6.14 2.08 0.15 0.25 119.36 124.98 3i4n n ILE 385 Ca -0.25 0.00 -0.14 0.00 0.56 0.00 0.00 62.75 62.91 3i4n n ILE 385 Cb 1.05 0.00 -0.07 0.00 -0.75 0.00 0.00 39.64 39.87 3i4n n ILE 385 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 3i4n h ASP 386 N 0.00 -0.79 0.11 4.38 3.32 -1.82 -1.54 116.42 120.08 3i4n h ASP 386 Ca 0.00 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.09 3i4n h ASP 386 Cb 0.00 0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.71 3i4n h ASP 386 CO 0.00 -0.52 -0.53 -0.09 -1.72 0.00 0.00 179.24 176.39 3i4n h ARG 387 N -1.04 -0.72 -1.01 3.56 2.43 0.30 -1.98 114.38 115.92 3i4n h ARG 387 Ca -0.10 0.05 0.36 0.00 -0.81 0.00 0.00 59.98 59.48 3i4n h ARG 387 Cb 0.72 0.16 -0.16 0.00 -0.42 0.00 0.00 29.97 30.27 3i4n h ARG 387 CO 0.16 -0.48 0.57 -0.07 -1.51 0.00 0.00 179.97 178.64 3i4n h LEU 388 N -0.75 0.45 -0.60 3.80 3.38 -1.45 0.34 115.31 120.50 3i4n h LEU 388 Ca -0.00 0.21 -0.13 0.00 0.09 0.00 0.00 57.88 58.05 3i4n h LEU 388 Cb 0.76 0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 3i4n h LEU 388 CO -0.29 -0.23 -0.30 0.74 0.09 0.00 0.00 178.44 178.44 3i4n h THR 389 N 0.22 1.28 0.07 0.22 2.02 -0.54 -2.06 112.91 114.12 3i4n h THR 389 Ca 0.77 -1.45 -0.00 0.00 0.77 0.00 0.00 66.41 66.50 3i4n h THR 389 Cb 1.88 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 69.61 3i4n h THR 389 CO -0.65 0.48 -0.03 -0.61 0.37 0.00 0.00 175.52 175.08 3i4n h GLN 390 N 0.66 -0.09 -0.16 6.66 5.75 0.14 -0.82 115.11 127.25 3i4n h GLN 390 Ca 0.07 0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.63 3i4n h GLN 390 Cb 0.84 0.02 -0.07 0.00 1.07 0.00 0.00 27.48 29.34 3i4n h GLN 390 CO 0.07 0.10 -0.37 -0.07 -2.65 0.00 0.00 178.83 175.91 3i4n h LEU 391 N -0.26 -1.18 0.00 -2.39 3.38 -1.21 2.22 115.31 115.87 3i4n h LEU 391 Ca -0.01 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3i4n h LEU 391 Cb 0.23 0.49 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 3i4n h LEU 391 CO 0.02 -0.39 -0.00 0.58 0.09 0.00 0.00 178.44 178.73 3i4n h VAL 392 N -0.43 0.00 0.00 1.22 2.07 -1.24 0.55 116.25 118.42 3i4n h VAL 392 Ca 0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.61 3i4n h VAL 392 Cb 0.59 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3i4n h VAL 392 CO -0.40 0.00 0.00 0.03 0.02 0.00 0.00 177.57 177.22 3i4n h ARG 393 N -0.01 0.00 0.00 1.57 3.08 -1.03 0.45 114.38 118.45 3i4n h ARG 393 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3i4n h ARG 393 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 3i4n h ARG 393 CO -0.00 0.00 0.00 -1.71 -1.07 0.00 0.00 179.97 177.19 3i4n n ASN 394 N -2.35 0.53 0.00 7.04 2.85 0.75 -4.96 115.26 119.12 3i4n n ASN 394 Ca -0.01 0.60 0.00 0.00 -0.11 0.00 0.00 54.58 55.06 3i4n n ASN 394 Cb 0.05 -0.72 0.00 0.00 1.24 0.00 0.00 39.78 40.35 3i4n n ASN 394 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3i4n n GLY 395 N 0.40 -0.84 1.82 8.20 0.00 0.16 -4.48 105.19 110.45 3i4n n GLY 395 Ca 0.03 -1.59 -0.11 0.00 0.00 0.00 0.00 46.02 44.35 3i4n n GLY 395 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3i4n n PRO 396 N -0.48 2.60 0.00 1.61 -0.04 -0.86 -2.81 135.00 135.01 3i4n n PRO 396 Ca 0.00 -2.33 0.00 0.00 -0.04 0.00 0.00 63.50 61.13 3i4n n PRO 396 Cb 0.00 -1.96 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 3i4n n PRO 396 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3i4n n ASN 397 N -0.37 2.02 -4.72 3.54 4.13 -1.26 -4.87 115.26 113.73 3i4n n ASN 397 Ca 0.38 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 56.23 3i4n n ASN 397 Cb 1.27 0.23 -0.04 0.00 -1.54 0.00 0.00 39.78 39.70 3i4n n ASN 397 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 3i4n s GLU 398 N -1.32 4.60 0.00 3.52 2.02 -1.26 -4.99 118.70 121.27 3i4n s GLU 398 Ca 0.00 1.38 0.00 0.00 0.02 0.00 0.00 54.97 56.37 3i4n s GLU 398 Cb 0.00 -3.43 0.00 0.00 0.10 0.00 0.00 34.13 30.80 3i4n s GLU 398 CO 0.00 0.06 0.31 1.58 0.02 0.00 0.00 175.26 177.23 3i4n n HIS 399 N 3.47 0.00 -1.63 1.61 -0.00 -1.26 -3.66 115.22 113.75 3i4n n HIS 399 Ca 0.04 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.39 3i4n n HIS 399 Cb 0.50 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.46 3i4n n HIS 399 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.34 174.20 3i4n s PRO 400 N -0.73 2.25 0.00 1.57 0.02 -1.26 -4.68 135.00 132.17 3i4n s PRO 400 Ca 0.00 1.34 0.00 0.00 0.02 0.00 0.00 61.00 62.36 3i4n s PRO 400 Cb 0.00 -4.54 0.00 0.00 0.02 0.00 0.00 34.50 29.98 3i4n s PRO 400 CO 0.00 -3.12 0.00 0.41 -0.33 0.00 0.00 177.00 173.96 3i4n n GLY 401 N 5.94 2.62 3.72 0.52 0.00 -1.24 -4.76 105.19 111.99 3i4n n GLY 401 Ca 0.34 -0.22 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 3i4n n GLY 401 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4n s ALA 402 N -1.00 -1.68 0.00 4.61 0.00 -1.12 -1.48 121.76 121.08 3i4n s ALA 402 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.22 3i4n s ALA 402 Cb 0.00 0.61 0.00 0.00 0.00 0.00 0.00 23.12 23.73 3i4n s ALA 402 CO 0.00 -0.99 0.00 0.36 0.00 0.00 0.00 175.76 175.13 3i4n n LYS 403 N -0.44 1.51 -4.32 0.00 2.85 -1.11 -2.03 118.16 114.62 3i4n n LYS 403 Ca -0.07 0.00 -0.20 0.00 -1.05 0.00 0.00 58.31 56.99 3i4n n LYS 403 Cb 0.61 -0.86 -0.16 0.00 -0.65 0.00 0.00 35.03 33.97 3i4n n LYS 403 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3i4n s TYR 404 N -1.56 0.89 -0.14 5.58 4.12 -1.15 -0.78 117.35 124.32 3i4n s TYR 404 Ca 0.00 -0.24 0.02 0.00 0.02 0.00 0.00 57.07 56.87 3i4n s TYR 404 Cb 0.00 -0.67 0.01 0.00 -1.52 0.00 0.00 41.96 39.78 3i4n s TYR 404 CO 0.00 -0.13 -0.18 0.08 0.02 0.00 0.00 175.55 175.34 3i4n s VAL 405 N 0.41 1.79 -0.20 0.71 1.01 -1.06 -0.14 120.40 122.92 3i4n s VAL 405 Ca -0.06 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.13 3i4n s VAL 405 Cb -0.10 -1.62 0.03 0.00 0.00 0.00 0.00 36.38 34.69 3i4n s VAL 405 CO 0.01 0.50 -0.18 0.27 0.00 0.00 0.00 175.10 175.70 3i4n s ILE 406 N 1.05 2.09 0.53 2.22 -4.36 0.91 -0.52 121.20 123.12 3i4n s ILE 406 Ca -0.03 -1.12 -0.12 0.00 -0.26 0.00 0.00 60.65 59.11 3i4n s ILE 406 Cb -0.15 -1.97 -0.06 0.00 1.25 0.00 0.00 42.46 41.54 3i4n s ILE 406 CO -0.05 0.39 0.94 -0.13 0.24 0.00 0.00 174.94 176.34 3i4n s ARG 407 N 1.24 3.74 0.31 0.37 0.52 -1.24 -0.53 118.95 123.35 3i4n s ARG 407 Ca 0.01 0.70 0.06 0.00 -0.52 0.00 0.00 55.73 55.99 3i4n s ARG 407 Cb -0.15 -2.18 0.85 0.00 0.52 0.00 0.00 34.95 33.99 3i4n s ARG 407 CO -0.11 -0.34 1.65 0.38 0.02 0.00 0.00 175.30 176.90 3i4n h ASP 408 N 0.40 0.16 0.00 0.23 3.04 -1.92 -3.27 116.42 115.06 3i4n h ASP 408 Ca -0.46 0.20 -0.57 0.00 -3.24 0.00 0.00 57.03 52.96 3i4n h ASP 408 Cb 1.19 0.23 0.10 0.00 -1.04 0.00 0.00 39.33 39.81 3i4n h ASP 408 CO 0.62 -0.16 1.77 -1.54 -2.04 0.00 0.00 179.24 177.89 3i4n n SER 409 N -5.18 1.71 -0.10 4.15 3.41 -1.26 -4.69 113.62 111.66 3i4n n SER 409 Ca 0.25 -2.53 0.00 0.00 -0.26 0.00 0.00 58.87 56.33 3i4n n SER 409 Cb 0.79 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 3i4n n SER 409 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i4n n GLY 410 N 4.70 0.00 2.78 5.00 0.00 -1.23 -4.78 105.19 111.65 3i4n n GLY 410 Ca 0.45 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.29 3i4n n GLY 410 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i4n s ASP 411 N -0.13 0.96 -0.10 1.61 2.15 -1.26 -5.10 116.67 114.81 3i4n s ASP 411 Ca 0.00 0.20 -0.23 0.00 0.43 0.00 0.00 52.55 52.95 3i4n s ASP 411 Cb 0.00 0.14 -0.03 0.00 -0.30 0.00 0.00 42.92 42.73 3i4n s ASP 411 CO 0.00 -0.25 0.68 0.00 -0.17 0.00 0.00 175.17 175.42 3i4n s ARG 412 N 2.25 4.39 -0.22 4.34 1.70 -1.26 -3.71 118.95 126.44 3i4n s ARG 412 Ca 0.04 0.81 -0.21 0.00 -0.47 0.00 0.00 55.73 55.90 3i4n s ARG 412 Cb -0.12 -3.47 -0.02 0.00 -0.57 0.00 0.00 34.95 30.77 3i4n s ARG 412 CO -0.05 0.01 0.66 0.42 -1.08 0.00 0.00 175.30 175.26 3i4n s ILE 413 N 1.01 4.98 -0.81 4.99 1.01 0.32 -4.98 121.20 127.72 3i4n s ILE 413 Ca 0.35 1.24 -0.22 0.00 0.00 0.00 0.00 60.65 62.02 3i4n s ILE 413 Cb -0.17 -3.97 0.08 0.00 0.01 0.00 0.00 42.46 38.41 3i4n s ILE 413 CO 0.16 0.05 1.11 -0.62 0.00 0.00 0.00 174.94 175.65 3i4n s ASP 414 N 1.32 6.37 0.52 3.58 -1.08 -1.26 -2.55 116.67 123.57 3i4n s ASP 414 Ca 0.29 -1.36 0.41 0.00 -0.52 0.00 0.00 52.55 51.37 3i4n s ASP 414 Cb -0.16 -2.45 1.60 0.00 -1.46 0.00 0.00 42.92 40.46 3i4n s ASP 414 CO 0.09 -1.36 1.65 -0.07 0.52 0.00 0.00 175.17 176.01 3i4n h LEU 415 N 11.38 0.07 -1.37 -1.34 3.38 -1.33 -0.76 115.31 125.35 3i4n h LEU 415 Ca -0.07 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3i4n h LEU 415 Cb 1.04 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3i4n h LEU 415 CO 1.20 -0.04 0.00 -2.11 0.09 0.00 0.00 178.44 177.58 3i4n n ARG 416 N -4.20 1.68 0.03 1.13 1.85 -1.26 -4.46 116.66 111.43 3i4n n ARG 416 Ca 0.37 -0.57 0.00 0.00 -1.00 0.00 0.00 57.85 56.66 3i4n n ARG 416 Cb 1.65 -1.59 0.00 0.00 -1.05 0.00 0.00 32.46 31.47 3i4n n ARG 416 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3i4n n TYR 417 N 0.09 -2.22 -0.68 2.89 4.01 -0.33 -5.09 117.16 115.83 3i4n n TYR 417 Ca 0.05 0.16 -0.31 0.00 -0.16 0.00 0.00 57.90 57.64 3i4n n TYR 417 Cb 0.39 0.83 -0.07 0.00 -0.31 0.00 0.00 39.34 40.19 3i4n n TYR 417 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3i4n n SER 418 N -2.61 0.38 -2.01 7.72 2.88 -1.00 -4.60 113.62 114.37 3i4n n SER 418 Ca 0.00 0.34 -0.00 0.00 -1.33 0.00 0.00 58.87 57.88 3i4n n SER 418 Cb 0.00 -0.48 -0.00 0.00 -0.75 0.00 0.00 64.21 62.98 3i4n n SER 418 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 3i4n n LYS 419 N 4.07 0.01 0.00 -1.46 -0.00 -1.26 0.72 118.16 120.24 3i4n n LYS 419 Ca 0.30 -0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.61 3i4n n LYS 419 Cb -0.02 -1.50 0.00 0.00 -0.00 0.00 0.00 35.03 33.52 3i4n n LYS 419 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 3i4n n ARG 420 N 2.02 0.00 -0.34 -1.58 0.63 -1.26 -4.93 116.66 111.20 3i4n n ARG 420 Ca 0.00 -0.12 0.13 0.00 -0.92 0.00 0.00 57.85 56.94 3i4n n ARG 420 Cb 0.00 -0.15 0.33 0.00 0.45 0.00 0.00 32.46 33.10 3i4n n ARG 420 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3i4n h ALA 421 N 0.00 1.71 0.00 5.13 0.00 0.01 0.42 119.26 126.53 3i4n h ALA 421 Ca 0.00 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3i4n h ALA 421 Cb 0.89 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3i4n h ALA 421 CO 0.00 -0.07 -0.22 0.78 0.00 0.00 0.00 179.25 179.74 3i4n h GLY 422 N 0.75 0.00 0.00 0.00 0.00 -1.92 -3.42 103.07 98.49 3i4n h GLY 422 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.89 3i4n h GLY 422 CO -0.35 0.00 0.00 1.34 0.00 0.00 0.00 176.54 177.53 3i4n n ASP 423 N -3.33 0.00 -2.12 0.19 -0.08 0.14 -4.89 116.55 106.47 3i4n n ASP 423 Ca 0.01 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.29 3i4n n ASP 423 Cb 0.46 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.92 3i4n n ASP 423 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 3i4n n ILE 424 N 0.00-13.89 -3.73 5.18 5.41 -1.15 -4.87 119.36 106.31 3i4n n ILE 424 Ca 0.00 3.50 -0.38 0.00 1.00 0.00 0.00 62.75 66.88 3i4n n ILE 424 Cb 0.00 -5.68 -0.11 0.00 -0.71 0.00 0.00 39.64 33.14 3i4n n ILE 424 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 3i4n s GLN 425 N -0.60 2.27 0.67 0.38 -1.52 -1.26 -5.01 119.66 114.58 3i4n s GLN 425 Ca 0.00 -1.65 -0.17 0.00 -1.95 0.00 0.00 55.36 51.60 3i4n s GLN 425 Cb 0.00 -3.62 -0.04 0.00 -0.22 0.00 0.00 33.01 29.14 3i4n s GLN 425 CO 0.00 -0.99 0.72 1.28 -0.25 0.00 0.00 175.29 176.04 3i4n n LEU 426 N 4.71 2.03 -4.02 2.90 4.77 -1.26 -4.98 117.00 121.15 3i4n n LEU 426 Ca -0.06 0.67 -0.30 0.00 -0.03 0.00 0.00 56.01 56.29 3i4n n LEU 426 Cb 0.42 -1.29 -0.16 0.00 -2.33 0.00 0.00 43.42 40.06 3i4n n LEU 426 CO 0.35 -2.61 -0.49 -1.10 -1.33 0.00 0.00 177.39 172.21 3i4n s GLN 427 N -2.78 2.29 0.21 3.23 -1.52 -1.26 -5.09 119.66 114.74 3i4n s GLN 427 Ca 0.70 -0.56 -0.29 0.00 -1.95 0.00 0.00 55.36 53.26 3i4n s GLN 427 Cb -0.38 -2.09 -0.16 0.00 -0.22 0.00 0.00 33.01 30.16 3i4n s GLN 427 CO 0.53 -0.22 0.76 0.66 -0.25 0.00 0.00 175.29 176.77 3i4n n TYR 428 N 4.73 0.27 -0.77 0.91 4.02 -1.26 0.02 117.16 125.08 3i4n n TYR 428 Ca -0.17 0.87 0.00 0.00 -0.01 0.00 0.00 57.90 58.59 3i4n n TYR 428 Cb 0.50 -2.08 0.00 0.00 -0.02 0.00 0.00 39.34 37.74 3i4n n TYR 428 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3i4n n GLY 429 N 1.74 0.66 3.98 2.72 0.00 0.29 -4.95 105.19 109.64 3i4n n GLY 429 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.98 3i4n n GLY 429 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3i4n s TRP 430 N -2.23 3.15 0.08 1.61 0.52 0.10 -4.61 118.94 117.56 3i4n s TRP 430 Ca 0.00 -0.14 0.08 0.00 0.02 0.00 0.00 56.10 56.06 3i4n s TRP 430 Cb 0.00 -2.03 -0.04 0.00 -1.15 0.00 0.00 33.47 30.26 3i4n s TRP 430 CO 0.00 -0.05 -0.17 0.15 0.02 0.00 0.00 176.95 176.91 3i4n s LYS 431 N -4.23 1.95 -0.44 4.98 1.02 0.31 0.49 119.74 123.82 3i4n s LYS 431 Ca 0.45 -1.07 0.03 0.00 0.02 0.00 0.00 55.97 55.39 3i4n s LYS 431 Cb -0.10 -2.18 0.16 0.00 -0.52 0.00 0.00 37.83 35.19 3i4n s LYS 431 CO 0.32 0.51 0.31 0.08 -0.92 0.00 0.00 175.35 175.65 3i4n s VAL 432 N -1.07 0.87 -0.28 3.17 1.01 0.66 -0.07 120.40 124.69 3i4n s VAL 432 Ca 0.17 -2.64 -0.36 0.00 0.00 0.00 0.00 61.98 59.16 3i4n s VAL 432 Cb -0.11 -1.61 -0.12 0.00 0.00 0.00 0.00 36.38 34.55 3i4n s VAL 432 CO 0.09 -1.08 2.05 -0.62 0.00 0.00 0.00 175.10 175.54 3i4n n GLU 433 N 3.15 1.34 -4.52 2.72 1.02 0.80 -3.68 120.64 121.47 3i4n n GLU 433 Ca 0.20 0.43 -0.27 0.00 -0.02 0.00 0.00 57.16 57.49 3i4n n GLU 433 Cb 0.41 -2.46 -0.10 0.00 -0.02 0.00 0.00 31.44 29.27 3i4n n GLU 433 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 3i4n s ARG 434 N 5.30 2.01 0.38 3.49 1.70 -0.68 -2.73 118.95 128.42 3i4n s ARG 434 Ca 1.04 -2.06 -0.27 0.00 -0.47 0.00 0.00 55.73 53.97 3i4n s ARG 434 Cb -0.85 -1.71 -0.09 0.00 -0.57 0.00 0.00 34.95 31.73 3i4n s ARG 434 CO 0.52 -0.06 1.33 -1.01 -1.08 0.00 0.00 175.30 175.00 3i4n s HIS 435 N -2.69 2.83 0.11 5.89 3.76 -0.55 -1.80 115.29 122.85 3i4n s HIS 435 Ca 0.36 1.37 -0.32 0.00 -0.15 0.00 0.00 55.06 56.32 3i4n s HIS 435 Cb 0.09 -3.73 -0.12 0.00 1.11 0.00 0.00 32.58 29.93 3i4n s HIS 435 CO 0.19 -2.18 1.79 -0.89 -0.85 0.00 0.00 174.74 172.79 3i4n n ILE 436 N 0.34 0.29 -4.23 0.60 2.08 -1.10 -4.88 119.36 112.46 3i4n n ILE 436 Ca 0.02 -0.05 -0.23 0.00 0.56 0.00 0.00 62.75 63.05 3i4n n ILE 436 Cb 0.42 -1.97 -0.06 0.00 -0.75 0.00 0.00 39.64 37.28 3i4n n ILE 436 CO 0.00 0.00 0.00 -0.04 0.56 0.00 0.00 176.55 177.07 3i4n s MET 437 N 2.41 2.50 -0.34 0.38 -1.94 -1.26 -4.86 119.30 116.18 3i4n s MET 437 Ca 0.82 -1.26 -0.38 0.00 -1.71 0.00 0.00 55.69 53.17 3i4n s MET 437 Cb -0.55 -2.31 -0.13 0.00 2.01 0.00 0.00 34.83 33.85 3i4n s MET 437 CO 0.39 0.39 2.06 -0.25 -0.01 0.00 0.00 175.02 177.60 3i4n n ASP 438 N -0.83 2.08 -0.40 3.03 9.92 -1.26 -2.45 116.55 126.64 3i4n n ASP 438 Ca -0.07 0.64 0.00 0.00 -0.53 0.00 0.00 54.79 54.82 3i4n n ASP 438 Cb 0.58 -1.19 0.00 0.00 -0.64 0.00 0.00 41.12 39.87 3i4n n ASP 438 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3i4n n ASN 439 N 8.29 -0.88 -4.29 -2.24 4.13 0.60 -4.91 115.26 115.97 3i4n n ASN 439 Ca 0.38 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 56.30 3i4n n ASN 439 Cb 0.17 -0.22 -0.14 0.00 -1.54 0.00 0.00 39.78 38.05 3i4n n ASN 439 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 3i4n s ASP 440 N -2.00 4.17 0.42 6.41 1.01 -1.03 -4.76 116.67 120.90 3i4n s ASP 440 Ca 0.00 -0.43 -0.25 0.00 0.71 0.00 0.00 52.55 52.58 3i4n s ASP 440 Cb 0.00 -1.71 -0.10 0.00 1.01 0.00 0.00 42.92 42.12 3i4n s ASP 440 CO 0.00 -0.02 1.25 -0.81 0.21 0.00 0.00 175.17 175.80 3i4n n PRO 441 N 4.78 1.88 -3.83 8.23 -0.04 -1.26 -3.09 135.00 141.66 3i4n n PRO 441 Ca -0.18 0.67 -0.09 0.00 -0.04 0.00 0.00 63.50 63.85 3i4n n PRO 441 Cb 0.51 -2.36 -0.07 0.00 -0.04 0.00 0.00 33.50 31.54 3i4n n PRO 441 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3i4n s VAL 442 N -1.20 0.13 -0.23 0.52 1.01 -1.01 -4.43 120.40 115.18 3i4n s VAL 442 Ca 0.61 -1.06 -0.14 0.00 0.00 0.00 0.00 61.98 61.39 3i4n s VAL 442 Cb -0.51 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 3i4n s VAL 442 CO 0.58 -0.59 0.33 -0.22 0.00 0.00 0.00 175.10 175.20 3i4n s LEU 443 N -2.69 4.11 -0.04 3.92 1.98 -0.44 -1.85 118.68 123.66 3i4n s LEU 443 Ca 0.03 0.34 0.05 0.00 -2.89 0.00 0.00 54.13 51.65 3i4n s LEU 443 Cb 0.03 -2.38 -0.01 0.00 0.66 0.00 0.00 46.19 44.50 3i4n s LEU 443 CO -0.10 -0.07 -0.19 0.12 -1.89 0.00 0.00 176.35 174.22 3i4n s PHE 444 N 1.49 1.85 0.06 5.38 5.36 0.12 0.26 117.98 132.50 3i4n s PHE 444 Ca 0.15 -0.52 -0.18 0.00 -0.96 0.00 0.00 56.93 55.43 3i4n s PHE 444 Cb -0.15 -1.23 0.04 0.00 -0.34 0.00 0.00 43.02 41.33 3i4n s PHE 444 CO 0.08 -0.16 0.41 0.54 -1.46 0.00 0.00 175.22 174.63 3i4n s ASN 445 N -0.05 -0.27 -0.35 6.13 4.22 0.78 -1.42 114.94 123.97 3i4n s ASN 445 Ca -0.03 -0.07 0.02 0.00 -2.14 0.00 0.00 52.86 50.65 3i4n s ASN 445 Cb -0.11 0.43 0.11 0.00 1.28 0.00 0.00 41.25 42.96 3i4n s ASN 445 CO 0.02 -0.71 0.10 -0.60 -2.04 0.00 0.00 177.10 173.87 3i4n s ARG 446 N -2.77 1.27 0.92 3.55 3.52 -0.98 -1.47 118.95 122.99 3i4n s ARG 446 Ca -0.03 -1.71 -0.11 0.00 -0.13 0.00 0.00 55.73 53.75 3i4n s ARG 446 Cb -0.00 -2.78 0.10 0.00 -1.56 0.00 0.00 34.95 30.71 3i4n s ARG 446 CO -0.04 -0.99 0.89 1.04 -0.81 0.00 0.00 175.30 175.39 3i4n n GLN 447 N 4.28 -0.34 -2.56 5.12 6.02 -1.26 -4.24 117.38 124.39 3i4n n GLN 447 Ca 0.03 -0.04 -0.42 0.00 -0.01 0.00 0.00 57.00 56.55 3i4n n GLN 447 Cb 0.41 -2.20 -0.03 0.00 1.02 0.00 0.00 30.24 29.44 3i4n n GLN 447 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3i4n s PRO 448 N -4.22 4.48 -0.87 -1.09 0.04 -1.26 -5.05 135.00 127.03 3i4n s PRO 448 Ca 0.64 1.59 -0.24 0.00 0.04 0.00 0.00 61.00 63.03 3i4n s PRO 448 Cb -0.23 -3.43 0.05 0.00 0.04 0.00 0.00 34.50 30.94 3i4n s PRO 448 CO 0.61 -0.19 1.30 -1.12 0.04 0.00 0.00 177.00 177.64 3i4n s SER 449 N 1.08 6.35 0.00 6.66 0.01 -1.26 -4.73 113.70 121.81 3i4n s SER 449 Ca 0.55 -1.10 0.10 0.00 1.31 0.00 0.00 55.95 56.81 3i4n s SER 449 Cb -0.25 -2.53 0.03 0.00 0.21 0.00 0.00 66.02 63.48 3i4n s SER 449 CO 0.27 -1.58 0.69 0.00 0.41 0.00 0.00 173.24 173.04 3i4n n LEU 450 N 8.70 1.43 -4.86 2.44 -0.00 -1.26 -5.01 117.00 118.44 3i4n n LEU 450 Ca 0.17 -0.86 -0.21 0.00 -0.00 0.00 0.00 56.01 55.11 3i4n n LEU 450 Cb 0.49 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.88 3i4n n LEU 450 CO 0.66 0.28 -0.02 -1.00 -0.00 0.00 0.00 177.39 177.31 3i4n s HIS 451 N -1.12 2.72 -0.01 1.47 3.76 -1.26 -4.65 115.29 116.19 3i4n s HIS 451 Ca 0.09 -0.48 -0.16 0.00 -0.15 0.00 0.00 55.06 54.36 3i4n s HIS 451 Cb 0.08 -2.12 -0.33 0.00 1.11 0.00 0.00 32.58 31.32 3i4n s HIS 451 CO 0.19 -0.07 0.87 -0.22 -0.85 0.00 0.00 174.74 174.67 3i4n h LYS 452 N 1.08 0.45 -2.35 1.40 3.64 -1.95 -3.33 116.57 115.51 3i4n h LYS 452 Ca -0.42 -0.76 -0.60 0.00 -1.27 0.00 0.00 60.65 57.60 3i4n h LYS 452 Cb 1.26 0.28 -0.13 0.00 -0.41 0.00 0.00 32.23 33.24 3i4n h LYS 452 CO 0.58 1.36 1.50 -1.33 -2.27 0.00 0.00 179.45 179.30 3i4n n MET 453 N -3.78 3.47 -0.00 1.90 0.00 -1.26 -3.44 117.12 114.01 3i4n n MET 453 Ca -0.19 -2.74 0.00 0.00 0.00 0.00 0.00 57.70 54.77 3i4n n MET 453 Cb 1.03 -2.40 -0.00 0.00 0.00 0.00 0.00 33.22 31.85 3i4n n MET 453 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 3i4n n SER 454 N 1.58 0.83 -3.88 7.83 2.88 -1.25 -4.23 113.62 117.38 3i4n n SER 454 Ca 0.57 -0.42 -0.19 0.00 -1.33 0.00 0.00 58.87 57.49 3i4n n SER 454 Cb 0.42 1.00 -0.16 0.00 -0.75 0.00 0.00 64.21 64.72 3i4n n SER 454 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3i4n s MET 455 N -1.20 0.72 0.17 -1.46 -1.94 -1.22 -2.31 119.30 112.05 3i4n s MET 455 Ca 0.00 -0.08 -0.09 0.00 -1.71 0.00 0.00 55.69 53.81 3i4n s MET 455 Cb 0.00 -0.75 -0.01 0.00 2.01 0.00 0.00 34.83 36.08 3i4n s MET 455 CO 0.02 -0.08 0.30 -1.64 -0.01 0.00 0.00 175.02 173.60 3i4n s MET 456 N 0.89 1.18 -0.14 2.03 1.00 -0.51 -4.95 119.30 118.80 3i4n s MET 456 Ca -0.11 -1.17 -0.11 0.00 0.00 0.00 0.00 55.69 54.29 3i4n s MET 456 Cb -0.14 0.38 -0.05 0.00 0.00 0.00 0.00 34.83 35.03 3i4n s MET 456 CO -0.00 -0.43 0.23 0.00 0.00 0.00 0.00 175.02 174.81 3i4n s ALA 457 N -3.97 3.70 0.24 3.03 0.00 0.20 -0.70 121.76 124.27 3i4n s ALA 457 Ca 0.17 -0.53 0.09 0.00 0.00 0.00 0.00 51.96 51.69 3i4n s ALA 457 Cb 0.03 -2.23 -0.05 0.00 0.00 0.00 0.00 23.12 20.87 3i4n s ALA 457 CO 0.00 0.29 -0.14 -1.01 0.00 0.00 0.00 175.76 174.91 3i4n s HIS 458 N -0.15 1.93 -0.14 0.00 3.76 -0.77 -2.61 115.29 117.31 3i4n s HIS 458 Ca 0.15 -0.53 -0.22 0.00 -0.15 0.00 0.00 55.06 54.31 3i4n s HIS 458 Cb -0.13 -0.93 -0.03 0.00 1.11 0.00 0.00 32.58 32.60 3i4n s HIS 458 CO 0.04 0.44 0.67 1.03 -0.85 0.00 0.00 174.74 176.08 3i4n s ARG 459 N -3.62 4.32 0.20 1.40 0.52 0.12 -2.40 118.95 119.48 3i4n s ARG 459 Ca 0.26 0.76 -0.30 0.00 -0.52 0.00 0.00 55.73 55.93 3i4n s ARG 459 Cb -0.01 -3.52 -0.09 0.00 0.52 0.00 0.00 34.95 31.86 3i4n s ARG 459 CO 0.10 -0.11 1.32 0.08 0.02 0.00 0.00 175.30 176.71 3i4n s VAL 460 N 1.44 3.19 -0.32 3.52 1.01 -1.18 -1.59 120.40 126.46 3i4n s VAL 460 Ca 0.33 0.97 -0.02 0.00 0.00 0.00 0.00 61.98 63.26 3i4n s VAL 460 Cb -0.17 -3.62 0.11 0.00 0.00 0.00 0.00 36.38 32.71 3i4n s VAL 460 CO 0.13 0.14 0.16 -0.75 0.00 0.00 0.00 175.10 174.78 3i4n s LYS 461 N -0.04 0.46 0.01 2.72 2.47 -1.04 0.22 119.74 124.54 3i4n s LYS 461 Ca 0.57 -0.97 -0.30 0.00 -1.56 0.00 0.00 55.97 53.71 3i4n s LYS 461 Cb -0.37 -1.42 -0.06 0.00 -1.46 0.00 0.00 37.83 34.52 3i4n s LYS 461 CO 0.38 -1.08 1.42 0.08 0.16 0.00 0.00 175.35 176.31 3i4n s VAL 462 N 1.58 3.63 0.33 4.02 1.01 -1.26 -1.15 120.40 128.57 3i4n s VAL 462 Ca 0.12 1.04 0.03 0.00 0.00 0.00 0.00 61.98 63.17 3i4n s VAL 462 Cb -0.19 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 3i4n s VAL 462 CO -0.21 0.00 0.11 0.27 0.00 0.00 0.00 175.10 175.27 3i4n s ILE 463 N 2.35 0.70 0.91 2.22 -4.36 0.32 -4.83 121.20 118.51 3i4n s ILE 463 Ca 0.65 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.92 3i4n s ILE 463 Cb -0.32 -2.57 0.19 0.00 1.25 0.00 0.00 42.46 41.01 3i4n s ILE 463 CO 0.27 0.00 1.25 -2.16 0.24 0.00 0.00 174.94 174.54 3i4n s PRO 464 N -3.85 0.82 0.38 0.37 0.04 -1.26 -1.72 135.00 129.78 3i4n s PRO 464 Ca 0.33 -0.64 0.00 0.00 0.04 0.00 0.00 61.00 60.73 3i4n s PRO 464 Cb 0.06 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.63 3i4n s PRO 464 CO 0.15 -2.22 0.00 0.66 0.04 0.00 0.00 177.00 175.63 3i4n n TYR 465 N -3.55 -2.68 0.21 0.56 4.02 -1.26 -4.63 117.16 109.83 3i4n n TYR 465 Ca 0.16 1.45 -0.02 0.00 -0.01 0.00 0.00 57.90 59.48 3i4n n TYR 465 Cb 0.60 -2.44 0.01 0.00 -0.02 0.00 0.00 39.34 37.49 3i4n n TYR 465 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3i4n n SER 466 N -2.35 4.15 -4.35 7.72 7.64 -1.26 -4.29 113.62 120.87 3i4n n SER 466 Ca -0.01 -2.31 -0.23 0.00 1.01 0.00 0.00 58.87 57.34 3i4n n SER 466 Cb 0.32 -0.79 -0.11 0.00 -1.01 0.00 0.00 64.21 62.62 3i4n n SER 466 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3i4n s THR 467 N -0.33 1.95 -0.42 0.44 -4.23 -1.26 -4.48 115.64 107.30 3i4n s THR 467 Ca 0.05 -1.93 -0.23 0.00 -1.18 0.00 0.00 61.69 58.41 3i4n s THR 467 Cb 0.04 -1.90 0.02 0.00 1.34 0.00 0.00 72.50 72.00 3i4n s THR 467 CO 0.00 -0.25 0.76 -0.36 -0.54 0.00 0.00 174.62 174.23 3i4n s PHE 468 N -1.90 3.04 -0.42 3.99 2.99 -0.80 -4.13 117.98 120.75 3i4n s PHE 468 Ca 0.16 0.27 -0.10 0.00 0.00 0.00 0.00 56.93 57.26 3i4n s PHE 468 Cb -0.07 -3.52 0.08 0.00 0.00 0.00 0.00 43.02 39.51 3i4n s PHE 468 CO 0.07 -0.88 0.27 1.03 -0.00 0.00 0.00 175.22 175.72 3i4n s ARG 469 N 3.15 2.63 0.26 0.44 0.52 -1.04 -1.59 118.95 123.32 3i4n s ARG 469 Ca 0.29 -1.45 0.07 0.00 -0.52 0.00 0.00 55.73 54.12 3i4n s ARG 469 Cb -0.13 -3.81 -0.04 0.00 0.52 0.00 0.00 34.95 31.49 3i4n s ARG 469 CO 0.20 -0.96 0.18 -0.48 0.02 0.00 0.00 175.30 174.26 3i4n s LEU 470 N 1.44 3.74 1.05 2.53 2.34 -1.26 0.14 118.68 128.67 3i4n s LEU 470 Ca 0.03 -0.30 -0.12 0.00 0.06 0.00 0.00 54.13 53.80 3i4n s LEU 470 Cb -0.23 -2.27 0.22 0.00 -0.56 0.00 0.00 46.19 43.34 3i4n s LEU 470 CO 0.02 -0.05 1.07 0.21 -1.06 0.00 0.00 176.35 176.55 3i4n s ASN 471 N -3.83 1.92 -0.10 1.48 3.84 -1.26 -1.91 114.94 115.07 3i4n s ASN 471 Ca 0.33 1.73 -0.23 0.00 0.21 0.00 0.00 52.86 54.91 3i4n s ASN 471 Cb -0.08 -2.37 -0.28 0.00 -0.55 0.00 0.00 41.25 37.97 3i4n s ASN 471 CO 0.24 -3.65 0.73 -0.07 -2.79 0.00 0.00 177.10 171.57 3i4n h LEU 472 N -2.25 0.27 -2.91 3.21 3.38 -1.88 -3.36 115.31 111.77 3i4n h LEU 472 Ca -0.54 -0.91 -0.00 0.00 0.09 0.00 0.00 57.88 56.52 3i4n h LEU 472 Cb 1.31 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.97 3i4n h LEU 472 CO 0.48 1.33 -0.00 0.28 0.09 0.00 0.00 178.44 180.62 3i4n h SER 473 N -0.60 0.00 -0.29 -0.43 0.02 -1.94 0.27 113.55 110.58 3i4n h SER 473 Ca -0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 3i4n h SER 473 Cb 1.45 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.99 3i4n h SER 473 CO 0.06 0.00 0.00 0.55 -1.14 0.00 0.00 176.83 176.30 3i4n n VAL 474 N -3.19 1.36 -0.06 2.27 3.14 -1.26 -4.06 118.33 116.54 3i4n n VAL 474 Ca -0.03 -0.70 -0.10 0.00 -2.96 0.00 0.00 64.34 60.55 3i4n n VAL 474 Cb 0.07 -0.36 -0.10 0.00 -1.06 0.00 0.00 33.84 32.39 3i4n n VAL 474 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3i4n h THR 475 N 2.03 1.33 0.00 1.55 1.03 -0.64 -3.36 112.91 114.85 3i4n h THR 475 Ca 0.00 -2.00 0.00 0.00 -0.01 0.00 0.00 66.41 64.40 3i4n h THR 475 Cb 1.22 2.52 0.00 0.00 -1.07 0.00 0.00 68.15 70.82 3i4n h THR 475 CO 0.24 0.45 0.00 0.77 -0.01 0.00 0.00 175.52 176.97 3i4n h SER 476 N -1.00 0.00 0.83 0.00 4.64 -1.76 -0.81 113.55 115.45 3i4n h SER 476 Ca -0.00 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.08 3i4n h SER 476 Cb 0.74 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 3i4n h SER 476 CO 0.00 0.00 -1.12 -0.65 -0.87 0.00 0.00 176.83 174.19 3i4n h PRO 477 N 0.00 0.12 0.00 4.77 0.11 -1.74 -3.24 132.00 132.02 3i4n h PRO 477 Ca 0.00 -0.21 -0.02 0.00 0.11 0.00 0.00 66.00 65.88 3i4n h PRO 477 Cb 0.47 0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.66 3i4n h PRO 477 CO 0.00 1.09 -0.30 1.88 -0.21 0.00 0.00 178.00 180.46 3i4n h TYR 478 N 0.03 0.00 -1.37 0.65 0.99 -1.69 -3.41 116.97 112.17 3i4n h TYR 478 Ca -0.07 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.65 3i4n h TYR 478 Cb 1.86 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.60 3i4n h TYR 478 CO 0.03 0.10 -0.02 -1.71 -0.00 0.00 0.00 178.16 176.56 3i4n n ASN 479 N -3.04 -2.07 -4.64 3.88 2.85 -1.02 -4.71 115.26 106.50 3i4n n ASN 479 Ca 0.03 -0.01 -0.35 0.00 -0.11 0.00 0.00 54.58 54.14 3i4n n ASN 479 Cb 0.58 -0.60 -0.10 0.00 1.24 0.00 0.00 39.78 40.90 3i4n n ASN 479 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3i4n s ALA 480 N -3.01 3.43 0.42 5.20 0.00 -0.34 -5.03 121.76 122.43 3i4n s ALA 480 Ca 0.01 -0.75 0.05 0.00 0.00 0.00 0.00 51.96 51.26 3i4n s ALA 480 Cb -0.00 -1.96 -0.06 0.00 0.00 0.00 0.00 23.12 21.10 3i4n s ALA 480 CO 0.02 0.15 0.03 0.16 0.00 0.00 0.00 175.76 176.12 3i4n s ASP 481 N 0.41 3.53 0.00 0.00 3.84 -1.26 -4.68 116.67 118.52 3i4n s ASP 481 Ca 0.04 -1.46 0.15 0.00 -0.00 0.00 0.00 52.55 51.27 3i4n s ASP 481 Cb -0.12 -0.05 0.27 0.00 -1.38 0.00 0.00 42.92 41.64 3i4n s ASP 481 CO 0.00 -0.61 1.17 0.49 -0.00 0.00 0.00 175.17 176.21 3i4n n PHE 482 N -0.97 0.33 -0.55 2.11 0.99 -1.26 -4.27 117.46 113.83 3i4n n PHE 482 Ca -0.08 -0.26 -0.06 0.00 -0.00 0.00 0.00 57.45 57.05 3i4n n PHE 482 Cb 0.67 -0.01 -0.09 0.00 -1.00 0.00 0.00 39.48 39.05 3i4n n PHE 482 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.76 176.36 3i4n n ASP 483 N 0.85 3.08 0.00 4.37 5.75 -1.26 -4.14 116.55 125.20 3i4n n ASP 483 Ca 0.12 -2.05 0.00 0.00 -0.01 0.00 0.00 54.79 52.86 3i4n n ASP 483 Cb 0.43 -0.81 0.00 0.00 -1.03 0.00 0.00 41.12 39.71 3i4n n ASP 483 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3i4n n GLY 484 N 2.59 0.99 3.74 6.12 0.00 -1.26 -5.07 105.19 112.30 3i4n n GLY 484 Ca 0.22 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 3i4n n GLY 484 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3i4n s ASP 485 N -2.01 7.27 0.23 1.61 1.01 -1.26 -4.97 116.67 118.56 3i4n s ASP 485 Ca 0.00 1.52 0.08 0.00 0.71 0.00 0.00 52.55 54.86 3i4n s ASP 485 Cb 0.00 -2.49 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 3i4n s ASP 485 CO 0.00 0.01 0.10 -1.61 0.21 0.00 0.00 175.17 173.88 3i4n s GLU 486 N -0.09 2.66 0.03 8.23 2.02 -1.26 -1.34 118.70 128.95 3i4n s GLU 486 Ca 0.40 -1.14 0.01 0.00 0.02 0.00 0.00 54.97 54.26 3i4n s GLU 486 Cb -0.21 -2.43 -0.02 0.00 0.10 0.00 0.00 34.13 31.57 3i4n s GLU 486 CO 0.24 0.41 -0.04 -1.64 0.02 0.00 0.00 175.26 174.25 3i4n s MET 487 N -3.54 0.39 0.10 1.61 -1.94 -0.73 -4.85 119.30 110.33 3i4n s MET 487 Ca 0.31 -0.68 0.01 0.00 -1.71 0.00 0.00 55.69 53.62 3i4n s MET 487 Cb -0.08 -0.01 -0.04 0.00 2.01 0.00 0.00 34.83 36.71 3i4n s MET 487 CO 0.22 -0.02 0.26 -0.80 -0.01 0.00 0.00 175.02 174.67 3i4n s ASN 488 N -1.55 6.36 -0.13 3.03 0.01 -0.54 -3.20 114.94 118.93 3i4n s ASN 488 Ca -0.13 0.26 -0.06 0.00 -0.71 0.00 0.00 52.86 52.22 3i4n s ASN 488 Cb -0.09 -1.95 0.05 0.00 0.41 0.00 0.00 41.25 39.66 3i4n s ASN 488 CO -0.01 0.11 0.29 -0.22 -1.51 0.00 0.00 177.10 175.76 3i4n s LEU 489 N -2.82 0.20 0.14 0.60 2.96 0.66 -0.15 118.68 120.26 3i4n s LEU 489 Ca 0.35 0.64 0.06 0.00 -0.22 0.00 0.00 54.13 54.96 3i4n s LEU 489 Cb -0.12 0.91 -0.04 0.00 0.50 0.00 0.00 46.19 47.44 3i4n s LEU 489 CO 0.28 -0.18 0.03 -1.00 -1.32 0.00 0.00 176.35 174.16 3i4n s HIS 490 N 1.41 2.97 -0.25 5.38 3.76 0.14 0.00 115.29 128.70 3i4n s HIS 490 Ca -0.08 -0.07 -0.05 0.00 -0.15 0.00 0.00 55.06 54.71 3i4n s HIS 490 Cb -0.10 -1.46 0.00 0.00 1.11 0.00 0.00 32.58 32.13 3i4n s HIS 490 CO -0.10 0.51 0.00 0.08 -0.85 0.00 0.00 174.74 174.38 3i4n s VAL 491 N -1.59 3.55 1.14 -0.90 1.01 -0.68 -1.33 120.40 121.60 3i4n s VAL 491 Ca 0.28 -0.61 -0.18 0.00 0.00 0.00 0.00 61.98 61.47 3i4n s VAL 491 Cb -0.10 -2.71 0.15 0.00 0.00 0.00 0.00 36.38 33.71 3i4n s VAL 491 CO 0.20 0.28 0.20 -0.81 0.00 0.00 0.00 175.10 174.97 3i4n n PRO 492 N 4.81 -1.87 0.00 2.72 -0.04 -1.26 -4.93 135.00 134.43 3i4n n PRO 492 Ca -0.17 -0.53 0.00 0.00 -0.04 0.00 0.00 63.50 62.77 3i4n n PRO 492 Cb 0.49 -1.79 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 3i4n n PRO 492 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 3i4n n GLN 493 N -2.70 3.53 -4.23 0.54 -0.06 -1.26 -4.93 117.38 108.26 3i4n n GLN 493 Ca 0.01 0.00 -0.29 0.00 -2.00 0.00 0.00 57.00 54.72 3i4n n GLN 493 Cb 0.61 -0.61 -0.10 0.00 -4.06 0.00 0.00 30.24 26.09 3i4n n GLN 493 CO 0.00 0.00 0.00 -1.12 -0.20 0.00 0.00 177.06 175.74 3i4n s SER 494 N -0.74 4.40 0.57 1.69 0.01 -1.26 -4.55 113.70 113.83 3i4n s SER 494 Ca 0.00 -0.42 0.27 0.00 1.31 0.00 0.00 55.95 57.11 3i4n s SER 494 Cb 0.00 -0.83 1.52 0.00 0.21 0.00 0.00 66.02 66.92 3i4n s SER 494 CO 0.00 0.15 2.01 -0.08 0.41 0.00 0.00 173.24 175.74 3i4n h GLU 495 N 3.39 0.00 0.02 12.44 4.57 -1.99 -0.20 114.58 132.81 3i4n h GLU 495 Ca -0.48 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 57.37 3i4n h GLU 495 Cb 1.18 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.72 3i4n h GLU 495 CO 0.53 0.00 -1.95 -0.85 -1.18 0.00 0.00 179.01 175.56 3i4n n GLU 496 N -3.97 0.67 0.26 1.92 0.28 -1.26 -3.29 120.64 115.25 3i4n n GLU 496 Ca 0.06 0.22 -0.16 0.00 -0.16 0.00 0.00 57.16 57.11 3i4n n GLU 496 Cb 0.50 -1.70 -0.08 0.00 1.43 0.00 0.00 31.44 31.59 3i4n n GLU 496 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 177.13 178.12 3i4n h THR 497 N 0.01 0.35 -0.96 3.84 2.02 -1.46 -0.67 112.91 116.04 3i4n h THR 497 Ca -0.38 0.00 0.12 0.00 0.77 0.00 0.00 66.41 66.92 3i4n h THR 497 Cb 2.06 0.35 -0.08 0.00 -1.74 0.00 0.00 68.15 68.74 3i4n h THR 497 CO 0.06 0.00 0.59 0.08 0.37 0.00 0.00 175.52 176.62 3i4n h ARG 498 N -0.74 0.89 -0.36 6.66 0.11 -1.48 0.51 114.38 119.98 3i4n h ARG 498 Ca -0.04 -0.05 0.07 0.00 0.10 0.00 0.00 59.98 60.06 3i4n h ARG 498 Cb 0.62 -0.20 -0.09 0.00 1.11 0.00 0.00 29.97 31.42 3i4n h ARG 498 CO 0.02 0.59 -0.32 0.00 0.10 0.00 0.00 179.97 180.36 3i4n h ALA 499 N 1.53 -0.20 -0.83 0.08 0.00 -1.36 0.27 119.26 118.76 3i4n h ALA 499 Ca 0.48 0.09 0.17 0.00 0.00 0.00 0.00 54.91 55.66 3i4n h ALA 499 Cb 0.51 0.68 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 3i4n h ALA 499 CO -0.28 -0.73 0.55 0.93 0.00 0.00 0.00 179.25 179.72 3i4n h GLU 500 N -0.27 0.41 0.24 0.00 5.08 0.60 -0.79 114.58 119.85 3i4n h GLU 500 Ca 0.16 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 3i4n h GLU 500 Cb 0.53 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3i4n h GLU 500 CO -0.51 0.27 -0.12 -0.07 -1.00 0.00 0.00 179.01 177.59 3i4n h LEU 501 N 0.42 -0.27 -1.75 1.33 3.38 -0.13 -2.96 115.31 115.34 3i4n h LEU 501 Ca 0.42 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 3i4n h LEU 501 Cb 0.99 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 3i4n h LEU 501 CO -0.15 0.20 -0.17 0.77 0.09 0.00 0.00 178.44 179.18 3i4n h SER 502 N -0.85 0.00 0.08 -0.43 4.64 -0.72 1.42 113.55 117.69 3i4n h SER 502 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3i4n h SER 502 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3i4n h SER 502 CO 0.05 0.17 -0.46 0.00 -0.87 0.00 0.00 176.83 175.73 3i4n n GLN 503 N -3.96 0.95 0.00 4.77 3.00 -0.33 -4.48 117.38 117.32 3i4n n GLN 503 Ca -0.02 -0.72 0.00 0.00 -0.01 0.00 0.00 57.00 56.25 3i4n n GLN 503 Cb 0.25 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.01 3i4n n GLN 503 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3i4n n LEU 504 N -0.40 0.00 -0.10 1.08 4.32 -1.12 -4.94 117.00 115.84 3i4n n LEU 504 Ca 0.10 0.00 0.08 0.00 -0.02 0.00 0.00 56.01 56.17 3i4n n LEU 504 Cb 0.41 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.14 3i4n n LEU 504 CO 0.29 0.00 0.04 0.00 -1.22 0.00 0.00 177.39 176.50 3i4n s ALA 506 N -2.44 3.29 0.29 0.00 0.00 -0.78 0.60 121.76 122.71 3i4n s ALA 506 Ca 0.08 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.50 3i4n s ALA 506 Cb 0.13 -3.57 0.63 0.00 0.00 0.00 0.00 23.12 20.31 3i4n s ALA 506 CO 0.63 -1.09 1.79 0.28 0.00 0.00 0.00 175.76 177.37 3i4n h VAL 507 N 2.42 0.78 -0.95 0.00 2.07 -1.85 -1.22 116.25 117.51 3i4n h VAL 507 Ca -0.51 -0.28 0.22 0.00 0.82 0.00 0.00 66.70 66.96 3i4n h VAL 507 Cb 1.26 -0.10 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 3i4n h VAL 507 CO 0.62 0.15 0.63 -0.65 0.02 0.00 0.00 177.57 178.33 3i4n h PRO 508 N 0.81 0.38 0.17 1.57 0.11 -1.88 -2.26 132.00 130.90 3i4n h PRO 508 Ca 0.52 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.60 3i4n h PRO 508 Cb 0.70 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.73 3i4n h PRO 508 CO -0.34 0.25 -0.08 -0.07 -0.21 0.00 0.00 178.00 177.55 3i4n h LEU 509 N 0.39 -0.20 0.00 2.35 3.38 -1.51 -3.26 115.31 116.47 3i4n h LEU 509 Ca 0.51 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.28 3i4n h LEU 509 Cb 1.29 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.09 3i4n h LEU 509 CO -0.20 0.35 0.08 0.00 0.09 0.00 0.00 178.44 178.76 3i4n n GLN 510 N -4.92 0.00 -0.32 1.13 1.13 -0.92 -3.67 117.38 109.81 3i4n n GLN 510 Ca -0.05 0.19 0.20 0.00 -1.94 0.00 0.00 57.00 55.39 3i4n n GLN 510 Cb 0.19 -1.58 0.41 0.00 0.11 0.00 0.00 30.24 29.36 3i4n n GLN 510 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 3i4n h ILE 511 N 0.00 0.33 -3.51 5.09 2.04 -1.47 -3.35 117.51 116.64 3i4n h ILE 511 Ca 0.00 -0.11 -0.70 0.00 1.00 0.00 0.00 64.86 65.05 3i4n h ILE 511 Cb 0.17 -0.01 -0.33 0.00 -0.74 0.00 0.00 36.82 35.91 3i4n h ILE 511 CO 0.00 0.06 -0.55 -0.69 0.00 0.00 0.00 178.15 176.97 3i4n s VAL 512 N -5.76 3.47 0.21 1.67 1.01 -1.24 -1.33 120.40 118.43 3i4n s VAL 512 Ca -0.11 -1.82 -0.31 0.00 0.00 0.00 0.00 61.98 59.75 3i4n s VAL 512 Cb 0.29 -3.27 -0.11 0.00 0.00 0.00 0.00 36.38 33.29 3i4n s VAL 512 CO 0.78 -0.57 1.56 -0.55 0.00 0.00 0.00 175.10 176.32 3i4n s SER 513 N 1.84 6.54 0.34 3.32 0.15 -1.13 -4.77 113.70 119.98 3i4n s SER 513 Ca 0.05 2.72 0.24 0.00 0.70 0.00 0.00 55.95 59.66 3i4n s SER 513 Cb -0.23 -2.61 0.43 0.00 -1.71 0.00 0.00 66.02 61.90 3i4n s SER 513 CO -0.02 -0.83 1.58 1.55 1.20 0.00 0.00 173.24 176.72 3i4n h PRO 514 N 6.02 0.00 0.00 5.44 0.13 -1.89 -0.78 132.00 140.91 3i4n h PRO 514 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3i4n h PRO 514 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3i4n h PRO 514 CO 0.87 0.00 0.00 -0.56 -0.23 0.00 0.00 178.00 178.08 3i4n h GLN 515 N 0.00 0.00 0.00 0.86 3.07 -1.93 -3.18 115.11 113.93 3i4n h GLN 515 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 58.65 58.67 3i4n h GLN 515 Cb 0.92 0.00 -0.13 0.00 0.08 0.00 0.00 27.48 28.35 3i4n h GLN 515 CO 0.00 0.00 -0.48 -1.13 0.09 0.00 0.00 178.83 177.31 3i4n n SER 516 N -2.63 0.06 -3.37 0.06 3.41 -1.19 -2.84 113.62 107.12 3i4n n SER 516 Ca -0.00 -1.76 -0.17 0.00 -0.26 0.00 0.00 58.87 56.67 3i4n n SER 516 Cb 0.15 -0.08 -0.05 0.00 -0.26 0.00 0.00 64.21 63.98 3i4n n SER 516 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3i4n n ASN 517 N 0.13 0.21 -3.64 4.04 0.23 -0.33 -4.85 115.26 111.04 3i4n n ASN 517 Ca -0.04 -0.66 -0.13 0.00 -0.53 0.00 0.00 54.58 53.21 3i4n n ASN 517 Cb 0.77 -0.83 -0.07 0.00 -2.08 0.00 0.00 39.78 37.57 3i4n n ASN 517 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 3i4n s LYS 518 N -5.07 0.78 0.62 -3.83 2.20 -1.02 -4.74 119.74 108.69 3i4n s LYS 518 Ca 0.09 0.97 -0.17 0.00 -0.36 0.00 0.00 55.97 56.49 3i4n s LYS 518 Cb -0.05 0.36 -0.10 0.00 -1.51 0.00 0.00 37.83 36.53 3i4n s LYS 518 CO 0.52 -0.10 0.18 -0.35 -0.36 0.00 0.00 175.35 175.24 3i4n n PRO 519 N 2.86 0.23 -0.14 4.03 -0.04 -1.26 -2.84 135.00 137.84 3i4n n PRO 519 Ca -0.15 0.10 0.09 0.00 -0.04 0.00 0.00 63.50 63.50 3i4n n PRO 519 Cb 0.56 -1.42 0.14 0.00 -0.04 0.00 0.00 33.50 32.73 3i4n n PRO 519 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3i4n n MET 521 N -1.36 0.00 0.00 0.00 2.81 -1.26 -4.26 117.12 113.05 3i4n n MET 521 Ca 0.16 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 3i4n n MET 521 Cb 0.65 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.16 3i4n n MET 521 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3i4n n GLY 522 N 0.00 1.70 3.70 3.03 0.00 -1.26 -3.75 105.19 108.61 3i4n n GLY 522 Ca 0.00 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 3i4n n GLY 522 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i4n s ILE 523 N -1.50 4.37 0.40 -0.61 1.01 -0.91 -4.55 121.20 119.41 3i4n s ILE 523 Ca 0.00 1.69 0.04 0.00 0.00 0.00 0.00 60.65 62.39 3i4n s ILE 523 Cb 0.00 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 3i4n s ILE 523 CO 0.00 0.06 0.04 -0.69 0.00 0.00 0.00 174.94 174.36 3i4n s VAL 524 N 1.61 1.38 0.00 2.92 1.01 -1.26 -4.60 120.40 121.46 3i4n s VAL 524 Ca 0.55 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.53 3i4n s VAL 524 Cb -0.25 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.45 3i4n s VAL 524 CO 0.25 0.00 0.00 0.00 0.00 0.00 0.00 175.10 175.35 3i4n n GLN 525 N -0.92 0.00 -0.27 2.72 6.02 -1.26 -1.98 117.38 121.68 3i4n n GLN 525 Ca -0.07 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 56.88 3i4n n GLN 525 Cb 0.67 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.90 3i4n n GLN 525 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3i4n n ASP 526 N 0.66 -0.60 -0.23 1.08 9.92 -1.26 0.11 116.55 126.23 3i4n n ASP 526 Ca 0.00 1.19 -0.05 0.00 -0.53 0.00 0.00 54.79 55.40 3i4n n ASP 526 Cb 0.00 -0.20 0.10 0.00 -0.64 0.00 0.00 41.12 40.37 3i4n n ASP 526 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 3i4n h THR 527 N 0.00 1.25 0.10 -3.53 2.02 -1.84 0.10 112.91 111.02 3i4n h THR 527 Ca 0.16 -0.87 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 3i4n h THR 527 Cb 0.33 0.49 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 3i4n h THR 527 CO -0.65 0.34 -0.05 0.25 0.37 0.00 0.00 175.52 175.78 3i4n h LEU 528 N 1.03 -0.12 -1.27 2.58 5.85 0.14 0.82 115.31 124.34 3i4n h LEU 528 Ca 0.23 -0.21 0.08 0.00 0.84 0.00 0.00 57.88 58.81 3i4n h LEU 528 Cb 0.29 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 3i4n h LEU 528 CO -0.01 0.15 0.54 0.00 -0.34 0.00 0.00 178.44 178.78 3i4n h GLY 530 N 0.85 0.35 -0.44 0.00 0.00 -0.54 -3.30 103.07 99.99 3i4n h GLY 530 Ca 0.37 -0.89 0.31 0.00 0.00 0.00 0.00 47.33 47.12 3i4n h GLY 530 CO -0.14 0.78 0.68 1.19 0.00 0.00 0.00 176.54 179.05 3i4n h ILE 531 N -0.34 0.39 0.54 2.60 6.09 0.81 0.27 117.51 127.87 3i4n h ILE 531 Ca -0.17 -0.11 -0.03 0.00 -1.37 0.00 0.00 64.86 63.18 3i4n h ILE 531 Cb 1.69 0.03 0.01 0.00 0.47 0.00 0.00 36.82 39.01 3i4n h ILE 531 CO 0.14 0.06 -0.26 -0.09 -3.07 0.00 0.00 178.15 174.93 3i4n h ARG 532 N 0.33 -0.70 -0.53 2.19 2.43 -1.50 -2.56 114.38 114.05 3i4n h ARG 532 Ca 0.68 0.05 0.10 0.00 -0.81 0.00 0.00 59.98 60.00 3i4n h ARG 532 Cb 1.75 0.16 -0.11 0.00 -0.42 0.00 0.00 29.97 31.36 3i4n h ARG 532 CO -0.41 -0.46 -0.24 0.87 -1.51 0.00 0.00 179.97 178.22 3i4n h LYS 533 N -1.14 -0.11 -1.00 0.20 1.57 -1.36 0.21 116.57 114.95 3i4n h LYS 533 Ca -0.07 0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.88 3i4n h LYS 533 Cb 0.55 0.03 -0.10 0.00 0.08 0.00 0.00 32.23 32.79 3i4n h LYS 533 CO 0.12 -0.08 0.62 1.25 -0.57 0.00 0.00 179.45 180.79 3i4n h LEU 534 N -0.12 0.81 0.00 2.94 5.85 -1.05 -3.29 115.31 120.46 3i4n h LEU 534 Ca 0.24 0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.04 3i4n h LEU 534 Cb 0.49 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.45 3i4n h LEU 534 CO -0.60 0.34 0.00 0.41 -0.34 0.00 0.00 178.44 178.25 3i4n n THR 535 N -4.70 0.00 0.00 1.05 -1.04 0.74 -2.71 114.28 107.61 3i4n n THR 535 Ca 0.22 1.10 0.00 0.00 -2.04 0.00 0.00 64.05 63.33 3i4n n THR 535 Cb 0.51 -2.08 0.00 0.00 -1.82 0.00 0.00 70.33 66.94 3i4n n THR 535 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3i4n n LEU 536 N -0.83 0.00 -0.31 -4.42 4.77 -1.14 -3.79 117.00 111.28 3i4n n LEU 536 Ca 0.00 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.14 3i4n n LEU 536 Cb 0.00 0.00 0.33 0.00 -2.33 0.00 0.00 43.42 41.42 3i4n n LEU 536 CO 0.00 0.00 0.97 0.03 -1.33 0.00 0.00 177.39 177.06 3i4n h ARG 537 N 0.00 0.20 0.00 3.23 3.08 -1.92 0.37 114.38 119.34 3i4n h ARG 537 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3i4n h ARG 537 Cb 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.01 3i4n h ARG 537 CO 0.00 0.13 0.00 -3.47 -1.07 0.00 0.00 179.97 175.56 3i4n n ASP 538 N -5.22 0.00 -4.20 7.04 2.03 -1.26 -4.63 116.55 110.30 3i4n n ASP 538 Ca 0.24 -0.29 -0.33 0.00 0.52 0.00 0.00 54.79 54.93 3i4n n ASP 538 Cb 0.77 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 41.01 3i4n n ASP 538 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3i4n s THR 539 N -2.00 2.48 0.18 5.18 2.01 0.13 -5.11 115.64 118.51 3i4n s THR 539 Ca 0.04 -0.81 0.06 0.00 0.31 0.00 0.00 61.69 61.28 3i4n s THR 539 Cb 0.02 -2.06 -0.05 0.00 0.01 0.00 0.00 72.50 70.42 3i4n s THR 539 CO 0.03 0.51 -0.11 -0.36 -0.69 0.00 0.00 174.62 174.00 3i4n s PHE 540 N 1.14 1.49 -0.07 4.92 0.40 -1.26 -2.92 117.98 121.69 3i4n s PHE 540 Ca 0.01 -0.69 -0.04 0.00 -0.60 0.00 0.00 56.93 55.61 3i4n s PHE 540 Cb -0.14 -0.74 0.03 0.00 0.51 0.00 0.00 43.02 42.68 3i4n s PHE 540 CO -0.06 0.20 0.17 0.42 0.70 0.00 0.00 175.22 176.65 3i4n s ILE 541 N -3.17 -0.03 0.85 0.64 1.01 1.06 -4.89 121.20 116.67 3i4n s ILE 541 Ca 0.20 0.09 -0.12 0.00 0.00 0.00 0.00 60.65 60.82 3i4n s ILE 541 Cb 0.01 -0.26 0.10 0.00 0.01 0.00 0.00 42.46 42.33 3i4n s ILE 541 CO 0.04 0.04 1.18 -1.83 0.00 0.00 0.00 174.94 174.37 3i4n s GLU 542 N 0.69 1.65 0.16 2.79 -1.05 -1.26 0.56 118.70 122.25 3i4n s GLU 542 Ca -0.05 0.10 -0.18 0.00 -0.15 0.00 0.00 54.97 54.69 3i4n s GLU 542 Cb -0.07 -1.92 0.09 0.00 -0.44 0.00 0.00 34.13 31.80 3i4n s GLU 542 CO -0.04 -1.81 1.66 1.25 0.95 0.00 0.00 175.26 177.27 3i4n h LEU 543 N -1.21 -0.49 -0.69 1.83 5.85 -1.96 -1.96 115.31 116.68 3i4n h LEU 543 Ca -0.47 0.13 0.13 0.00 0.84 0.00 0.00 57.88 58.52 3i4n h LEU 543 Cb 1.32 0.29 -0.13 0.00 0.37 0.00 0.00 40.66 42.51 3i4n h LEU 543 CO 0.63 -0.17 -0.22 -2.24 -0.34 0.00 0.00 178.44 176.09 3i4n h ASP 544 N -0.06 -0.80 0.00 1.25 2.03 -1.96 -0.90 116.42 115.97 3i4n h ASP 544 Ca 0.19 0.22 -0.02 0.00 -0.73 0.00 0.00 57.03 56.68 3i4n h ASP 544 Cb 0.35 0.48 0.00 0.00 -0.83 0.00 0.00 39.33 39.33 3i4n h ASP 544 CO -0.42 -0.25 -0.08 -0.61 -1.03 0.00 0.00 179.24 176.84 3i4n h GLN 545 N -0.04 0.05 -1.03 4.15 4.15 -1.93 -3.20 115.11 117.26 3i4n h GLN 545 Ca 0.32 -0.06 0.26 0.00 0.77 0.00 0.00 58.65 59.94 3i4n h GLN 545 Cb 0.53 0.02 -0.11 0.00 0.21 0.00 0.00 27.48 28.13 3i4n h GLN 545 CO -0.73 0.85 0.63 0.28 -1.93 0.00 0.00 178.83 177.93 3i4n h VAL 546 N -0.72 0.51 -0.51 2.39 2.07 -1.05 0.28 116.25 119.23 3i4n h VAL 546 Ca -0.01 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.29 3i4n h VAL 546 Cb 0.88 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 3i4n h VAL 546 CO 0.02 0.09 0.12 -0.07 0.02 0.00 0.00 177.57 177.75 3i4n h LEU 547 N 0.50 0.78 -0.63 2.57 3.38 -1.23 0.77 115.31 121.44 3i4n h LEU 547 Ca 0.63 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 58.26 3i4n h LEU 547 Cb 1.37 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 3i4n h LEU 547 CO -0.41 0.82 -0.07 0.78 0.09 0.00 0.00 178.44 179.65 3i4n h ASN 548 N 0.71 1.00 0.56 -0.43 2.35 -0.58 -1.75 115.58 117.43 3i4n h ASN 548 Ca 0.16 -0.31 -0.03 0.00 -0.55 0.00 0.00 56.30 55.58 3i4n h ASN 548 Cb 0.34 -0.27 0.01 0.00 0.05 0.00 0.00 38.32 38.45 3i4n h ASN 548 CO 0.00 1.08 -0.27 0.24 -1.65 0.00 0.00 177.43 176.84 3i4n h MET 549 N 0.91 -0.72 -0.79 0.81 2.86 -0.51 -2.09 114.93 115.41 3i4n h MET 549 Ca 0.15 0.05 0.18 0.00 -2.06 0.00 0.00 59.70 58.02 3i4n h MET 549 Cb 0.62 0.16 -0.14 0.00 0.06 0.00 0.00 31.60 32.30 3i4n h MET 549 CO 0.04 -0.44 -0.00 -0.07 1.06 0.00 0.00 176.91 177.50 3i4n h LEU 550 N -0.85 -0.38 -0.63 1.22 3.38 -0.71 -0.26 115.31 117.09 3i4n h LEU 550 Ca -0.08 0.21 0.02 0.00 0.09 0.00 0.00 57.88 58.12 3i4n h LEU 550 Cb 0.61 0.37 -0.04 0.00 0.09 0.00 0.00 40.66 41.69 3i4n h LEU 550 CO 0.13 -0.20 0.40 0.22 0.09 0.00 0.00 178.44 179.08 3i4n h TYR 551 N 0.09 0.75 0.00 1.13 3.20 -1.09 -2.45 116.97 118.61 3i4n h TYR 551 Ca 0.43 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.32 3i4n h TYR 551 Cb 0.77 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.79 3i4n h TYR 551 CO -0.44 0.45 0.20 -1.49 -1.64 0.00 0.00 178.16 175.24 3i4n h TRP 552 N 0.80 0.00 -3.54 -3.82 4.06 -0.33 -3.37 115.95 109.75 3i4n h TRP 552 Ca 0.24 0.00 -0.66 0.00 2.06 0.00 0.00 58.89 60.54 3i4n h TRP 552 Cb -0.03 0.00 -0.16 0.00 -1.00 0.00 0.00 29.16 27.97 3i4n h TRP 552 CO -0.04 0.00 0.12 0.08 -3.56 0.00 0.00 178.44 175.04 3i4n s VAL 553 N -3.84 4.83 0.29 1.49 1.01 -0.92 -4.83 120.40 118.42 3i4n s VAL 553 Ca -0.03 0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.95 3i4n s VAL 553 Cb 0.08 -4.22 0.44 0.00 0.00 0.00 0.00 36.38 32.68 3i4n s VAL 553 CO 0.25 -0.63 1.55 -0.81 0.00 0.00 0.00 175.10 175.46 3i4n n PRO 554 N 6.27 -0.08 0.01 2.72 -0.04 -1.26 -2.50 135.00 140.12 3i4n n PRO 554 Ca -0.02 1.52 -0.18 0.00 -0.04 0.00 0.00 63.50 64.78 3i4n n PRO 554 Cb 0.48 -2.33 -0.11 0.00 -0.04 0.00 0.00 33.50 31.50 3i4n n PRO 554 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3i4n h ASP 555 N 0.00 0.54 0.00 3.54 3.32 -1.93 -3.48 116.42 118.41 3i4n h ASP 555 Ca 0.53 -0.78 0.00 0.00 0.02 0.00 0.00 57.03 56.80 3i4n h ASP 555 Cb 0.95 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.33 3i4n h ASP 555 CO -0.98 1.25 0.00 1.87 -1.72 0.00 0.00 179.24 179.66 3i4n n TRP 556 N -4.19 0.00 0.00 4.55 -0.00 -1.04 -4.57 117.44 112.19 3i4n n TRP 556 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.39 3i4n n TRP 556 Cb 0.70 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 32.01 3i4n n TRP 556 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 3i4n n ASP 557 N 0.00 0.00 -1.67 5.87 5.75 -1.26 -4.71 116.55 120.53 3i4n n ASP 557 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 54.79 54.63 3i4n n ASP 557 Cb 0.00 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.08 3i4n n ASP 557 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3i4n n GLY 558 N -0.87 -0.06 2.65 6.12 0.00 -1.26 -4.97 105.19 106.79 3i4n n GLY 558 Ca 0.00 -0.25 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 3i4n n GLY 558 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i4n s VAL 559 N -2.74 0.34 0.42 1.61 1.01 -1.26 -5.12 120.40 114.67 3i4n s VAL 559 Ca 0.00 -0.80 -0.23 0.00 0.00 0.00 0.00 61.98 60.94 3i4n s VAL 559 Cb 0.00 -1.13 -0.11 0.00 0.00 0.00 0.00 36.38 35.14 3i4n s VAL 559 CO 0.00 -0.52 0.84 2.30 0.00 0.00 0.00 175.10 177.72 3i4n n ILE 560 N 5.09 2.27 -3.13 2.22 -5.35 -1.26 -4.98 119.36 114.22 3i4n n ILE 560 Ca -0.06 -0.50 -0.29 0.00 -0.27 0.00 0.00 62.75 61.63 3i4n n ILE 560 Cb 0.44 -0.92 -0.03 0.00 -1.74 0.00 0.00 39.64 37.39 3i4n n ILE 560 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 3i4n s PRO 561 N -1.88 3.69 -0.12 6.28 0.04 -1.26 -5.03 135.00 136.72 3i4n s PRO 561 Ca 0.64 0.19 -0.29 0.00 0.04 0.00 0.00 61.00 61.58 3i4n s PRO 561 Cb -0.58 -2.54 -0.02 0.00 0.04 0.00 0.00 34.50 31.40 3i4n s PRO 561 CO 0.57 0.10 1.27 0.99 0.04 0.00 0.00 177.00 179.97 3i4n s THR 562 N -2.22 4.21 0.23 1.26 2.01 -1.26 -4.97 115.64 114.91 3i4n s THR 562 Ca 0.47 1.50 -0.31 0.00 0.31 0.00 0.00 61.69 63.65 3i4n s THR 562 Cb -0.10 -3.96 -0.14 0.00 0.01 0.00 0.00 72.50 68.30 3i4n s THR 562 CO 0.31 -0.09 1.30 -2.65 -0.69 0.00 0.00 174.62 172.80 3i4n n PRO 563 N 6.20 1.73 0.25 4.92 -0.02 -1.26 -4.86 135.00 141.95 3i4n n PRO 563 Ca 0.13 0.61 0.16 0.00 -2.02 0.00 0.00 63.50 62.39 3i4n n PRO 563 Cb 0.45 -2.20 0.63 0.00 -0.02 0.00 0.00 33.50 32.36 3i4n n PRO 563 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i4n h ALA 564 N 3.75 1.00 -3.56 3.55 0.00 -1.90 -3.38 119.26 118.72 3i4n h ALA 564 Ca -0.44 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.86 3i4n h ALA 564 Cb 1.30 0.00 -0.39 0.00 0.00 0.00 0.00 17.79 18.70 3i4n h ALA 564 CO 0.72 0.00 -0.77 0.42 0.00 0.00 0.00 179.25 179.63 3i4n s ILE 565 N -3.58 1.54 -0.47 0.00 1.01 -1.22 -4.88 121.20 113.61 3i4n s ILE 565 Ca 0.02 -1.45 0.17 0.00 0.00 0.00 0.00 60.65 59.39 3i4n s ILE 565 Cb 0.09 -1.93 -0.22 0.00 0.01 0.00 0.00 42.46 40.41 3i4n s ILE 565 CO 0.52 -0.29 0.57 -0.38 0.00 0.00 0.00 174.94 175.36 3i4n n ILE 566 N 4.63 0.00 0.00 2.92 5.41 -1.26 -0.94 119.36 130.12 3i4n n ILE 566 Ca -0.07 -0.23 0.00 0.00 1.00 0.00 0.00 62.75 63.45 3i4n n ILE 566 Cb 0.43 0.63 0.00 0.00 -0.71 0.00 0.00 39.64 39.99 3i4n n ILE 566 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 3i4n n LYS 567 N -1.69 0.00 -0.03 0.38 4.81 -1.26 -4.40 118.16 115.97 3i4n n LYS 567 Ca 0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.43 3i4n n LYS 567 Cb 0.34 0.00 -0.00 0.00 0.02 0.00 0.00 35.03 35.39 3i4n n LYS 567 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 3i4n h PRO 568 N 0.00 0.00 -5.01 1.64 0.14 -2.03 -3.45 132.00 123.28 3i4n h PRO 568 Ca 0.00 0.00 -0.65 0.00 0.14 0.00 0.00 66.00 65.49 3i4n h PRO 568 Cb 0.00 0.00 -0.24 0.00 0.14 0.00 0.00 31.00 30.90 3i4n h PRO 568 CO 0.00 0.00 -0.67 0.21 0.14 0.00 0.00 178.00 177.68 3i4n s LYS 569 N -1.46 3.55 0.05 0.86 2.20 -1.26 -5.08 119.74 118.60 3i4n s LYS 569 Ca -0.03 -0.54 -0.30 0.00 -0.36 0.00 0.00 55.97 54.73 3i4n s LYS 569 Cb 0.00 -3.15 -0.08 0.00 -1.51 0.00 0.00 37.83 33.10 3i4n s LYS 569 CO 0.05 -0.13 1.77 -1.25 -0.36 0.00 0.00 175.35 175.43 3i4n s PRO 570 N 1.39 4.17 0.38 4.03 0.04 -1.22 -4.65 135.00 139.13 3i4n s PRO 570 Ca 0.05 2.43 0.06 0.00 0.04 0.00 0.00 61.00 63.58 3i4n s PRO 570 Cb -0.15 -3.83 -0.07 0.00 0.04 0.00 0.00 34.50 30.49 3i4n s PRO 570 CO 0.01 -0.84 0.02 -0.51 0.04 0.00 0.00 177.00 175.71 3i4n s LEU 571 N 3.45 2.68 0.04 -3.56 1.02 -0.11 -4.19 118.68 118.01 3i4n s LEU 571 Ca 0.79 -1.36 0.02 0.00 0.02 0.00 0.00 54.13 53.60 3i4n s LEU 571 Cb -0.40 -0.76 -0.02 0.00 0.02 0.00 0.00 46.19 45.02 3i4n s LEU 571 CO 0.35 -0.48 -0.07 0.26 0.02 0.00 0.00 176.35 176.43 3i4n s TRP 572 N -2.87 0.63 0.17 0.29 0.51 0.19 -2.91 118.94 114.94 3i4n s TRP 572 Ca 0.35 -0.47 0.07 0.00 -2.12 0.00 0.00 56.10 53.92 3i4n s TRP 572 Cb 0.09 -0.38 -0.04 0.00 -0.81 0.00 0.00 33.47 32.33 3i4n s TRP 572 CO 0.17 -0.09 0.03 -1.54 -0.51 0.00 0.00 176.95 175.02 3i4n s SER 573 N -1.48 4.96 0.06 2.95 1.04 -1.26 0.34 113.70 120.32 3i4n s SER 573 Ca -0.10 -0.32 -0.14 0.00 0.48 0.00 0.00 55.95 55.87 3i4n s SER 573 Cb -0.09 -1.12 -0.04 0.00 0.10 0.00 0.00 66.02 64.86 3i4n s SER 573 CO 0.00 0.09 1.24 1.23 0.98 0.00 0.00 173.24 176.78 3i4n h GLY 574 N 2.67 -1.74 -0.99 7.32 0.00 -1.39 0.30 103.07 109.25 3i4n h GLY 574 Ca -0.47 0.90 0.18 0.00 0.00 0.00 0.00 47.33 47.94 3i4n h GLY 574 CO 0.59 -0.52 -0.30 0.50 0.00 0.00 0.00 176.54 176.81 3i4n h LYS 575 N -0.08 -0.00 -0.36 4.80 1.57 -1.69 0.99 116.57 121.80 3i4n h LYS 575 Ca 0.05 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 3i4n h LYS 575 Cb 0.22 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.48 3i4n h LYS 575 CO -0.34 -0.00 -0.21 1.04 -0.57 0.00 0.00 179.45 179.37 3i4n n GLN 576 N -5.57 -0.16 0.09 3.15 6.02 0.10 -1.51 117.38 119.50 3i4n n GLN 576 Ca 0.14 1.16 -0.22 0.00 -0.01 0.00 0.00 57.00 58.06 3i4n n GLN 576 Cb 0.46 -1.72 -0.14 0.00 1.02 0.00 0.00 30.24 29.87 3i4n n GLN 576 CO 0.00 0.00 0.00 -0.84 -1.01 0.00 0.00 177.06 175.21 3i4n h ILE 577 N 0.00 1.32 -1.40 5.09 3.07 -1.13 -3.24 117.51 121.22 3i4n h ILE 577 Ca 0.06 -2.48 0.41 0.00 1.55 0.00 0.00 64.86 64.40 3i4n h ILE 577 Cb 0.15 2.81 -0.06 0.00 -0.27 0.00 0.00 36.82 39.45 3i4n h ILE 577 CO -0.34 0.74 1.09 0.25 -1.05 0.00 0.00 178.15 178.84 3i4n h LEU 578 N 0.14 0.00 0.00 0.16 5.85 -0.51 2.37 115.31 123.32 3i4n h LEU 578 Ca -0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.53 3i4n h LEU 578 Cb 1.88 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.91 3i4n h LEU 578 CO 0.23 0.00 0.00 -1.20 -0.34 0.00 0.00 178.44 177.13 3i4n n SER 579 N -3.92 0.00 0.27 1.25 7.64 -0.57 -2.57 113.62 115.72 3i4n n SER 579 Ca 0.31 0.28 0.16 0.00 1.01 0.00 0.00 58.87 60.63 3i4n n SER 579 Cb 1.53 -0.42 0.62 0.00 -1.01 0.00 0.00 64.21 64.93 3i4n n SER 579 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3i4n h VAL 580 N 0.00 0.08 0.00 0.44 2.07 0.39 -2.49 116.25 116.73 3i4n h VAL 580 Ca 0.00 -0.63 -0.25 0.00 0.82 0.00 0.00 66.70 66.64 3i4n h VAL 580 Cb 0.34 1.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.64 3i4n h VAL 580 CO 0.00 0.03 -1.36 0.00 0.02 0.00 0.00 177.57 176.26 3i4n h ALA 581 N 1.97 0.57 -2.04 1.67 0.00 -1.62 -3.44 119.26 116.36 3i4n h ALA 581 Ca -0.00 -1.19 -0.57 0.00 0.00 0.00 0.00 54.91 53.15 3i4n h ALA 581 Cb 0.58 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 3i4n h ALA 581 CO 0.00 1.42 0.97 0.42 0.00 0.00 0.00 179.25 182.06 3i4n s ILE 582 N -2.65 4.12 0.00 0.00 1.01 -0.94 -4.89 121.20 117.85 3i4n s ILE 582 Ca -0.02 1.30 0.00 0.00 0.00 0.00 0.00 60.65 61.93 3i4n s ILE 582 Cb 0.09 -4.04 0.00 0.00 0.01 0.00 0.00 42.46 38.52 3i4n s ILE 582 CO 0.82 -0.33 0.00 -0.81 0.00 0.00 0.00 174.94 174.62 3i4n n PRO 583 N 7.12 2.44 -4.40 2.79 -0.04 -1.26 -4.74 135.00 136.91 3i4n n PRO 583 Ca 0.15 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.37 3i4n n PRO 583 Cb 0.46 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.83 3i4n n PRO 583 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3i4n s ASN 584 N -2.30 3.95 0.00 3.54 0.01 -1.26 -3.99 114.94 114.90 3i4n s ASN 584 Ca 0.00 -0.87 0.00 0.00 -0.71 0.00 0.00 52.86 51.28 3i4n s ASN 584 Cb 0.00 -0.51 0.00 0.00 0.41 0.00 0.00 41.25 41.15 3i4n s ASN 584 CO 0.00 0.03 0.00 0.61 -1.51 0.00 0.00 177.10 176.23 3i4n n GLY 585 N -0.67 0.97 3.61 0.66 0.00 -1.15 -4.80 105.19 103.81 3i4n n GLY 585 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 3i4n n GLY 585 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i4n s ILE 586 N -2.49 4.17 -0.09 -0.61 -1.09 -1.26 -4.77 121.20 115.05 3i4n s ILE 586 Ca 0.00 1.24 0.02 0.00 -2.23 0.00 0.00 60.65 59.67 3i4n s ILE 586 Cb 0.00 -4.42 -0.02 0.00 -1.58 0.00 0.00 42.46 36.44 3i4n s ILE 586 CO 0.00 -0.80 -0.13 -1.00 -1.23 0.00 0.00 174.94 171.78 3i4n s HIS 587 N 4.57 2.78 -0.02 3.97 3.76 -1.26 -1.95 115.29 127.14 3i4n s HIS 587 Ca 0.52 -0.36 -0.01 0.00 -0.15 0.00 0.00 55.06 55.06 3i4n s HIS 587 Cb -0.11 -1.74 0.01 0.00 1.11 0.00 0.00 32.58 31.86 3i4n s HIS 587 CO 0.28 0.02 0.04 -1.17 -0.85 0.00 0.00 174.74 173.07 3i4n s LEU 588 N -0.23 1.56 -0.11 0.89 2.96 0.12 -4.95 118.68 118.92 3i4n s LEU 588 Ca 0.01 0.09 -0.01 0.00 -0.22 0.00 0.00 54.13 54.00 3i4n s LEU 588 Cb -0.13 0.10 0.03 0.00 0.50 0.00 0.00 46.19 46.68 3i4n s LEU 588 CO 0.03 -0.05 -0.05 -1.10 -1.32 0.00 0.00 176.35 173.85 3i4n s GLN 589 N 0.39 1.27 0.00 1.98 -0.21 -1.24 -1.74 119.66 120.11 3i4n s GLN 589 Ca -0.03 -0.21 0.00 0.00 0.02 0.00 0.00 55.36 55.14 3i4n s GLN 589 Cb -0.04 -1.51 0.00 0.00 1.00 0.00 0.00 33.01 32.45 3i4n s GLN 589 CO -0.01 -0.31 0.00 -2.13 -2.12 0.00 0.00 175.29 170.72 3i4n n ARG 590 N 4.99 0.00 -0.69 2.91 0.63 -0.11 -4.94 116.66 119.45 3i4n n ARG 590 Ca -0.11 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.82 3i4n n ARG 590 Cb 0.50 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.41 3i4n n ARG 590 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 3i4n n PHE 591 N 0.00 0.00 0.00 -0.14 3.01 -1.26 -4.90 117.46 114.17 3i4n n PHE 591 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3i4n n PHE 591 Cb 0.00 -0.69 0.00 0.00 -0.01 0.00 0.00 39.48 38.78 3i4n n PHE 591 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 3i4n n ASP 592 N -0.22 0.00 0.00 4.37 8.00 -1.26 -4.92 116.55 122.52 3i4n n ASP 592 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3i4n n ASP 592 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3i4n n ASP 592 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3i4n n GLU 593 N 0.00 0.00 -0.49 -1.24 1.02 -1.26 -4.77 120.64 113.91 3i4n n GLU 593 Ca 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.13 3i4n n GLU 593 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3i4n n GLU 593 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i4n n GLY 594 N 4.17 2.55 3.76 0.62 0.00 -1.26 -4.88 105.19 110.15 3i4n n GLY 594 Ca 0.00 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 3i4n n GLY 594 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i4n s THR 595 N -0.12 3.43 -0.33 2.61 2.01 -1.26 -4.32 115.64 117.65 3i4n s THR 595 Ca 0.02 1.38 0.14 0.00 0.31 0.00 0.00 61.69 63.54 3i4n s THR 595 Cb 0.01 -3.86 0.42 0.00 0.01 0.00 0.00 72.50 69.09 3i4n s THR 595 CO -0.00 0.29 1.46 0.35 -0.69 0.00 0.00 174.62 176.02 3i4n n THR 596 N 0.94 0.21 0.00 -0.82 -2.24 -1.26 -4.89 114.28 106.22 3i4n n THR 596 Ca 0.00 -1.37 0.00 0.00 -2.27 0.00 0.00 64.05 60.41 3i4n n THR 596 Cb 0.45 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 3i4n n THR 596 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3i4n n LEU 597 N -1.30 0.00 -1.00 3.22 4.32 -1.26 -3.91 117.00 117.07 3i4n n LEU 597 Ca -0.12 0.00 0.03 0.00 -0.02 0.00 0.00 56.01 55.89 3i4n n LEU 597 Cb 0.86 0.00 0.14 0.00 -1.62 0.00 0.00 43.42 42.81 3i4n n LEU 597 CO -0.11 0.00 0.26 -0.11 -1.22 0.00 0.00 177.39 176.21 3i4n n LEU 598 N 0.00 2.47 -1.86 2.23 0.00 -1.26 -5.07 117.00 113.50 3i4n n LEU 598 Ca 0.00 -3.52 -0.26 0.00 0.00 0.00 0.00 56.01 52.23 3i4n n LEU 598 Cb 0.00 -0.36 -0.04 0.00 0.00 0.00 0.00 43.42 43.02 3i4n n LEU 598 CO 0.00 1.25 0.38 -1.54 0.00 0.00 0.00 177.39 177.48 3i4n n SER 599 N -0.70 0.31 0.00 1.96 3.41 -1.25 -4.88 113.62 112.47 3i4n n SER 599 Ca 0.18 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 3i4n n SER 599 Cb 0.82 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 3i4n n SER 599 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 3i4n n PRO 600 N 1.25 0.00 0.00 4.33 -0.04 -1.26 -3.74 135.00 135.53 3i4n n PRO 600 Ca 0.11 0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.85 3i4n n PRO 600 Cb -0.00 -0.97 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 3i4n n PRO 600 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3i4n n LYS 601 N -1.34 0.24 -2.08 0.54 5.02 -1.26 -4.66 118.16 114.61 3i4n n LYS 601 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 3i4n n LYS 601 Cb 0.00 -1.10 -0.03 0.00 -0.02 0.00 0.00 35.03 33.89 3i4n n LYS 601 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3i4n n ASP 602 N 0.21 -5.09 0.00 4.39 8.00 -1.25 -4.89 116.55 117.93 3i4n n ASP 602 Ca 0.00 0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.62 3i4n n ASP 602 Cb 0.05 -4.16 0.00 0.00 -0.02 0.00 0.00 41.12 36.99 3i4n n ASP 602 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3i4n n ASN 603 N -1.16 0.00 -3.13 -2.24 4.13 -1.26 -2.60 115.26 109.00 3i4n n ASN 603 Ca -0.20 0.05 0.00 0.00 1.68 0.00 0.00 54.58 56.11 3i4n n ASN 603 Cb 0.63 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.87 3i4n n ASN 603 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3i4n n GLY 604 N -0.09 -2.47 3.01 7.41 0.00 -1.26 -4.44 105.19 107.34 3i4n n GLY 604 Ca 0.00 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.08 3i4n n GLY 604 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3i4n s MET 605 N -1.33 0.27 -0.13 1.61 1.75 -1.26 -3.90 119.30 116.31 3i4n s MET 605 Ca 0.00 0.69 0.01 0.00 -1.25 0.00 0.00 55.69 55.14 3i4n s MET 605 Cb 0.00 -0.23 0.02 0.00 2.84 0.00 0.00 34.83 37.45 3i4n s MET 605 CO 0.00 -0.44 -0.16 -1.17 -0.65 0.00 0.00 175.02 172.60 3i4n s LEU 606 N 2.50 1.76 -0.13 4.11 2.96 -1.06 -0.93 118.68 127.89 3i4n s LEU 606 Ca 0.05 -0.48 -0.02 0.00 -0.22 0.00 0.00 54.13 53.47 3i4n s LEU 606 Cb -0.14 -1.18 0.04 0.00 0.50 0.00 0.00 46.19 45.42 3i4n s LEU 606 CO -0.12 -0.01 -0.00 -0.63 -1.32 0.00 0.00 176.35 174.26 3i4n s ILE 607 N 1.19 0.60 0.00 6.68 1.01 -0.71 -0.33 121.20 129.65 3i4n s ILE 607 Ca -0.01 -0.24 0.08 0.00 0.00 0.00 0.00 60.65 60.47 3i4n s ILE 607 Cb -0.14 -0.85 -0.02 0.00 0.01 0.00 0.00 42.46 41.45 3i4n s ILE 607 CO -0.06 0.11 -0.25 -0.63 0.00 0.00 0.00 174.94 174.11 3i4n s ILE 608 N 1.86 2.22 0.00 2.92 1.01 -0.42 -0.71 121.20 128.08 3i4n s ILE 608 Ca 0.03 -1.18 0.00 0.00 0.00 0.00 0.00 60.65 59.49 3i4n s ILE 608 Cb -0.14 -1.82 0.00 0.00 0.01 0.00 0.00 42.46 40.51 3i4n s ILE 608 CO -0.07 0.49 0.00 -0.67 0.00 0.00 0.00 174.94 174.69 3i4n n ASP 609 N 2.14 -4.71 -0.11 3.58 2.03 -1.23 -0.09 116.55 118.15 3i4n n ASP 609 Ca -0.16 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.15 3i4n n ASP 609 Cb 0.51 -3.00 0.00 0.00 -0.72 0.00 0.00 41.12 37.91 3i4n n ASP 609 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3i4n n GLY 610 N 0.64 1.13 2.97 0.27 0.00 -0.82 -2.92 105.19 106.46 3i4n n GLY 610 Ca 0.00 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 3i4n n GLY 610 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i4n s GLN 611 N -2.24 1.26 -0.65 1.61 -1.52 0.87 -4.58 119.66 114.41 3i4n s GLN 611 Ca 0.00 -0.28 -0.26 0.00 -1.95 0.00 0.00 55.36 52.87 3i4n s GLN 611 Cb 0.00 -1.11 -0.02 0.00 -0.22 0.00 0.00 33.01 31.65 3i4n s GLN 611 CO 0.00 0.00 1.85 0.42 -0.25 0.00 0.00 175.29 177.32 3i4n s ILE 612 N 0.68 3.38 0.03 1.08 1.01 -1.26 -1.30 121.20 124.82 3i4n s ILE 612 Ca -0.12 0.14 0.15 0.00 0.00 0.00 0.00 60.65 60.82 3i4n s ILE 612 Cb -0.14 -3.98 0.05 0.00 0.01 0.00 0.00 42.46 38.40 3i4n s ILE 612 CO 0.02 -0.94 1.54 0.40 0.00 0.00 0.00 174.94 175.96 3i4n h ILE 613 N 6.91 1.03 0.00 2.92 2.04 -1.05 -3.44 117.51 125.91 3i4n h ILE 613 Ca -0.22 -2.13 0.00 0.00 1.00 0.00 0.00 64.86 63.52 3i4n h ILE 613 Cb 1.14 2.28 0.00 0.00 -0.74 0.00 0.00 36.82 39.50 3i4n h ILE 613 CO 1.22 0.52 0.00 2.22 0.00 0.00 0.00 178.15 182.11 3i4n n PHE 614 N -3.39 0.00 0.00 1.37 1.16 -1.17 -4.98 117.46 110.46 3i4n n PHE 614 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.59 3i4n n PHE 614 Cb 0.67 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.54 3i4n n PHE 614 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3i4n n GLY 615 N -0.21 1.54 3.94 4.97 0.00 -1.26 -2.56 105.19 111.61 3i4n n GLY 615 Ca 0.00 -2.02 -0.26 0.00 0.00 0.00 0.00 46.02 43.74 3i4n n GLY 615 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i4n s VAL 616 N -2.04 5.22 -0.07 1.61 1.01 -1.07 -4.75 120.40 120.30 3i4n s VAL 616 Ca 0.00 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.50 3i4n s VAL 616 Cb 0.00 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 3i4n s VAL 616 CO 0.00 -0.22 -0.09 -0.69 0.00 0.00 0.00 175.10 174.09 3i4n s VAL 617 N -1.92 3.49 0.01 2.92 1.01 -1.26 -4.86 120.40 119.80 3i4n s VAL 617 Ca 0.38 -0.55 -0.18 0.00 0.00 0.00 0.00 61.98 61.62 3i4n s VAL 617 Cb -0.11 -2.42 0.06 0.00 0.00 0.00 0.00 36.38 33.91 3i4n s VAL 617 CO 0.30 0.58 0.81 -1.84 0.00 0.00 0.00 175.10 174.96 3i4n n GLU 618 N 2.43 0.17 -0.34 2.72 -0.00 -1.26 -3.16 120.64 121.19 3i4n n GLU 618 Ca -0.18 -0.58 0.26 0.00 -0.00 0.00 0.00 57.16 56.67 3i4n n GLU 618 Cb 0.53 0.92 0.41 0.00 -0.00 0.00 0.00 31.44 33.29 3i4n n GLU 618 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 3i4n n LYS 619 N -0.58 -0.00 0.08 3.44 4.81 -0.64 0.19 118.16 125.45 3i4n n LYS 619 Ca 0.02 0.58 -0.09 0.00 -0.87 0.00 0.00 58.31 57.96 3i4n n LYS 619 Cb 0.38 -1.30 0.02 0.00 0.02 0.00 0.00 35.03 34.15 3i4n n LYS 619 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 3i4n h LYS 620 N 0.00 0.25 0.00 1.64 1.57 -1.94 -2.09 116.57 116.00 3i4n h LYS 620 Ca 0.48 -0.24 -0.42 0.00 -1.87 0.00 0.00 60.65 58.60 3i4n h LYS 620 Cb 1.86 0.06 -0.06 0.00 0.08 0.00 0.00 32.23 34.17 3i4n h LYS 620 CO -0.06 0.93 -2.29 2.41 -0.57 0.00 0.00 179.45 179.87 3i4n n THR 621 N -3.73 1.53 0.83 -0.16 -1.04 0.50 -4.57 114.28 107.64 3i4n n THR 621 Ca -0.04 -0.33 0.12 0.00 -2.04 0.00 0.00 64.05 61.76 3i4n n THR 621 Cb 0.76 -1.89 0.13 0.00 -1.82 0.00 0.00 70.33 67.51 3i4n n THR 621 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 3i4n n VAL 622 N -4.24 0.12 -0.82 12.58 3.14 -0.68 -0.40 118.33 128.02 3i4n n VAL 622 Ca -0.50 -0.56 0.00 0.00 -2.96 0.00 0.00 64.34 60.32 3i4n n VAL 622 Cb 0.85 1.38 0.00 0.00 -1.06 0.00 0.00 33.84 35.01 3i4n n VAL 622 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3i4n n GLY 623 N 1.38 -1.23 1.44 7.55 0.00 -0.78 -2.13 105.19 111.42 3i4n n GLY 623 Ca 0.15 -1.64 -0.08 0.00 0.00 0.00 0.00 46.02 44.45 3i4n n GLY 623 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i4n n SER 624 N -2.62 3.53 -4.59 1.61 3.41 -1.25 -4.66 113.62 109.05 3i4n n SER 624 Ca 0.00 -2.56 -0.29 0.00 -0.26 0.00 0.00 58.87 55.77 3i4n n SER 624 Cb 0.00 -0.66 0.20 0.00 -0.26 0.00 0.00 64.21 63.50 3i4n n SER 624 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3i4n s SER 625 N 0.30 2.00 0.00 4.04 1.04 -1.26 -4.50 113.70 115.32 3i4n s SER 625 Ca 0.19 1.51 0.00 0.00 0.48 0.00 0.00 55.95 58.13 3i4n s SER 625 Cb 0.16 -2.20 0.00 0.00 0.10 0.00 0.00 66.02 64.07 3i4n s SER 625 CO 0.03 -3.56 0.40 -3.20 0.98 0.00 0.00 173.24 167.88 3i4n n ASN 626 N -4.49 0.00 0.00 7.02 2.85 -1.26 -3.41 115.26 115.96 3i4n n ASN 626 Ca 0.05 0.53 0.05 0.00 -0.11 0.00 0.00 54.58 55.09 3i4n n ASN 626 Cb 0.55 -0.27 0.28 0.00 1.24 0.00 0.00 39.78 41.59 3i4n n ASN 626 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3i4n n GLY 627 N 0.68 -0.55 3.40 8.20 0.00 -1.26 -4.63 105.19 111.03 3i4n n GLY 627 Ca 0.00 -0.06 -0.44 0.00 0.00 0.00 0.00 46.02 45.52 3i4n n GLY 627 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4n n GLY 628 N 0.07 -1.88 0.42 -0.02 0.00 -1.22 -4.63 105.19 97.92 3i4n n GLY 628 Ca 0.07 0.12 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 3i4n n GLY 628 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3i4n h LEU 629 N 0.78 -1.86 -0.54 0.99 7.12 -1.02 0.11 115.31 120.89 3i4n h LEU 629 Ca -0.36 0.29 0.11 0.00 0.13 0.00 0.00 57.88 58.05 3i4n h LEU 629 Cb 1.42 0.84 -0.11 0.00 -0.53 0.00 0.00 40.66 42.28 3i4n h LEU 629 CO 0.52 -0.29 -0.23 -0.29 -0.13 0.00 0.00 178.44 178.02 3i4n h ILE 630 N -0.12 0.31 -0.61 4.05 2.10 -1.83 0.13 117.51 121.54 3i4n h ILE 630 Ca 0.18 0.00 0.11 0.00 1.08 0.00 0.00 64.86 66.23 3i4n h ILE 630 Cb 0.51 0.31 -0.08 0.00 -1.09 0.00 0.00 36.82 36.47 3i4n h ILE 630 CO -0.84 0.00 0.17 -0.74 -1.08 0.00 0.00 178.15 175.66 3i4n h HIS 631 N -0.10 0.28 0.30 2.19 2.76 -1.08 -2.42 115.15 117.08 3i4n h HIS 631 Ca 0.25 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.44 3i4n h HIS 631 Cb 0.49 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.42 3i4n h HIS 631 CO -0.53 0.02 -0.15 0.28 -1.30 0.00 0.00 177.93 176.25 3i4n h VAL 632 N 0.32 0.71 -0.85 5.26 2.07 -0.01 -2.85 116.25 120.90 3i4n h VAL 632 Ca 0.32 -0.57 0.15 0.00 0.82 0.00 0.00 66.70 67.42 3i4n h VAL 632 Cb 0.45 1.00 -0.15 0.00 -1.52 0.00 0.00 31.29 31.06 3i4n h VAL 632 CO -0.37 0.11 -0.30 0.58 0.02 0.00 0.00 177.57 177.61 3i4n h VAL 633 N -0.73 0.10 0.47 2.57 2.07 -0.52 0.64 116.25 120.84 3i4n h VAL 633 Ca -0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 3i4n h VAL 633 Cb 0.49 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 3i4n h VAL 633 CO 0.07 0.00 -0.37 0.74 0.02 0.00 0.00 177.57 178.03 3i4n h THR 634 N -0.04 0.00 0.00 2.57 2.02 -1.47 0.11 112.91 116.10 3i4n h THR 634 Ca 0.35 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.53 3i4n h THR 634 Cb 0.61 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.02 3i4n h THR 634 CO -0.88 0.00 0.00 0.54 0.37 0.00 0.00 175.52 175.55 3i4n n ARG 635 N -4.66 0.00 -0.01 6.66 5.12 -0.70 -2.23 116.66 120.84 3i4n n ARG 635 Ca -0.10 0.68 0.22 0.00 -1.93 0.00 0.00 57.85 56.72 3i4n n ARG 635 Cb 0.35 -1.40 0.54 0.00 -1.16 0.00 0.00 32.46 30.79 3i4n n ARG 635 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 3i4n h GLU 636 N 0.00 0.00 0.00 5.56 4.57 0.24 -3.39 114.58 121.56 3i4n h GLU 636 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3i4n h GLU 636 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 3i4n h GLU 636 CO 0.00 0.00 0.00 1.63 -1.18 0.00 0.00 179.01 179.46 3i4n n LYS 637 N -3.31 0.00 -4.20 1.92 4.76 0.38 -5.04 118.16 112.67 3i4n n LYS 637 Ca 0.13 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.44 3i4n n LYS 637 Cb 1.06 0.00 -0.09 0.00 -1.84 0.00 0.00 35.03 34.17 3i4n n LYS 637 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3i4n s GLY 638 N 0.00 1.58 0.44 0.72 0.00 -1.04 -4.98 107.32 104.05 3i4n s GLY 638 Ca 0.00 -1.71 0.21 0.00 0.00 0.00 0.00 44.72 43.22 3i4n s GLY 638 CO 0.00 -1.33 1.92 -0.56 0.00 0.00 0.00 173.10 173.13 3i4n h PRO 639 N 2.44 0.00 0.00 2.90 0.13 -1.85 -3.23 132.00 132.39 3i4n h PRO 639 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3i4n h PRO 639 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3i4n h PRO 639 CO 0.47 0.24 0.00 1.04 -0.23 0.00 0.00 178.00 179.52 3i4n n GLN 640 N -3.74 0.00 0.00 0.86 1.13 -1.26 -2.70 117.38 111.67 3i4n n GLN 640 Ca -0.01 0.31 0.00 0.00 -1.94 0.00 0.00 57.00 55.35 3i4n n GLN 640 Cb 0.35 -1.20 0.00 0.00 0.11 0.00 0.00 30.24 29.50 3i4n n GLN 640 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3i4n n VAL 641 N -1.42 0.00 -0.31 5.09 0.31 -1.22 0.37 118.33 121.15 3i4n n VAL 641 Ca 0.00 0.56 0.11 0.00 -0.01 0.00 0.00 64.34 64.99 3i4n n VAL 641 Cb 0.00 -0.78 0.24 0.00 -0.91 0.00 0.00 33.84 32.39 3i4n n VAL 641 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i4n h ALA 643 N 1.86 1.77 0.00 0.00 0.00 0.13 0.48 119.26 123.50 3i4n h ALA 643 Ca 0.52 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.44 3i4n h ALA 643 Cb 1.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 3i4n h ALA 643 CO -0.81 -0.12 -0.26 -0.22 0.00 0.00 0.00 179.25 177.84 3i4n h LYS 644 N 0.71 0.00 -0.89 0.00 3.64 0.12 -3.28 116.57 116.87 3i4n h LYS 644 Ca 0.56 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.98 3i4n h LYS 644 Cb 0.94 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.70 3i4n h LYS 644 CO -0.34 0.26 0.57 1.25 -2.27 0.00 0.00 179.45 178.93 3i4n h LEU 645 N 0.00 0.94 -1.11 5.20 5.85 0.84 0.26 115.31 127.29 3i4n h LEU 645 Ca -0.00 -0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.81 3i4n h LEU 645 Cb 1.17 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.93 3i4n h LEU 645 CO 0.03 0.64 0.61 -0.26 -0.34 0.00 0.00 178.44 179.12 3i4n h PHE 646 N 1.10 1.06 -0.40 1.25 -1.00 -1.56 0.63 116.94 118.02 3i4n h PHE 646 Ca 0.37 0.03 -0.04 0.00 2.81 0.00 0.00 57.97 61.14 3i4n h PHE 646 Cb 0.05 -0.34 -0.02 0.00 3.61 0.00 0.00 35.95 39.25 3i4n h PHE 646 CO -0.02 0.50 0.10 0.78 -1.61 0.00 0.00 178.31 178.06 3i4n h GLY 647 N 0.99 0.68 0.43 -1.45 0.00 -1.13 0.23 103.07 102.83 3i4n h GLY 647 Ca 0.43 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3i4n h GLY 647 CO -0.19 0.40 -0.21 3.43 0.00 0.00 0.00 176.54 179.97 3i4n h ASN 648 N 0.50 -0.49 -0.82 0.19 2.35 -0.64 -0.44 115.58 116.24 3i4n h ASN 648 Ca 0.13 0.02 0.19 0.00 -0.55 0.00 0.00 56.30 56.08 3i4n h ASN 648 Cb 0.30 0.13 -0.12 0.00 0.05 0.00 0.00 38.32 38.68 3i4n h ASN 648 CO 0.00 -0.13 0.26 0.40 -1.65 0.00 0.00 177.43 176.31 3i4n h ILE 649 N -1.02 0.47 0.17 2.81 2.04 -0.96 -1.24 117.51 119.77 3i4n h ILE 649 Ca -0.06 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 3i4n h ILE 649 Cb 0.44 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 3i4n h ILE 649 CO 0.10 0.06 -0.11 1.56 0.00 0.00 0.00 178.15 179.76 3i4n h GLN 650 N 0.31 -0.25 -0.64 2.37 4.20 -0.53 -2.10 115.11 118.47 3i4n h GLN 650 Ca 0.49 0.02 0.12 0.00 0.06 0.00 0.00 58.65 59.34 3i4n h GLN 650 Cb 0.88 0.06 -0.12 0.00 0.30 0.00 0.00 27.48 28.60 3i4n h GLN 650 CO -0.54 -0.16 -0.25 0.87 -0.67 0.00 0.00 178.83 178.08 3i4n h LYS 651 N -0.26 -0.07 0.00 1.46 1.57 -0.61 0.19 116.57 118.85 3i4n h LYS 651 Ca -0.02 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3i4n h LYS 651 Cb 0.21 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3i4n h LYS 651 CO 0.02 -0.05 0.00 0.28 -0.57 0.00 0.00 179.45 179.13 3i4n n VAL 652 N -5.45 0.00 -0.33 0.50 0.31 -0.51 -0.82 118.33 112.03 3i4n n VAL 652 Ca 0.07 1.28 0.14 0.00 -0.01 0.00 0.00 64.34 65.82 3i4n n VAL 652 Cb 0.36 -2.21 0.33 0.00 -0.91 0.00 0.00 33.84 31.41 3i4n n VAL 652 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3i4n h VAL 653 N 0.00 0.60 -0.34 2.52 2.07 -1.37 0.96 116.25 120.70 3i4n h VAL 653 Ca 0.00 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.33 3i4n h VAL 653 Cb 0.00 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 29.68 3i4n h VAL 653 CO 0.00 0.11 0.16 0.78 0.02 0.00 0.00 177.57 178.65 3i4n h ASN 654 N 0.61 0.24 -0.23 0.57 2.35 -0.57 0.11 115.58 118.65 3i4n h ASN 654 Ca 0.58 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 56.33 3i4n h ASN 654 Cb 1.02 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 39.35 3i4n h ASN 654 CO -0.44 0.18 0.07 0.15 -1.65 0.00 0.00 177.43 175.73 3i4n h PHE 655 N 0.34 0.38 -0.60 1.19 3.57 0.11 -0.57 116.94 121.36 3i4n h PHE 655 Ca 0.14 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.62 3i4n h PHE 655 Cb 0.05 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 3i4n h PHE 655 CO -0.10 0.45 0.38 2.35 -2.23 0.00 0.00 178.31 179.16 3i4n h TRP 656 N 0.20 0.72 0.00 0.41 7.01 -0.68 0.02 115.95 123.64 3i4n h TRP 656 Ca 0.07 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.09 3i4n h TRP 656 Cb 0.25 -0.24 0.00 0.00 -2.10 0.00 0.00 29.16 27.07 3i4n h TRP 656 CO 0.01 0.43 0.00 1.25 -2.79 0.00 0.00 178.44 177.34 3i4n h LEU 657 N 0.77 0.00 -0.40 0.65 5.85 -0.62 -1.22 115.31 120.33 3i4n h LEU 657 Ca 0.23 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 3i4n h LEU 657 Cb -0.03 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 3i4n h LEU 657 CO -0.08 0.00 0.24 0.25 -0.34 0.00 0.00 178.44 178.51 3i4n h LEU 658 N 0.00 0.49 0.16 2.25 5.85 0.68 -2.49 115.31 122.25 3i4n h LEU 658 Ca 0.00 -0.06 -0.33 0.00 0.84 0.00 0.00 57.88 58.33 3i4n h LEU 658 Cb 0.42 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.33 3i4n h LEU 658 CO 0.00 0.41 -1.65 0.45 -0.34 0.00 0.00 178.44 177.31 3i4n h HIS 659 N 0.53 0.61 0.00 1.25 3.86 -1.43 -3.30 115.15 116.67 3i4n h HIS 659 Ca 0.14 -0.44 0.00 0.00 -1.16 0.00 0.00 60.37 58.91 3i4n h HIS 659 Cb 0.01 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3i4n h HIS 659 CO -0.03 1.54 0.00 -1.71 0.86 0.00 0.00 177.93 178.58 3i4n n ASN 660 N -3.53 0.00 -1.12 2.45 5.15 -0.49 -4.97 115.26 112.75 3i4n n ASN 660 Ca -0.21 0.50 0.12 0.00 -0.60 0.00 0.00 54.58 54.39 3i4n n ASN 660 Cb 1.06 -0.50 -0.05 0.00 -0.53 0.00 0.00 39.78 39.77 3i4n n ASN 660 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3i4n n GLY 661 N -0.28 -1.76 3.59 8.20 0.00 -0.94 -5.05 105.19 108.96 3i4n n GLY 661 Ca 0.03 -0.68 -0.05 0.00 0.00 0.00 0.00 46.02 45.32 3i4n n GLY 661 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3i4n s PHE 662 N -3.42 -0.17 0.00 1.61 5.36 -1.26 -5.00 117.98 115.10 3i4n s PHE 662 Ca 0.00 0.18 0.00 0.00 -0.96 0.00 0.00 56.93 56.15 3i4n s PHE 662 Cb 0.00 0.50 0.00 0.00 -0.34 0.00 0.00 43.02 43.18 3i4n s PHE 662 CO 0.00 -0.22 0.00 0.45 -1.46 0.00 0.00 175.22 173.99 3i4n n SER 663 N 0.14 0.00 -3.74 6.13 2.88 -1.26 -5.19 113.62 112.58 3i4n n SER 663 Ca -0.02 -0.82 -0.10 0.00 -1.33 0.00 0.00 58.87 56.60 3i4n n SER 663 Cb 0.59 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 64.00 3i4n n SER 663 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3i4n s THR 664 N -2.46 0.05 0.00 2.46 2.01 -1.26 -4.72 115.64 111.72 3i4n s THR 664 Ca 0.00 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.17 3i4n s THR 664 Cb 0.00 -1.47 0.00 0.00 0.01 0.00 0.00 72.50 71.04 3i4n s THR 664 CO 0.00 -0.24 0.00 0.61 -0.69 0.00 0.00 174.62 174.30 3i4n n GLY 665 N -0.27 1.79 0.00 4.40 0.00 -1.26 -5.02 105.19 104.84 3i4n n GLY 665 Ca -0.12 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.32 3i4n n GLY 665 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3i4n n ILE 666 N 0.00 0.00 0.22 -0.61 -6.64 -1.26 -1.35 119.36 109.71 3i4n n ILE 666 Ca 0.00 0.00 0.18 0.00 -1.77 0.00 0.00 62.75 61.16 3i4n n ILE 666 Cb 0.00 0.00 0.84 0.00 -1.44 0.00 0.00 39.64 39.04 3i4n n ILE 666 CO 0.00 0.00 0.00 1.23 -1.77 0.00 0.00 176.55 176.01 3i4n h GLY 667 N 0.00 0.00 1.83 3.28 0.00 -1.96 0.30 103.07 106.51 3i4n h GLY 667 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3i4n h GLY 667 CO 0.00 0.00 -0.16 -0.55 0.00 0.00 0.00 176.54 175.83 3i4n h ASP 668 N 0.00 0.00 -0.08 0.19 3.32 -1.62 -3.26 116.42 114.97 3i4n h ASP 668 Ca 0.09 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3i4n h ASP 668 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 3i4n h ASP 668 CO -0.00 0.01 0.00 0.35 -1.72 0.00 0.00 179.24 177.88 3i4n n THR 669 N -2.69 0.08 -3.70 0.35 -2.24 0.10 -4.83 114.28 101.35 3i4n n THR 669 Ca 0.04 -0.39 -0.36 0.00 -2.27 0.00 0.00 64.05 61.08 3i4n n THR 669 Cb 0.49 0.83 -0.09 0.00 -2.10 0.00 0.00 70.33 69.47 3i4n n THR 669 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3i4n s ILE 670 N -1.92 5.39 0.26 2.28 1.01 -1.17 -3.79 121.20 123.26 3i4n s ILE 670 Ca 0.34 0.19 0.01 0.00 0.00 0.00 0.00 60.65 61.20 3i4n s ILE 670 Cb 0.20 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 39.15 3i4n s ILE 670 CO 0.31 0.40 0.45 0.00 0.00 0.00 0.00 174.94 176.10 3i4n s ALA 671 N 0.62 3.80 -0.02 9.38 0.00 -1.26 -5.01 121.76 129.27 3i4n s ALA 671 Ca 0.08 -0.94 -0.27 0.00 0.00 0.00 0.00 51.96 50.83 3i4n s ALA 671 Cb -0.12 -1.99 -0.14 0.00 0.00 0.00 0.00 23.12 20.88 3i4n s ALA 671 CO 0.00 0.22 0.75 -3.47 0.00 0.00 0.00 175.76 173.26 3i4n n ASP 672 N -1.24 0.04 -0.12 0.00 2.03 -1.26 -4.60 116.55 111.39 3i4n n ASP 672 Ca -0.06 0.79 -0.03 0.00 0.52 0.00 0.00 54.79 56.01 3i4n n ASP 672 Cb 0.55 -0.62 -0.03 0.00 -0.72 0.00 0.00 41.12 40.30 3i4n n ASP 672 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3i4n n GLY 673 N 1.11 -2.09 0.16 0.27 0.00 -1.26 -0.82 105.19 102.56 3i4n n GLY 673 Ca 0.14 0.60 0.01 0.00 0.00 0.00 0.00 46.02 46.77 3i4n n GLY 673 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i4n h PRO 674 N 0.00 0.00 0.00 1.61 0.13 -2.00 -2.98 132.00 128.76 3i4n h PRO 674 Ca 0.05 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.16 3i4n h PRO 674 Cb 0.12 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.25 3i4n h PRO 674 CO -0.28 0.52 -0.10 1.15 -0.23 0.00 0.00 178.00 179.06 3i4n h THR 675 N 0.00 0.57 -0.01 1.56 2.02 -1.30 0.65 112.91 116.39 3i4n h THR 675 Ca -0.01 -0.44 -0.03 0.00 0.77 0.00 0.00 66.41 66.70 3i4n h THR 675 Cb 1.00 1.29 0.00 0.00 -1.74 0.00 0.00 68.15 68.70 3i4n h THR 675 CO 0.07 0.10 -0.13 0.24 0.37 0.00 0.00 175.52 176.17 3i4n h MET 676 N 0.00 0.10 -0.66 6.66 2.86 -0.98 -2.94 114.93 119.98 3i4n h MET 676 Ca -0.00 -0.10 0.02 0.00 -2.06 0.00 0.00 59.70 57.56 3i4n h MET 676 Cb 0.28 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 3i4n h MET 676 CO 0.01 0.83 0.42 -0.09 1.06 0.00 0.00 176.91 179.14 3i4n h ARG 677 N -0.59 0.81 -1.05 1.72 1.12 -1.41 0.31 114.38 115.29 3i4n h ARG 677 Ca -0.01 -0.05 0.30 0.00 -1.11 0.00 0.00 59.98 59.11 3i4n h ARG 677 Cb 0.87 -0.18 -0.04 0.00 -0.01 0.00 0.00 29.97 30.60 3i4n h ARG 677 CO 0.03 0.53 0.79 1.49 -3.11 0.00 0.00 179.97 179.70 3i4n h GLU 678 N 0.83 0.00 0.15 0.20 4.81 0.26 0.37 114.58 121.20 3i4n h GLU 678 Ca 0.26 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 59.19 3i4n h GLU 678 Cb -0.03 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.36 3i4n h GLU 678 CO -0.09 0.00 -1.46 0.82 -0.73 0.00 0.00 179.01 177.56 3i4n h ILE 679 N 0.00 1.07 -0.03 2.32 2.04 -0.29 -3.02 117.51 119.59 3i4n h ILE 679 Ca 0.50 -2.47 0.01 0.00 1.00 0.00 0.00 64.86 63.90 3i4n h ILE 679 Cb 2.07 2.80 -0.00 0.00 -0.74 0.00 0.00 36.82 40.95 3i4n h ILE 679 CO -0.01 0.76 0.27 0.74 0.00 0.00 0.00 178.15 179.91 3i4n h THR 680 N -0.16 0.05 0.00 -0.27 2.02 0.17 0.67 112.91 115.39 3i4n h THR 680 Ca -0.30 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.88 3i4n h THR 680 Cb 1.88 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 69.03 3i4n h THR 680 CO 0.12 0.00 -1.43 -1.84 0.37 0.00 0.00 175.52 172.73 3i4n n GLU 681 N -3.02 0.52 0.00 6.66 0.28 -0.83 -2.56 120.64 121.68 3i4n n GLU 681 Ca -0.01 -0.09 0.14 0.00 -0.16 0.00 0.00 57.16 57.03 3i4n n GLU 681 Cb 0.33 -1.46 0.65 0.00 1.43 0.00 0.00 31.44 32.39 3i4n n GLU 681 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 3i4n n THR 682 N -1.84 0.00 0.00 3.84 -1.04 0.22 -1.42 114.28 114.04 3i4n n THR 682 Ca 0.00 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 3i4n n THR 682 Cb 0.42 -0.41 0.00 0.00 -1.82 0.00 0.00 70.33 68.52 3i4n n THR 682 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3i4n n ILE 683 N -1.36 0.00 -0.28 12.58 5.41 -0.17 -4.25 119.36 131.29 3i4n n ILE 683 Ca 0.10 0.27 0.18 0.00 1.00 0.00 0.00 62.75 64.30 3i4n n ILE 683 Cb 0.29 -1.15 0.34 0.00 -0.71 0.00 0.00 39.64 38.41 3i4n n ILE 683 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4n n ALA 684 N -1.85 0.59 -0.20 -1.39 0.00 -1.06 0.19 120.51 116.79 3i4n n ALA 684 Ca 0.00 0.89 0.09 0.00 0.00 0.00 0.00 53.44 54.42 3i4n n ALA 684 Cb 0.00 -0.74 0.38 0.00 0.00 0.00 0.00 19.45 19.10 3i4n n ALA 684 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3i4n h GLU 685 N 0.00 0.67 0.03 0.00 -0.00 -1.47 -0.35 114.58 113.47 3i4n h GLU 685 Ca 0.59 -0.04 -0.22 0.00 -0.00 0.00 0.00 59.36 59.68 3i4n h GLU 685 Cb 1.36 -0.15 -0.01 0.00 -0.00 0.00 0.00 28.75 29.96 3i4n h GLU 685 CO -0.74 0.44 -0.99 0.00 -0.00 0.00 0.00 179.01 177.72 3i4n h ALA 686 N 1.61 0.37 -0.77 1.06 0.00 0.19 -1.92 119.26 119.79 3i4n h ALA 686 Ca 0.35 -0.78 0.12 0.00 0.00 0.00 0.00 54.91 54.61 3i4n h ALA 686 Cb 0.46 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.11 3i4n h ALA 686 CO -0.13 0.94 0.37 0.87 0.00 0.00 0.00 179.25 181.30 3i4n h LYS 687 N 0.11 0.56 0.00 0.00 1.57 -0.34 0.47 116.57 118.95 3i4n h LYS 687 Ca -0.07 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 3i4n h LYS 687 Cb 1.66 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.84 3i4n h LYS 687 CO 0.16 0.37 0.00 0.87 -0.57 0.00 0.00 179.45 180.28 3i4n h LYS 688 N 0.58 0.00 0.00 3.15 1.57 -1.37 0.47 116.57 120.97 3i4n h LYS 688 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 3i4n h LYS 688 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3i4n h LYS 688 CO -0.33 0.00 0.00 1.17 -0.57 0.00 0.00 179.45 179.72 3i4n n LYS 689 N -2.77 0.15 -0.09 3.15 4.81 0.14 -2.42 118.16 121.13 3i4n n LYS 689 Ca 0.05 0.21 -0.09 0.00 -0.87 0.00 0.00 58.31 57.61 3i4n n LYS 689 Cb 0.49 -1.71 -0.03 0.00 0.02 0.00 0.00 35.03 33.81 3i4n n LYS 689 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 3i4n n VAL 690 N -1.97 1.48 -0.31 3.15 0.31 0.16 -3.88 118.33 117.27 3i4n n VAL 690 Ca 0.05 0.15 0.26 0.00 -0.01 0.00 0.00 64.34 64.78 3i4n n VAL 690 Cb 0.33 -2.34 0.48 0.00 -0.91 0.00 0.00 33.84 31.40 3i4n n VAL 690 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 3i4n n LEU 691 N -4.44 0.21 0.15 7.52 7.94 0.16 -0.68 117.00 127.87 3i4n n LEU 691 Ca -0.14 1.58 -0.06 0.00 -1.11 0.00 0.00 56.01 56.28 3i4n n LEU 691 Cb 0.51 -0.72 -0.03 0.00 0.53 0.00 0.00 43.42 43.71 3i4n n LEU 691 CO 0.20 -1.72 0.36 0.44 -1.11 0.00 0.00 177.39 175.56 3i4n h ASP 692 N 0.00 -0.34 0.00 1.96 5.19 -1.70 -2.75 116.42 118.78 3i4n h ASP 692 Ca 0.74 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 57.16 3i4n h ASP 692 Cb 1.87 0.09 0.00 0.00 0.18 0.00 0.00 39.33 41.47 3i4n h ASP 692 CO -0.77 -0.18 0.00 0.52 -3.12 0.00 0.00 179.24 175.69 3i4n n VAL 693 N -3.45 0.00 -0.09 -1.35 0.31 -0.11 -1.00 118.33 112.63 3i4n n VAL 693 Ca -0.05 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.16 3i4n n VAL 693 Cb 0.16 -0.87 -0.05 0.00 -0.91 0.00 0.00 33.84 32.17 3i4n n VAL 693 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3i4n n THR 694 N -0.87 1.47 0.04 2.52 -1.04 0.15 -3.93 114.28 112.63 3i4n n THR 694 Ca 0.00 0.08 0.02 0.00 -2.04 0.00 0.00 64.05 62.11 3i4n n THR 694 Cb 0.00 -2.25 0.38 0.00 -1.82 0.00 0.00 70.33 66.64 3i4n n THR 694 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 3i4n h LYS 695 N -1.00 0.44 0.00 -2.82 1.57 -1.00 0.40 116.57 114.15 3i4n h LYS 695 Ca -0.15 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 3i4n h LYS 695 Cb 0.92 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.15 3i4n h LYS 695 CO -0.09 0.42 0.03 -1.91 -0.57 0.00 0.00 179.45 177.33 3i4n n GLU 696 N -4.36 0.09 0.00 3.15 2.13 -0.17 0.50 120.64 121.97 3i4n n GLU 696 Ca 0.01 0.58 0.00 0.00 0.66 0.00 0.00 57.16 58.41 3i4n n GLU 696 Cb 0.18 -1.82 0.00 0.00 0.27 0.00 0.00 31.44 30.07 3i4n n GLU 696 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3i4n n ALA 697 N -1.66 2.08 1.26 4.31 0.00 0.40 -2.88 120.51 124.02 3i4n n ALA 697 Ca -0.01 -0.08 0.09 0.00 0.00 0.00 0.00 53.44 53.44 3i4n n ALA 697 Cb 0.05 0.00 0.35 0.00 0.00 0.00 0.00 19.45 19.85 3i4n n ALA 697 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3i4n n GLN 698 N -0.83 1.66 -0.00 0.00 6.02 0.18 -3.31 117.38 121.10 3i4n n GLN 698 Ca 0.00 -1.00 0.00 0.00 -0.01 0.00 0.00 57.00 55.99 3i4n n GLN 698 Cb 0.00 -1.36 0.00 0.00 1.02 0.00 0.00 30.24 29.90 3i4n n GLN 698 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3i4n n ALA 699 N 0.23 1.72 -3.25 -1.58 0.00 -0.47 -4.99 120.51 112.16 3i4n n ALA 699 Ca 0.15 -0.88 -0.15 0.00 0.00 0.00 0.00 53.44 52.55 3i4n n ALA 699 Cb 0.29 -0.01 0.08 0.00 0.00 0.00 0.00 19.45 19.81 3i4n n ALA 699 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3i4n n ASN 700 N -0.37 -2.31 -2.88 0.00 5.15 -1.21 -4.98 115.26 108.67 3i4n n ASN 700 Ca 0.00 -0.53 -0.22 0.00 -0.60 0.00 0.00 54.58 53.23 3i4n n ASN 700 Cb 0.33 -4.50 -0.02 0.00 -0.53 0.00 0.00 39.78 35.06 3i4n n ASN 700 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3i4n n LEU 701 N -3.76 3.09 -3.68 1.20 4.77 -1.14 -5.05 117.00 112.43 3i4n n LEU 701 Ca -0.23 -5.13 -0.11 0.00 -0.03 0.00 0.00 56.01 50.51 3i4n n LEU 701 Cb 0.64 -0.04 -0.09 0.00 -2.33 0.00 0.00 43.42 41.59 3i4n n LEU 701 CO 0.53 2.20 0.18 -0.76 -1.33 0.00 0.00 177.39 178.22 3i4n s LEU 702 N -3.15 -0.22 -0.34 2.23 1.43 -1.26 -4.71 118.68 112.66 3i4n s LEU 702 Ca 0.43 1.09 -0.28 0.00 -1.03 0.00 0.00 54.13 54.34 3i4n s LEU 702 Cb 0.35 1.76 -0.01 0.00 0.03 0.00 0.00 46.19 48.32 3i4n s LEU 702 CO -0.11 -0.20 1.75 -0.89 0.23 0.00 0.00 176.35 177.13 3i4n s THR 703 N 0.94 3.53 -0.78 5.49 2.01 -1.26 -4.90 115.64 120.67 3i4n s THR 703 Ca -0.05 0.54 -0.26 0.00 0.31 0.00 0.00 61.69 62.23 3i4n s THR 703 Cb -0.06 -3.72 -0.10 0.00 0.01 0.00 0.00 72.50 68.63 3i4n s THR 703 CO -0.08 -0.46 2.27 0.00 -0.69 0.00 0.00 174.62 175.65 3i4n s ALA 704 N 6.68 1.10 -0.32 7.40 0.00 -1.26 -4.84 121.76 130.53 3i4n s ALA 704 Ca 0.77 -0.88 -0.36 0.00 0.00 0.00 0.00 51.96 51.49 3i4n s ALA 704 Cb -0.21 -4.53 -0.12 0.00 0.00 0.00 0.00 23.12 18.25 3i4n s ALA 704 CO 0.33 -5.39 2.11 1.63 0.00 0.00 0.00 175.76 174.44 3i4n n LYS 705 N 8.87 1.15 0.00 0.00 5.02 -1.26 -4.66 118.16 127.27 3i4n n LYS 705 Ca 0.43 0.34 0.00 0.00 -2.02 0.00 0.00 58.31 57.06 3i4n n LYS 705 Cb 0.46 -2.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.06 3i4n n LYS 705 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 3i4n n HIS 706 N 9.02 0.00 -2.97 2.13 -0.00 -1.26 -2.59 115.22 119.55 3i4n n HIS 706 Ca 0.38 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.99 3i4n n HIS 706 Cb 0.22 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.26 3i4n n HIS 706 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3i4n n GLY 707 N 0.00 -0.03 3.58 1.57 0.00 -1.26 -5.04 105.19 104.00 3i4n n GLY 707 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 46.02 45.89 3i4n n GLY 707 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3i4n s MET 708 N -5.13 0.45 1.06 1.61 1.00 -1.07 -5.03 119.30 112.20 3i4n s MET 708 Ca 0.11 0.93 -0.14 0.00 0.00 0.00 0.00 55.69 56.58 3i4n s MET 708 Cb -0.05 0.34 0.14 0.00 0.00 0.00 0.00 34.83 35.26 3i4n s MET 708 CO 0.45 -0.12 0.52 2.41 0.00 0.00 0.00 175.02 178.28 3i4n n THR 709 N 4.49 0.00 0.07 2.05 -1.04 -1.26 -4.38 114.28 114.21 3i4n n THR 709 Ca -0.15 -0.26 -0.01 0.00 -2.04 0.00 0.00 64.05 61.59 3i4n n THR 709 Cb 0.55 -0.76 0.28 0.00 -1.82 0.00 0.00 70.33 68.58 3i4n n THR 709 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3i4n h LEU 710 N -2.06 0.32 0.79 -4.42 4.07 -1.96 0.59 115.31 112.64 3i4n h LEU 710 Ca -0.51 -0.10 -0.04 0.00 0.08 0.00 0.00 57.88 57.31 3i4n h LEU 710 Cb 1.32 -0.09 0.01 0.00 1.08 0.00 0.00 40.66 42.98 3i4n h LEU 710 CO 0.40 0.57 -0.38 -0.09 -1.08 0.00 0.00 178.44 177.87 3i4n h ARG 711 N 0.29 -1.02 0.40 1.13 9.65 -1.99 -1.50 114.38 121.34 3i4n h ARG 711 Ca 0.05 0.07 -0.01 0.00 -1.10 0.00 0.00 59.98 58.99 3i4n h ARG 711 Cb 0.60 0.23 -0.02 0.00 -1.39 0.00 0.00 29.97 29.39 3i4n h ARG 711 CO 0.04 -0.68 -0.45 0.93 2.80 0.00 0.00 179.97 182.62 3i4n h GLU 712 N -1.19 -0.82 -1.01 0.20 5.08 -1.80 -0.20 114.58 114.84 3i4n h GLU 712 Ca -0.11 0.06 0.29 0.00 -1.00 0.00 0.00 59.36 58.60 3i4n h GLU 712 Cb 0.81 0.19 -0.04 0.00 0.50 0.00 0.00 28.75 30.21 3i4n h GLU 712 CO 0.18 -0.55 0.89 0.77 -1.00 0.00 0.00 179.01 179.30 3i4n h SER 713 N -0.85 0.00 0.00 1.42 0.02 0.11 -1.99 113.55 112.26 3i4n h SER 713 Ca -0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 3i4n h SER 713 Cb 0.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.29 3i4n h SER 713 CO -0.08 0.00 0.00 0.33 -1.14 0.00 0.00 176.83 175.94 3i4n n PHE 714 N -3.78 0.00 -0.26 3.45 7.35 -0.20 -3.89 117.46 120.13 3i4n n PHE 714 Ca 0.22 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.96 3i4n n PHE 714 Cb 1.22 -0.29 0.12 0.00 0.35 0.00 0.00 39.48 40.88 3i4n n PHE 714 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 3i4n n GLU 715 N -1.37 -0.06 -0.29 -4.13 -0.58 -0.54 -0.03 120.64 113.65 3i4n n GLU 715 Ca 0.00 1.12 0.11 0.00 -0.42 0.00 0.00 57.16 57.97 3i4n n GLU 715 Cb 0.00 -1.70 0.25 0.00 -0.57 0.00 0.00 31.44 29.42 3i4n n GLU 715 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 3i4n h ASP 716 N 0.00 -0.04 0.11 1.62 1.82 -1.53 0.22 116.42 118.62 3i4n h ASP 716 Ca 0.36 0.19 -0.14 0.00 -0.39 0.00 0.00 57.03 57.05 3i4n h ASP 716 Cb 0.60 0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.86 3i4n h ASP 716 CO -0.74 -0.13 -0.50 0.78 -1.61 0.00 0.00 179.24 177.04 3i4n h ASN 717 N 0.21 0.48 0.00 2.28 2.35 -0.56 -2.79 115.58 117.56 3i4n h ASN 717 Ca 0.51 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 3i4n h ASN 717 Cb 0.98 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.22 3i4n h ASN 717 CO -0.63 0.90 0.00 0.52 -1.65 0.00 0.00 177.43 176.57 3i4n n VAL 718 N -3.97 0.00 0.00 2.81 0.31 0.66 -2.40 118.33 115.74 3i4n n VAL 718 Ca -0.02 1.43 0.00 0.00 -0.01 0.00 0.00 64.34 65.74 3i4n n VAL 718 Cb 0.57 -2.31 0.00 0.00 -0.91 0.00 0.00 33.84 31.19 3i4n n VAL 718 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3i4n n VAL 719 N -2.01 0.00 -0.22 2.52 0.31 -0.60 -1.27 118.33 117.06 3i4n n VAL 719 Ca 0.00 0.99 -0.05 0.00 -0.01 0.00 0.00 64.34 65.27 3i4n n VAL 719 Cb 0.00 -1.40 -0.05 0.00 -0.91 0.00 0.00 33.84 31.48 3i4n n VAL 719 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3i4n n ARG 720 N -1.77 -0.22 -0.22 5.55 1.74 -1.05 0.12 116.66 120.80 3i4n n ARG 720 Ca 0.00 0.80 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 3i4n n ARG 720 Cb 0.00 -1.18 0.08 0.00 -1.02 0.00 0.00 32.46 30.34 3i4n n ARG 720 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 3i4n h PHE 721 N 0.00 -0.29 0.00 -1.55 0.05 -0.82 0.51 116.94 114.84 3i4n h PHE 721 Ca 0.09 0.06 0.00 0.00 3.82 0.00 0.00 57.97 61.94 3i4n h PHE 721 Cb 0.23 0.23 0.00 0.00 2.00 0.00 0.00 35.95 38.41 3i4n h PHE 721 CO -0.54 -0.27 0.00 1.28 -0.18 0.00 0.00 178.31 178.61 3i4n n LEU 722 N -5.42 0.08 -0.27 1.54 4.32 0.12 -1.12 117.00 116.24 3i4n n LEU 722 Ca 0.09 0.83 0.05 0.00 -0.02 0.00 0.00 56.01 56.96 3i4n n LEU 722 Cb 0.35 -0.39 0.14 0.00 -1.62 0.00 0.00 43.42 41.91 3i4n n LEU 722 CO 0.04 -0.39 0.78 0.78 -1.22 0.00 0.00 177.39 177.38 3i4n h ASN 723 N 0.00 -0.49 -0.71 -1.43 2.35 -1.44 0.72 115.58 114.57 3i4n h ASN 723 Ca 0.00 0.22 0.16 0.00 -0.55 0.00 0.00 56.30 56.12 3i4n h ASN 723 Cb 0.00 0.41 -0.12 0.00 0.05 0.00 0.00 38.32 38.66 3i4n h ASN 723 CO 0.00 -0.22 0.08 -0.08 -1.65 0.00 0.00 177.43 175.55 3i4n h GLU 724 N 0.06 0.16 -0.04 0.81 4.81 0.03 0.14 114.58 120.55 3i4n h GLU 724 Ca 0.41 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.60 3i4n h GLU 724 Cb 0.71 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.05 3i4n h GLU 724 CO -0.73 0.11 -0.11 0.00 -0.73 0.00 0.00 179.01 177.55 3i4n h ALA 725 N 1.63 0.06 -0.74 2.92 0.00 0.17 -3.26 119.26 120.05 3i4n h ALA 725 Ca 0.39 -0.35 0.15 0.00 0.00 0.00 0.00 54.91 55.11 3i4n h ALA 725 Cb 0.68 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.36 3i4n h ALA 725 CO -0.57 -0.05 0.24 -0.09 0.00 0.00 0.00 179.25 178.79 3i4n h ARG 726 N -0.41 0.35 0.30 0.00 2.43 0.11 -1.54 114.38 115.62 3i4n h ARG 726 Ca -0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3i4n h ARG 726 Cb 0.72 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.16 3i4n h ARG 726 CO 0.02 0.23 -0.44 -0.44 -1.51 0.00 0.00 179.97 177.83 3i4n h ASP 727 N 0.36 -1.26 -1.00 -3.80 5.19 -0.83 -0.96 116.42 114.11 3i4n h ASP 727 Ca 0.41 0.12 0.11 0.00 -0.62 0.00 0.00 57.03 57.06 3i4n h ASP 727 Cb 0.67 0.44 -0.08 0.00 0.18 0.00 0.00 39.33 40.54 3i4n h ASP 727 CO -0.45 -0.56 0.63 0.07 -3.12 0.00 0.00 179.24 175.81 3i4n h LYS 728 N -0.80 1.00 -1.02 3.56 2.10 -1.50 1.34 116.57 121.25 3i4n h LYS 728 Ca -0.02 -0.06 0.26 0.00 -2.00 0.00 0.00 60.65 58.83 3i4n h LYS 728 Cb 0.75 -0.23 -0.08 0.00 -0.90 0.00 0.00 32.23 31.78 3i4n h LYS 728 CO -0.15 0.66 0.68 0.00 -2.00 0.00 0.00 179.45 178.64 3i4n h ALA 729 N 1.52 2.38 -2.82 0.07 0.00 -0.27 0.65 119.26 120.80 3i4n h ALA 729 Ca 0.49 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3i4n h ALA 729 Cb 0.43 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3i4n h ALA 729 CO -0.25 -0.74 0.00 0.41 0.00 0.00 0.00 179.25 178.67 3i4n n GLY 730 N -1.53 -1.50 0.20 0.00 0.00 0.45 -3.03 105.19 99.78 3i4n n GLY 730 Ca 0.24 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.39 3i4n n GLY 730 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i4n n ARG 731 N -0.59 -0.04 -0.27 1.61 1.74 -0.73 0.19 116.66 118.57 3i4n n ARG 731 Ca 0.00 0.88 0.07 0.00 -0.77 0.00 0.00 57.85 58.04 3i4n n ARG 731 Cb 0.00 -1.48 0.21 0.00 -1.02 0.00 0.00 32.46 30.17 3i4n n ARG 731 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3i4n h LEU 732 N 0.00 0.16 0.00 0.55 3.38 0.27 0.75 115.31 120.43 3i4n h LEU 732 Ca 0.44 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.55 3i4n h LEU 732 Cb 1.04 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.94 3i4n h LEU 732 CO -0.53 0.01 -0.46 0.00 0.09 0.00 0.00 178.44 177.56 3i4n n ALA 733 N -2.58 3.11 -0.22 1.53 0.00 0.51 -3.83 120.51 119.03 3i4n n ALA 733 Ca 0.16 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.33 3i4n n ALA 733 Cb 0.49 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.74 3i4n n ALA 733 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3i4n n GLU 734 N -1.74 0.00 0.00 0.00 2.13 0.26 -2.66 120.64 118.63 3i4n n GLU 734 Ca 0.05 0.39 0.04 0.00 0.66 0.00 0.00 57.16 58.30 3i4n n GLU 734 Cb 0.38 -1.09 0.21 0.00 0.27 0.00 0.00 31.44 31.21 3i4n n GLU 734 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3i4n n VAL 735 N -1.67 0.00 0.03 6.31 0.31 -0.77 -1.61 118.33 120.93 3i4n n VAL 735 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 3i4n n VAL 735 Cb 0.00 -0.41 -0.08 0.00 -0.91 0.00 0.00 33.84 32.43 3i4n n VAL 735 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 3i4n h ASN 736 N 0.00 0.00 -3.45 4.52 -0.73 -1.66 -3.45 115.58 110.81 3i4n h ASN 736 Ca 0.00 0.00 -0.61 0.00 1.87 0.00 0.00 56.30 57.56 3i4n h ASN 736 Cb 0.00 0.00 -0.11 0.00 0.27 0.00 0.00 38.32 38.48 3i4n h ASN 736 CO 0.00 0.62 0.31 -0.76 -0.37 0.00 0.00 177.43 177.23 3i4n s LEU 737 N -5.85 4.10 1.08 0.34 1.43 -0.63 -4.80 118.68 114.35 3i4n s LEU 737 Ca -0.03 0.63 -0.20 0.00 -1.03 0.00 0.00 54.13 53.50 3i4n s LEU 737 Cb 0.09 -2.99 0.03 0.00 0.03 0.00 0.00 46.19 43.34 3i4n s LEU 737 CO 0.81 -0.55 -0.33 0.29 0.23 0.00 0.00 176.35 176.80 3i4n n LYS 738 N 6.05 -1.10 0.09 1.70 4.01 -1.26 -4.80 118.16 122.85 3i4n n LYS 738 Ca 0.02 -0.31 0.01 0.00 -0.51 0.00 0.00 58.31 57.53 3i4n n LYS 738 Cb 0.48 -1.54 0.35 0.00 -0.51 0.00 0.00 35.03 33.82 3i4n n LYS 738 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 3i4n h ASP 739 N -1.76 0.29 0.31 4.39 5.19 -1.98 -2.32 116.42 120.54 3i4n h ASP 739 Ca -0.49 -0.06 -0.00 0.00 -0.62 0.00 0.00 57.03 55.85 3i4n h ASP 739 Cb 1.36 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 40.79 3i4n h ASP 739 CO 0.34 0.45 -0.00 0.17 -3.12 0.00 0.00 179.24 177.07 3i4n h LEU 740 N 0.29 0.00 -9.87 1.55 8.10 -2.03 -3.41 115.31 109.94 3i4n h LEU 740 Ca 0.06 0.00 -0.53 0.00 0.11 0.00 0.00 57.88 57.51 3i4n h LEU 740 Cb 0.40 0.00 0.10 0.00 -0.44 0.00 0.00 40.66 40.72 3i4n h LEU 740 CO 0.02 0.00 0.84 0.21 -4.11 0.00 0.00 178.44 175.41 3i4n s ASN 741 N -5.36 6.34 -0.01 0.17 2.47 -0.87 -4.93 114.94 112.74 3i4n s ASN 741 Ca -0.03 3.02 -0.05 0.00 0.42 0.00 0.00 52.86 56.22 3i4n s ASN 741 Cb 0.12 -2.65 -0.03 0.00 -1.45 0.00 0.00 41.25 37.24 3i4n s ASN 741 CO 0.46 -0.91 0.52 0.78 -3.72 0.00 0.00 177.10 174.22 3i4n h ASN 742 N 3.95 -0.14 -1.81 -4.21 2.35 -1.85 -2.07 115.58 111.81 3i4n h ASN 742 Ca -0.49 0.00 0.54 0.00 -0.55 0.00 0.00 56.30 55.81 3i4n h ASN 742 Cb 1.23 0.04 -0.09 0.00 0.05 0.00 0.00 38.32 39.55 3i4n h ASN 742 CO 0.72 -0.03 1.28 0.52 -1.65 0.00 0.00 177.43 178.27 3i4n n VAL 743 N -2.85 -0.05 -0.06 2.81 0.31 -1.26 0.10 118.33 117.33 3i4n n VAL 743 Ca -0.02 1.52 -0.12 0.00 -0.01 0.00 0.00 64.34 65.70 3i4n n VAL 743 Cb 0.06 -2.52 -0.11 0.00 -0.91 0.00 0.00 33.84 30.37 3i4n n VAL 743 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 3i4n h LYS 744 N 0.00 -0.01 -0.97 5.55 3.64 -1.92 -2.90 116.57 119.95 3i4n h LYS 744 Ca 0.91 0.00 0.33 0.00 -1.27 0.00 0.00 60.65 60.61 3i4n h LYS 744 Cb 3.50 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 35.15 3i4n h LYS 744 CO -0.11 0.81 0.35 1.96 -2.27 0.00 0.00 179.45 180.19 3i4n h GLN 745 N -0.94 0.10 -0.04 1.90 4.20 0.14 0.71 115.11 121.17 3i4n h GLN 745 Ca -0.00 -0.01 -0.21 0.00 0.06 0.00 0.00 58.65 58.49 3i4n h GLN 745 Cb 0.82 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.58 3i4n h GLN 745 CO 0.00 0.07 -0.85 0.52 -0.67 0.00 0.00 178.83 177.90 3i4n h MET 746 N 0.11 0.47 0.00 1.46 2.86 -1.44 -1.89 114.93 116.48 3i4n h MET 746 Ca 0.70 -0.44 -0.00 0.00 -2.06 0.00 0.00 59.70 57.90 3i4n h MET 746 Cb 1.65 0.11 -0.00 0.00 0.06 0.00 0.00 31.60 33.42 3i4n h MET 746 CO -0.76 1.09 -0.01 0.28 1.06 0.00 0.00 176.91 178.57 3i4n h VAL 747 N 0.29 0.04 0.08 -2.22 2.07 0.37 -0.79 116.25 116.09 3i4n h VAL 747 Ca -0.06 -0.46 -0.17 0.00 0.82 0.00 0.00 66.70 66.83 3i4n h VAL 747 Cb 1.47 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 3i4n h VAL 747 CO 0.15 0.01 -0.83 0.24 0.02 0.00 0.00 177.57 177.16 3i4n h MET 748 N 0.00 0.16 -0.19 1.57 2.07 0.10 -3.28 114.93 115.38 3i4n h MET 748 Ca -0.00 -0.28 -0.05 0.00 -2.07 0.00 0.00 59.70 57.29 3i4n h MET 748 Cb 0.44 0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 30.26 3i4n h MET 748 CO 0.00 1.13 -0.13 0.00 1.07 0.00 0.00 176.91 178.99 3i4n h ALA 749 N -0.05 1.44 0.00 6.32 0.00 -1.23 -3.46 119.26 122.28 3i4n h ALA 749 Ca -0.18 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3i4n h ALA 749 Cb 1.46 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3i4n h ALA 749 CO 0.04 0.39 0.00 0.41 0.00 0.00 0.00 179.25 180.09 3i4n n GLY 750 N -0.82 1.50 0.97 0.00 0.00 -0.37 -1.61 105.19 104.85 3i4n n GLY 750 Ca -0.00 -0.18 0.12 0.00 0.00 0.00 0.00 46.02 45.96 3i4n n GLY 750 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i4n n SER 751 N 0.38 3.03 0.00 1.61 3.41 -0.78 -4.87 113.62 116.39 3i4n n SER 751 Ca 0.00 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 3i4n n SER 751 Cb 0.07 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 3i4n n SER 751 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3i4n n LYS 752 N 1.35 0.00 0.00 4.33 4.76 -1.24 -4.62 118.16 122.74 3i4n n LYS 752 Ca 0.14 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.58 3i4n n LYS 752 Cb 0.60 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.79 3i4n n LYS 752 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3i4n n GLY 753 N 0.00 -0.00 3.39 0.72 0.00 -1.26 -3.58 105.19 104.46 3i4n n GLY 753 Ca 0.00 -1.66 -0.12 0.00 0.00 0.00 0.00 46.02 44.24 3i4n n GLY 753 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i4n s SER 754 N -1.73 0.22 0.18 1.61 1.04 -1.26 -4.63 113.70 109.13 3i4n s SER 754 Ca 0.00 -1.24 -0.16 0.00 0.48 0.00 0.00 55.95 55.03 3i4n s SER 754 Cb 0.00 0.50 0.16 0.00 0.10 0.00 0.00 66.02 66.78 3i4n s SER 754 CO 0.00 -1.02 1.26 0.33 0.98 0.00 0.00 173.24 174.79 3i4n n PHE 755 N -0.36 -0.03 -0.19 5.02 7.35 -1.26 -1.31 117.46 126.68 3i4n n PHE 755 Ca 0.01 1.00 -0.10 0.00 -0.76 0.00 0.00 57.45 57.59 3i4n n PHE 755 Cb 0.64 -0.77 -0.06 0.00 0.35 0.00 0.00 39.48 39.64 3i4n n PHE 755 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3i4n h ILE 756 N 0.00 0.06 -0.32 -2.13 1.08 -2.00 -2.66 117.51 111.54 3i4n h ILE 756 Ca 0.26 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.76 3i4n h ILE 756 Cb 0.46 0.06 -0.05 0.00 -3.07 0.00 0.00 36.82 34.22 3i4n h ILE 756 CO -0.80 0.00 -0.29 0.78 -0.69 0.00 0.00 178.15 177.15 3i4n h ASN 757 N -0.28 -1.00 -0.97 1.72 2.35 -1.60 0.14 115.58 115.93 3i4n h ASN 757 Ca 0.14 0.14 0.25 0.00 -0.55 0.00 0.00 56.30 56.28 3i4n h ASN 757 Cb 0.57 0.42 -0.18 0.00 0.05 0.00 0.00 38.32 39.19 3i4n h ASN 757 CO -0.66 -0.17 -0.01 0.40 -1.65 0.00 0.00 177.43 175.34 3i4n h ILE 758 N -0.12 0.05 0.42 2.81 2.04 -1.50 -0.00 117.51 121.21 3i4n h ILE 758 Ca 0.05 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 3i4n h ILE 758 Cb 0.26 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.35 3i4n h ILE 758 CO -0.37 0.00 -0.42 0.00 0.00 0.00 0.00 178.15 177.36 3i4n h ALA 759 N 1.96 -0.93 0.00 1.87 0.00 -0.44 0.12 119.26 121.84 3i4n h ALA 759 Ca 0.56 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3i4n h ALA 759 Cb 1.11 0.61 0.00 0.00 0.00 0.00 0.00 17.79 19.51 3i4n h ALA 759 CO -0.91 -1.06 0.00 1.04 0.00 0.00 0.00 179.25 178.32 3i4n n GLN 760 N -5.51 0.35 -0.04 0.00 6.02 -0.07 -0.69 117.38 117.44 3i4n n GLN 760 Ca -0.11 0.05 -0.10 0.00 -0.01 0.00 0.00 57.00 56.83 3i4n n GLN 760 Cb 0.41 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.14 3i4n n GLN 760 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3i4n n MET 761 N -1.09 0.24 0.02 -1.09 2.81 -0.88 -2.13 117.12 115.00 3i4n n MET 761 Ca 0.09 0.10 -0.18 0.00 -1.81 0.00 0.00 57.70 55.90 3i4n n MET 761 Cb 0.06 -0.91 -0.14 0.00 -0.71 0.00 0.00 33.22 31.53 3i4n n MET 761 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 3i4n h SER 762 N -0.42 0.35 0.00 7.83 0.02 -0.81 -2.46 113.55 118.07 3i4n h SER 762 Ca -0.21 -0.96 0.00 0.00 -0.84 0.00 0.00 61.79 59.78 3i4n h SER 762 Cb 1.02 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.44 3i4n h SER 762 CO -0.13 1.28 0.00 0.00 -1.14 0.00 0.00 176.83 176.84 3i4n n ALA 763 N -2.65 0.00 -2.54 3.77 0.00 0.14 -4.66 120.51 114.56 3i4n n ALA 763 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.01 3i4n n ALA 763 Cb 0.73 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.07 3i4n n ALA 763 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n n VAL 765 N 1.26 0.00 0.00 0.00 0.31 -0.59 -3.35 118.33 115.97 3i4n n VAL 765 Ca -0.15 0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 3i4n n VAL 765 Cb 0.52 -0.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.89 3i4n n VAL 765 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i4n n GLY 766 N 1.73 0.22 3.48 2.92 0.00 -0.72 -4.69 105.19 108.12 3i4n n GLY 766 Ca 0.00 -1.31 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 3i4n n GLY 766 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3i4n s GLN 767 N -1.94 3.18 0.57 1.61 2.00 -1.26 0.57 119.66 124.40 3i4n s GLN 767 Ca 0.00 -0.68 -0.20 0.00 -2.00 0.00 0.00 55.36 52.48 3i4n s GLN 767 Cb 0.00 -4.05 -0.04 0.00 0.80 0.00 0.00 33.01 29.72 3i4n s GLN 767 CO 0.00 -1.17 1.26 -0.65 -0.50 0.00 0.00 175.29 174.23 3i4n s GLN 768 N 2.79 3.07 0.10 1.67 1.11 0.10 -4.95 119.66 123.55 3i4n s GLN 768 Ca 0.19 1.97 -0.11 0.00 0.01 0.00 0.00 55.36 57.41 3i4n s GLN 768 Cb -0.17 -2.08 0.01 0.00 -1.01 0.00 0.00 33.01 29.77 3i4n s GLN 768 CO 0.15 -1.17 0.27 -1.54 0.01 0.00 0.00 175.29 173.01 3i4n s SER 769 N -1.35 -0.01 -0.13 5.90 1.04 -1.26 -4.08 113.70 113.80 3i4n s SER 769 Ca 0.75 -0.51 -0.02 0.00 0.48 0.00 0.00 55.95 56.65 3i4n s SER 769 Cb -0.34 0.39 0.04 0.00 0.10 0.00 0.00 66.02 66.21 3i4n s SER 769 CO 0.38 -0.76 -0.00 -0.69 0.98 0.00 0.00 173.24 173.15 3i4n s VAL 770 N -3.76 0.60 -1.50 5.02 1.01 -1.17 -4.59 120.40 116.01 3i4n s VAL 770 Ca 0.04 -0.26 -0.04 0.00 0.00 0.00 0.00 61.98 61.72 3i4n s VAL 770 Cb 0.03 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.55 3i4n s VAL 770 CO -0.11 0.10 0.47 -0.62 0.00 0.00 0.00 175.10 174.94 3i4n n GLU 771 N 5.05 -4.07 0.00 2.72 1.02 -1.26 -2.10 120.64 122.01 3i4n n GLU 771 Ca -0.09 0.87 0.00 0.00 -0.02 0.00 0.00 57.16 57.92 3i4n n GLU 771 Cb 0.49 -5.59 0.00 0.00 -0.02 0.00 0.00 31.44 26.32 3i4n n GLU 771 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i4n n GLY 772 N -1.40 2.19 3.54 0.62 0.00 -1.26 -4.91 105.19 103.97 3i4n n GLY 772 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 3i4n n GLY 772 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i4n s LYS 773 N 0.00 3.21 0.21 1.61 1.02 -0.89 -4.93 119.74 119.97 3i4n s LYS 773 Ca 0.00 -0.38 -0.29 0.00 0.02 0.00 0.00 55.97 55.32 3i4n s LYS 773 Cb 0.00 -4.28 -0.16 0.00 -0.52 0.00 0.00 37.83 32.87 3i4n s LYS 773 CO 0.00 -2.12 0.80 2.89 -0.92 0.00 0.00 175.35 176.00 3i4n n ARG 774 N 9.15 0.57 0.00 1.68 1.85 -1.26 -3.05 116.66 125.60 3i4n n ARG 774 Ca 0.05 0.20 0.00 0.00 -1.00 0.00 0.00 57.85 57.10 3i4n n ARG 774 Cb 0.49 -1.42 0.00 0.00 -1.05 0.00 0.00 32.46 30.48 3i4n n ARG 774 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 3i4n n ILE 775 N 0.37 0.00 -2.58 8.89 2.08 -0.99 -4.85 119.36 122.28 3i4n n ILE 775 Ca 0.15 0.00 -0.18 0.00 0.56 0.00 0.00 62.75 63.29 3i4n n ILE 775 Cb 0.26 0.00 0.09 0.00 -0.75 0.00 0.00 39.64 39.24 3i4n n ILE 775 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3i4n n ALA 776 N 0.00 0.23 -2.33 -1.39 0.00 -1.26 -4.69 120.51 111.07 3i4n n ALA 776 Ca 0.00 -1.53 -0.40 0.00 0.00 0.00 0.00 53.44 51.51 3i4n n ALA 776 Cb 0.00 0.27 0.01 0.00 0.00 0.00 0.00 19.45 19.73 3i4n n ALA 776 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3i4n n PHE 777 N -2.47 2.68 0.60 0.00 0.99 -1.26 -4.54 117.46 113.47 3i4n n PHE 777 Ca 0.13 -2.59 0.06 0.00 -0.00 0.00 0.00 57.45 55.04 3i4n n PHE 777 Cb 0.46 -1.40 0.31 0.00 -1.00 0.00 0.00 39.48 37.84 3i4n n PHE 777 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3i4n n GLY 778 N 0.49 -0.55 2.63 1.37 0.00 -1.26 -2.62 105.19 105.24 3i4n n GLY 778 Ca 0.52 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 46.15 3i4n n GLY 778 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i4n n PHE 779 N -1.18 3.17 -3.23 1.61 0.99 -1.21 -4.98 117.46 112.64 3i4n n PHE 779 Ca 0.07 -2.71 -0.14 0.00 -0.00 0.00 0.00 57.45 54.67 3i4n n PHE 779 Cb 0.07 -0.67 0.01 0.00 -1.00 0.00 0.00 39.48 37.90 3i4n n PHE 779 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 3i4n n VAL 780 N -0.55 -4.17 -3.76 -4.37 0.31 -1.08 -3.56 118.33 101.15 3i4n n VAL 780 Ca 0.47 0.52 -0.25 0.00 -0.01 0.00 0.00 64.34 65.07 3i4n n VAL 780 Cb 0.50 -3.82 0.04 0.00 -0.91 0.00 0.00 33.84 29.65 3i4n n VAL 780 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3i4n n ASP 781 N 0.65 -3.42 -3.59 4.52 8.00 -1.25 -4.74 116.55 116.72 3i4n n ASP 781 Ca -0.02 -0.75 0.01 0.00 0.71 0.00 0.00 54.79 54.74 3i4n n ASP 781 Cb 0.51 -4.19 -0.01 0.00 -0.02 0.00 0.00 41.12 37.41 3i4n n ASP 781 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i4n s ARG 782 N -6.25 0.04 -0.20 -1.24 1.70 -1.23 0.23 118.95 112.00 3i4n s ARG 782 Ca 0.35 -0.02 -0.23 0.00 -0.47 0.00 0.00 55.73 55.36 3i4n s ARG 782 Cb -0.17 0.01 -0.20 0.00 -0.57 0.00 0.00 34.95 34.02 3i4n s ARG 782 CO 0.80 -0.02 0.32 1.15 -1.08 0.00 0.00 175.30 176.48 3i4n h THR 783 N 2.00 1.08 -3.45 4.99 2.02 -1.83 -3.19 112.91 114.53 3i4n h THR 783 Ca -0.21 -2.21 -0.41 0.00 0.77 0.00 0.00 66.41 64.35 3i4n h THR 783 Cb 1.16 2.45 -0.14 0.00 -1.74 0.00 0.00 68.15 69.88 3i4n h THR 783 CO 0.25 0.37 -0.59 -0.76 0.37 0.00 0.00 175.52 175.16 3i4n s LEU 784 N -7.93 1.81 0.00 2.58 1.43 -1.26 -4.62 118.68 110.69 3i4n s LEU 784 Ca -0.27 -1.44 0.00 0.00 -1.03 0.00 0.00 54.13 51.39 3i4n s LEU 784 Cb 0.04 -0.06 0.03 0.00 0.03 0.00 0.00 46.19 46.23 3i4n s LEU 784 CO 0.61 -0.75 0.73 -0.81 0.23 0.00 0.00 176.35 176.36 3i4n n PRO 785 N -0.59 0.71 -0.05 1.29 -0.04 -1.26 -2.03 135.00 133.03 3i4n n PRO 785 Ca -0.01 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.57 3i4n n PRO 785 Cb 0.66 -1.01 0.22 0.00 -0.04 0.00 0.00 33.50 33.33 3i4n n PRO 785 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3i4n n HIS 786 N -0.51 0.13 -4.42 0.54 8.25 -1.26 -4.94 115.22 113.02 3i4n n HIS 786 Ca 0.00 -0.07 -0.25 0.00 -0.26 0.00 0.00 57.72 57.14 3i4n n HIS 786 Cb 0.00 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.00 3i4n n HIS 786 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3i4n s PHE 787 N -1.87 2.22 0.05 4.41 2.99 -0.86 -5.12 117.98 119.79 3i4n s PHE 787 Ca 0.32 -0.37 -0.23 0.00 0.00 0.00 0.00 56.93 56.65 3i4n s PHE 787 Cb 0.21 -1.07 -0.06 0.00 0.00 0.00 0.00 43.02 42.10 3i4n s PHE 787 CO 0.31 0.52 0.70 -1.12 -0.00 0.00 0.00 175.22 175.63 3i4n s SER 788 N -2.87 7.15 1.02 1.36 0.01 -1.26 -4.89 113.70 114.22 3i4n s SER 788 Ca 0.22 1.37 -0.22 0.00 1.31 0.00 0.00 55.95 58.63 3i4n s SER 788 Cb -0.07 -2.43 -0.10 0.00 0.21 0.00 0.00 66.02 63.63 3i4n s SER 788 CO 0.10 0.09 -0.91 0.29 0.41 0.00 0.00 173.24 173.23 3i4n n LYS 789 N 2.52 -0.37 -3.87 12.44 5.02 -1.26 -3.64 118.16 129.00 3i4n n LYS 789 Ca -0.05 -0.10 -0.33 0.00 -2.02 0.00 0.00 58.31 55.81 3i4n n LYS 789 Cb 0.50 -1.22 0.01 0.00 -0.02 0.00 0.00 35.03 34.30 3i4n n LYS 789 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3i4n n ASP 790 N 1.99 -4.01 -4.07 4.39 9.92 0.62 -4.93 116.55 120.46 3i4n n ASP 790 Ca -0.01 -1.04 -0.33 0.00 -0.53 0.00 0.00 54.79 52.89 3i4n n ASP 790 Cb 0.67 -1.43 -0.14 0.00 -0.64 0.00 0.00 41.12 39.58 3i4n n ASP 790 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3i4n s ASP 791 N -3.28 4.75 0.03 -2.24 -1.08 -1.24 -4.97 116.67 108.63 3i4n s ASP 791 Ca 0.22 -1.75 0.23 0.00 -0.52 0.00 0.00 52.55 50.73 3i4n s ASP 791 Cb -0.13 -1.64 -0.02 0.00 -1.46 0.00 0.00 42.92 39.67 3i4n s ASP 791 CO 0.85 -0.32 0.97 -1.22 0.52 0.00 0.00 175.17 175.97 3i4n n TYR 792 N 4.41 0.16 -1.15 -5.34 4.02 -1.26 -4.74 117.16 113.26 3i4n n TYR 792 Ca -0.05 0.05 -0.36 0.00 -0.01 0.00 0.00 57.90 57.52 3i4n n TYR 792 Cb 0.42 -0.33 0.07 0.00 -0.02 0.00 0.00 39.34 39.48 3i4n n TYR 792 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 3i4n n SER 793 N -1.86 -2.09 0.28 7.72 3.41 -1.26 -4.60 113.62 115.21 3i4n n SER 793 Ca 0.02 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.26 3i4n n SER 793 Cb 0.42 -1.13 0.79 0.00 -0.26 0.00 0.00 64.21 64.03 3i4n n SER 793 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 3i4n h PRO 794 N -0.62 0.00 0.00 4.33 0.13 -1.95 -1.62 132.00 132.26 3i4n h PRO 794 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3i4n h PRO 794 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 3i4n h PRO 794 CO 0.39 0.05 0.00 0.39 -0.23 0.00 0.00 178.00 178.60 3i4n n GLU 795 N -3.93 0.27 0.00 0.86 4.71 -1.26 -2.17 120.64 119.12 3i4n n GLU 795 Ca -0.03 0.10 0.00 0.00 -0.01 0.00 0.00 57.16 57.23 3i4n n GLU 795 Cb 0.14 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.07 3i4n n GLU 795 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 3i4n n SER 796 N -1.18 3.75 -0.24 1.62 2.88 -0.64 -4.71 113.62 115.10 3i4n n SER 796 Ca 0.07 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.69 3i4n n SER 796 Cb 0.08 0.45 0.35 0.00 -0.75 0.00 0.00 64.21 64.35 3i4n n SER 796 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3i4n n LYS 797 N -1.52 1.31 -0.52 -1.46 4.76 -1.00 -4.67 118.16 115.06 3i4n n LYS 797 Ca 0.00 -0.48 0.00 0.00 -2.87 0.00 0.00 58.31 54.96 3i4n n LYS 797 Cb 0.30 -1.27 0.00 0.00 -1.84 0.00 0.00 35.03 32.22 3i4n n LYS 797 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3i4n n GLY 798 N 0.87 0.87 3.16 0.72 0.00 -1.21 -2.35 105.19 107.25 3i4n n GLY 798 Ca 0.12 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 3i4n n GLY 798 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3i4n s PHE 799 N -2.26 3.33 -0.68 1.61 5.36 -0.92 0.01 117.98 124.42 3i4n s PHE 799 Ca 0.00 -1.98 -0.27 0.00 -0.96 0.00 0.00 56.93 53.72 3i4n s PHE 799 Cb 0.00 -2.29 0.03 0.00 -0.34 0.00 0.00 43.02 40.42 3i4n s PHE 799 CO 0.00 -0.83 1.27 0.08 -1.46 0.00 0.00 175.22 174.28 3i4n s VAL 800 N 1.23 3.81 -0.00 3.12 1.01 0.19 -4.81 120.40 124.95 3i4n s VAL 800 Ca -0.03 0.56 -0.21 0.00 0.00 0.00 0.00 61.98 62.31 3i4n s VAL 800 Cb -0.20 -4.83 -0.21 0.00 0.00 0.00 0.00 36.38 31.13 3i4n s VAL 800 CO -0.02 -1.67 1.13 -0.08 0.00 0.00 0.00 175.10 174.47 3i4n h GLU 801 N 9.99 0.34 0.00 2.72 4.81 -1.97 -1.90 114.58 128.56 3i4n h GLU 801 Ca -0.27 -0.31 -0.31 0.00 -0.13 0.00 0.00 59.36 58.34 3i4n h GLU 801 Cb 1.05 0.08 0.18 0.00 0.63 0.00 0.00 28.75 30.69 3i4n h GLU 801 CO 1.25 0.98 -0.15 0.09 -0.73 0.00 0.00 179.01 180.45 3i4n n ASN 802 N -4.37 -3.86 -4.36 1.04 3.02 -1.26 -4.10 115.26 101.38 3i4n n ASN 802 Ca -0.09 -0.74 -0.20 0.00 -0.03 0.00 0.00 54.58 53.52 3i4n n ASN 802 Cb 0.56 -0.87 -0.10 0.00 -0.61 0.00 0.00 39.78 38.75 3i4n n ASN 802 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3i4n s SER 803 N -2.85 2.74 0.64 6.41 1.04 -1.24 -1.54 113.70 118.89 3i4n s SER 803 Ca 0.57 -0.97 0.34 0.00 0.48 0.00 0.00 55.95 56.37 3i4n s SER 803 Cb -0.10 -0.16 1.85 0.00 0.10 0.00 0.00 66.02 67.70 3i4n s SER 803 CO 0.47 -0.10 2.04 1.88 0.98 0.00 0.00 173.24 178.51 3i4n h TYR 804 N 2.75 0.00 0.14 5.02 0.99 -1.46 1.02 116.97 125.43 3i4n h TYR 804 Ca -0.40 0.00 -0.29 0.00 2.00 0.00 0.00 58.73 60.05 3i4n h TYR 804 Cb 1.22 0.00 0.02 0.00 1.00 0.00 0.00 36.73 38.97 3i4n h TYR 804 CO 0.72 0.00 -1.26 1.25 -0.00 0.00 0.00 178.16 178.87 3i4n h LEU 805 N 0.00 0.64 0.19 3.88 5.85 -1.71 -3.35 115.31 120.81 3i4n h LEU 805 Ca 0.00 -0.63 -0.35 0.00 0.84 0.00 0.00 57.88 57.74 3i4n h LEU 805 Cb 0.40 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 41.24 3i4n h LEU 805 CO 0.00 1.48 -1.68 0.03 -0.34 0.00 0.00 178.44 177.92 3i4n h ARG 806 N 0.15 0.41 -0.04 1.25 3.08 0.06 -3.51 114.38 115.80 3i4n h ARG 806 Ca -0.17 -0.70 0.00 0.00 0.07 0.00 0.00 59.98 59.18 3i4n h ARG 806 Cb 1.95 0.26 0.00 0.00 0.08 0.00 0.00 29.97 32.27 3i4n h ARG 806 CO 0.22 1.33 0.00 0.41 -1.07 0.00 0.00 179.97 180.86 3i4n n GLY 807 N 1.82 1.03 3.50 0.04 0.00 0.29 -4.91 105.19 106.95 3i4n n GLY 807 Ca -0.22 -1.28 -0.29 0.00 0.00 0.00 0.00 46.02 44.23 3i4n n GLY 807 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i4n n LEU 808 N -0.04 -0.74 -4.81 0.99 4.32 -1.26 -4.79 117.00 110.66 3i4n n LEU 808 Ca 0.00 -0.07 -0.24 0.00 -0.02 0.00 0.00 56.01 55.67 3i4n n LEU 808 Cb 0.00 -1.29 -0.05 0.00 -1.62 0.00 0.00 43.42 40.46 3i4n n LEU 808 CO 0.00 -3.12 -0.19 0.42 -1.22 0.00 0.00 177.39 173.27 3i4n s THR 809 N -2.44 4.50 0.47 -5.08 -4.23 -1.26 -4.82 115.64 102.78 3i4n s THR 809 Ca 0.68 -1.20 0.36 0.00 -1.18 0.00 0.00 61.69 60.35 3i4n s THR 809 Cb -0.25 -3.35 0.55 0.00 1.34 0.00 0.00 72.50 70.79 3i4n s THR 809 CO 0.64 -0.21 1.59 -0.65 -0.54 0.00 0.00 174.62 175.46 3i4n h PRO 810 N 2.03 0.02 0.00 3.99 0.11 -1.98 1.46 132.00 137.63 3i4n h PRO 810 Ca -0.48 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 3i4n h PRO 810 Cb 1.22 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3i4n h PRO 810 CO 0.62 0.01 -0.57 1.96 -0.21 0.00 0.00 178.00 179.82 3i4n h GLN 811 N 0.02 0.00 -1.08 1.05 7.50 -1.99 -2.63 115.11 117.98 3i4n h GLN 811 Ca 0.88 0.00 0.32 0.00 0.50 0.00 0.00 58.65 60.35 3i4n h GLN 811 Cb 2.97 0.00 -0.13 0.00 0.05 0.00 0.00 27.48 30.37 3i4n h GLN 811 CO -0.37 0.59 0.66 0.93 -1.50 0.00 0.00 178.83 179.14 3i4n h GLU 812 N -1.00 0.31 0.30 1.46 5.08 -1.06 -0.97 114.58 118.70 3i4n h GLU 812 Ca -0.12 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 3i4n h GLU 812 Cb 0.82 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.00 3i4n h GLU 812 CO -0.07 0.21 -0.15 0.35 -1.00 0.00 0.00 179.01 178.35 3i4n h PHE 813 N 0.32 -0.38 -1.00 4.33 3.57 0.18 -2.44 116.94 121.52 3i4n h PHE 813 Ca 0.71 -0.01 0.20 0.00 3.53 0.00 0.00 57.97 62.40 3i4n h PHE 813 Cb 1.77 0.12 -0.11 0.00 2.79 0.00 0.00 35.95 40.53 3i4n h PHE 813 CO -0.01 -0.23 0.61 0.35 -2.23 0.00 0.00 178.31 176.80 3i4n h PHE 814 N -0.50 1.02 0.16 0.41 3.57 -0.94 -1.44 116.94 119.21 3i4n h PHE 814 Ca -0.04 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 3i4n h PHE 814 Cb 0.31 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.75 3i4n h PHE 814 CO 0.11 0.20 -0.08 0.74 -2.23 0.00 0.00 178.31 177.05 3i4n h PHE 815 N 0.70 -0.20 -1.10 0.41 0.05 -1.28 -2.31 116.94 113.22 3i4n h PHE 815 Ca 0.58 -0.00 0.32 0.00 3.82 0.00 0.00 57.97 62.69 3i4n h PHE 815 Cb 0.99 0.07 -0.12 0.00 2.00 0.00 0.00 35.95 38.89 3i4n h PHE 815 CO -0.00 0.07 0.68 1.25 -0.18 0.00 0.00 178.31 180.13 3i4n h HIS 816 N -0.45 0.73 0.00 -0.55 2.76 -0.77 -1.76 115.15 115.11 3i4n h HIS 816 Ca -0.02 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 3i4n h HIS 816 Cb 0.35 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.11 3i4n h HIS 816 CO 0.00 -0.07 0.00 0.00 -1.30 0.00 0.00 177.93 176.57 3i4n n ALA 817 N -2.42 -0.32 -0.32 5.26 0.00 -0.85 0.37 120.51 122.23 3i4n n ALA 817 Ca 0.30 0.00 0.28 0.00 0.00 0.00 0.00 53.44 54.02 3i4n n ALA 817 Cb 1.03 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.97 3i4n n ALA 817 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3i4n n MET 818 N -1.45 -0.03 0.06 0.00 2.00 -0.77 0.24 117.12 117.17 3i4n n MET 818 Ca 0.00 0.93 -0.11 0.00 0.00 0.00 0.00 57.70 58.52 3i4n n MET 818 Cb 0.00 -1.80 -0.08 0.00 0.00 0.00 0.00 33.22 31.34 3i4n n MET 818 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 3i4n h GLY 819 N 0.00 -0.25 0.21 3.03 0.00 -1.04 -3.23 103.07 101.80 3i4n h GLY 819 Ca 0.64 0.09 0.08 0.00 0.00 0.00 0.00 47.33 48.14 3i4n h GLY 819 CO -0.39 -0.09 -0.09 -1.33 0.00 0.00 0.00 176.54 174.64 3i4n h GLY 820 N -0.85 0.30 -0.71 4.60 0.00 0.80 -1.10 103.07 106.11 3i4n h GLY 820 Ca -0.02 0.12 0.36 0.00 0.00 0.00 0.00 47.33 47.79 3i4n h GLY 820 CO 0.04 -0.15 0.70 -0.09 0.00 0.00 0.00 176.54 177.04 3i4n h ARG 821 N 0.01 0.22 -0.65 4.80 9.65 -0.48 0.56 114.38 128.49 3i4n h ARG 821 Ca 0.19 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 59.01 3i4n h ARG 821 Cb 0.29 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 28.79 3i4n h ARG 821 CO -0.40 0.14 0.22 1.49 2.80 0.00 0.00 179.97 184.22 3i4n h GLU 822 N 0.22 0.98 0.73 0.20 4.81 -1.21 0.28 114.58 120.59 3i4n h GLU 822 Ca 0.75 -0.18 -0.04 0.00 -0.13 0.00 0.00 59.36 59.76 3i4n h GLU 822 Cb 2.03 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 31.26 3i4n h GLU 822 CO -0.49 0.82 -0.35 0.78 -0.73 0.00 0.00 179.01 179.05 3i4n h GLY 823 N 1.04 -1.03 -0.07 1.92 0.00 -0.95 -2.42 103.07 101.56 3i4n h GLY 823 Ca 0.22 0.38 0.24 0.00 0.00 0.00 0.00 47.33 48.16 3i4n h GLY 823 CO -0.01 -0.37 0.62 1.41 0.00 0.00 0.00 176.54 178.18 3i4n h LEU 824 N -1.03 0.64 0.00 3.11 3.38 -1.29 0.24 115.31 120.35 3i4n h LEU 824 Ca -0.10 0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3i4n h LEU 824 Cb 0.77 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.52 3i4n h LEU 824 CO 0.17 0.14 0.00 0.00 0.09 0.00 0.00 178.44 178.83 3i4n n ILE 825 N -4.78 0.00 0.28 1.22 0.13 0.94 -2.83 119.36 114.32 3i4n n ILE 825 Ca 0.26 1.40 0.14 0.00 -1.10 0.00 0.00 62.75 63.45 3i4n n ILE 825 Cb 0.74 -2.40 0.83 0.00 -0.84 0.00 0.00 39.64 37.97 3i4n n ILE 825 CO 0.00 0.00 0.00 -2.24 2.80 0.00 0.00 176.55 177.11 3i4n h ASP 826 N 0.00 0.00 -0.91 9.51 3.04 -1.38 -0.59 116.42 126.08 3i4n h ASP 826 Ca 0.00 0.00 0.22 0.00 -3.24 0.00 0.00 57.03 54.01 3i4n h ASP 826 Cb 0.00 0.00 -0.12 0.00 -1.04 0.00 0.00 39.33 38.17 3i4n h ASP 826 CO 0.00 0.05 0.43 0.74 -2.04 0.00 0.00 179.24 178.43 3i4n h THR 827 N 0.00 0.50 -0.28 1.15 2.02 -0.85 1.78 112.91 117.23 3i4n h THR 827 Ca -0.00 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.00 3i4n h THR 827 Cb 0.14 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.55 3i4n h THR 827 CO 0.01 0.08 0.03 0.00 0.37 0.00 0.00 175.52 176.01 3i4n n ALA 828 N -2.46 3.23 0.04 6.16 0.00 -0.23 -3.05 120.51 124.20 3i4n n ALA 828 Ca 0.23 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.74 3i4n n ALA 828 Cb 0.66 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 19.04 3i4n n ALA 828 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3i4n n VAL 829 N 0.23 0.19 -0.01 0.00 0.31 0.50 -4.63 118.33 114.92 3i4n n VAL 829 Ca 0.14 0.06 0.22 0.00 -0.01 0.00 0.00 64.34 64.76 3i4n n VAL 829 Cb 0.73 -0.60 0.59 0.00 -0.91 0.00 0.00 33.84 33.64 3i4n n VAL 829 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 3i4n h LYS 830 N 0.00 0.00 0.04 5.55 1.63 0.16 1.59 116.57 125.53 3i4n h LYS 830 Ca 0.00 0.00 -0.22 0.00 -0.85 0.00 0.00 60.65 59.58 3i4n h LYS 830 Cb 0.00 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.62 3i4n h LYS 830 CO 0.00 0.00 -1.02 0.00 -3.45 0.00 0.00 179.45 174.98 3i4n h THR 831 N 0.00 1.58 0.03 1.00 1.03 -1.64 -2.75 112.91 112.17 3i4n h THR 831 Ca 0.30 -3.04 -0.05 0.00 -0.01 0.00 0.00 66.41 63.60 3i4n h THR 831 Cb 1.88 2.74 0.00 0.00 -1.07 0.00 0.00 68.15 71.70 3i4n h THR 831 CO -0.00 0.88 -0.24 0.00 -0.01 0.00 0.00 175.52 176.14 3i4n h ALA 832 N 0.89 0.00 -0.62 0.00 0.00 0.20 -2.10 119.26 117.63 3i4n h ALA 832 Ca -0.06 -0.59 0.05 0.00 0.00 0.00 0.00 54.91 54.32 3i4n h ALA 832 Cb 1.73 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.55 3i4n h ALA 832 CO 0.15 0.12 0.41 1.49 0.00 0.00 0.00 179.25 181.42 3i4n h GLU 833 N -0.87 0.65 0.61 0.00 4.57 -1.21 -1.19 114.58 117.13 3i4n h GLU 833 Ca -0.05 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.06 3i4n h GLU 833 Cb 1.15 -0.15 0.01 0.00 -0.16 0.00 0.00 28.75 29.60 3i4n h GLU 833 CO 0.02 0.43 -0.30 1.15 -1.18 0.00 0.00 179.01 179.13 3i4n h THR 834 N 0.67 0.19 -0.25 0.32 2.02 -1.56 0.49 112.91 114.79 3i4n h THR 834 Ca 0.26 -0.35 0.07 0.00 0.77 0.00 0.00 66.41 67.16 3i4n h THR 834 Cb 0.18 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 3i4n h THR 834 CO -0.07 0.03 0.52 1.23 0.37 0.00 0.00 175.52 177.59 3i4n h GLY 835 N -1.12 0.00 0.00 2.16 0.00 -0.84 0.71 103.07 103.98 3i4n h GLY 835 Ca -0.08 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.16 3i4n h GLY 835 CO 0.14 0.00 -0.77 -1.82 0.00 0.00 0.00 176.54 174.08 3i4n h TYR 836 N 0.00 0.00 -1.17 5.60 3.20 -0.97 -3.22 116.97 120.42 3i4n h TYR 836 Ca 0.12 0.00 0.33 0.00 3.14 0.00 0.00 58.73 62.32 3i4n h TYR 836 Cb 1.16 0.00 -0.08 0.00 1.54 0.00 0.00 36.73 39.35 3i4n h TYR 836 CO 0.00 0.55 0.80 0.82 -1.64 0.00 0.00 178.16 178.69 3i4n h ILE 837 N -1.00 0.40 0.15 1.81 2.04 0.14 -0.82 117.51 120.24 3i4n h ILE 837 Ca -0.13 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 3i4n h ILE 837 Cb 0.79 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 3i4n h ILE 837 CO -0.08 0.03 -0.07 -0.61 0.00 0.00 0.00 178.15 177.42 3i4n h GLN 838 N 0.17 -0.20 -0.92 2.37 -0.00 0.22 -3.00 115.11 113.76 3i4n h GLN 838 Ca 0.62 0.01 0.26 0.00 -0.00 0.00 0.00 58.65 59.55 3i4n h GLN 838 Cb 2.05 0.04 -0.16 0.00 0.00 0.00 0.00 27.48 29.42 3i4n h GLN 838 CO -0.18 -0.13 0.19 -0.09 0.00 0.00 0.00 178.83 178.62 3i4n h ARG 839 N -0.23 0.12 0.41 1.69 2.43 -1.18 -0.93 114.38 116.68 3i4n h ARG 839 Ca -0.02 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 3i4n h ARG 839 Cb 0.16 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 3i4n h ARG 839 CO 0.03 0.08 -0.25 0.00 -1.51 0.00 0.00 179.97 178.32 3i4n h ARG 840 N 0.12 -0.61 -0.89 0.20 3.08 -1.46 -0.68 114.38 114.14 3i4n h ARG 840 Ca 0.59 0.04 0.24 0.00 0.07 0.00 0.00 59.98 60.92 3i4n h ARG 840 Cb 1.24 0.14 -0.15 0.00 0.08 0.00 0.00 29.97 31.28 3i4n h ARG 840 CO -0.75 -0.41 0.17 -0.07 -1.07 0.00 0.00 179.97 177.84 3i4n h LEU 841 N -0.63 -0.14 0.24 3.04 3.38 -1.02 0.40 115.31 120.57 3i4n h LEU 841 Ca -0.04 0.22 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 3i4n h LEU 841 Cb 0.52 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.60 3i4n h LEU 841 CO 0.04 -0.21 -0.12 0.58 0.09 0.00 0.00 178.44 178.82 3i4n h VAL 842 N 0.14 0.72 0.00 1.22 2.07 -1.23 -2.92 116.25 116.26 3i4n h VAL 842 Ca 0.55 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 67.19 3i4n h VAL 842 Cb 1.12 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 3i4n h VAL 842 CO -0.72 0.16 0.04 0.29 0.02 0.00 0.00 177.57 177.37 3i4n n LYS 843 N -5.02 0.04 -0.93 1.57 4.76 -0.28 -1.09 118.16 117.19 3i4n n LYS 843 Ca -0.08 0.51 -0.09 0.00 -2.87 0.00 0.00 58.31 55.77 3i4n n LYS 843 Cb 0.26 -1.67 0.22 0.00 -1.84 0.00 0.00 35.03 32.00 3i4n n LYS 843 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3i4n n ALA 844 N -1.54 4.62 -0.22 7.82 0.00 0.05 -4.48 120.51 126.76 3i4n n ALA 844 Ca -0.00 -2.85 0.00 0.00 0.00 0.00 0.00 53.44 50.59 3i4n n ALA 844 Cb 0.05 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.46 3i4n n ALA 844 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3i4n n LEU 845 N -0.91 0.00 0.00 0.00 4.77 -0.25 -5.00 117.00 115.61 3i4n n LEU 845 Ca 0.41 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 3i4n n LEU 845 Cb 1.28 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.37 3i4n n LEU 845 CO 0.36 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.80 3i4n n GLU 846 N 0.00 0.00 0.00 3.23 1.02 -0.39 0.36 120.64 124.86 3i4n n GLU 846 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3i4n n GLU 846 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3i4n n GLU 846 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3i4n n ASP 847 N -0.32 0.00 -4.62 1.62 5.75 -1.26 -3.90 116.55 113.82 3i4n n ASP 847 Ca 0.00 -0.01 -0.39 0.00 -0.01 0.00 0.00 54.79 54.38 3i4n n ASP 847 Cb 0.00 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.01 3i4n n ASP 847 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3i4n s ILE 848 N -2.00 5.14 0.36 2.12 1.01 0.16 -3.92 121.20 124.07 3i4n s ILE 848 Ca 0.00 0.70 -0.02 0.00 0.00 0.00 0.00 60.65 61.33 3i4n s ILE 848 Cb 0.00 -3.75 0.01 0.00 0.01 0.00 0.00 42.46 38.73 3i4n s ILE 848 CO 0.00 0.15 0.50 1.15 0.00 0.00 0.00 174.94 176.74 3i4n n MET 849 N 5.23 0.72 -3.55 2.79 0.00 -1.09 -0.88 117.12 120.34 3i4n n MET 849 Ca -0.07 -2.91 -0.41 0.00 0.00 0.00 0.00 57.70 54.31 3i4n n MET 849 Cb 0.50 2.80 -0.11 0.00 0.00 0.00 0.00 33.22 36.41 3i4n n MET 849 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 3i4n s VAL 850 N -2.84 5.09 0.24 3.17 1.01 -1.09 -2.51 120.40 123.46 3i4n s VAL 850 Ca 0.30 -0.40 -0.22 0.00 0.00 0.00 0.00 61.98 61.66 3i4n s VAL 850 Cb -0.01 -3.67 -0.09 0.00 0.00 0.00 0.00 36.38 32.61 3i4n s VAL 850 CO 0.22 -0.07 0.79 -1.00 0.00 0.00 0.00 175.10 175.04 3i4n s HIS 851 N 1.68 3.71 0.10 5.22 3.76 -0.28 -2.50 115.29 126.98 3i4n s HIS 851 Ca 0.05 1.54 0.00 0.00 -0.15 0.00 0.00 55.06 56.50 3i4n s HIS 851 Cb -0.18 -2.73 0.00 0.00 1.11 0.00 0.00 32.58 30.79 3i4n s HIS 851 CO 0.09 0.34 0.25 0.66 -0.85 0.00 0.00 174.74 175.23 3i4n n TYR 852 N 0.85 0.00 0.94 1.40 0.53 -1.26 0.16 117.16 119.78 3i4n n TYR 852 Ca -0.02 0.00 0.10 0.00 -1.02 0.00 0.00 57.90 56.96 3i4n n TYR 852 Cb 0.50 0.00 -0.09 0.00 -1.03 0.00 0.00 39.34 38.72 3i4n n TYR 852 CO 0.00 0.00 0.00 -0.40 -1.02 0.00 0.00 176.86 175.44 3i4n n ASP 853 N -0.72 1.12 0.00 7.72 5.68 -1.26 -4.96 116.55 124.13 3i4n n ASP 853 Ca 0.00 -1.06 0.00 0.00 -0.50 0.00 0.00 54.79 53.23 3i4n n ASP 853 Cb 0.25 0.91 0.00 0.00 -1.14 0.00 0.00 41.12 41.14 3i4n n ASP 853 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3i4n n ASN 854 N -1.23 -1.23 -4.87 -1.12 3.02 0.42 -4.91 115.26 105.35 3i4n n ASN 854 Ca 0.05 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.24 3i4n n ASN 854 Cb 0.33 -0.23 -0.06 0.00 -0.61 0.00 0.00 39.78 39.22 3i4n n ASN 854 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3i4n s THR 855 N -2.00 5.20 -0.47 3.41 -1.32 -1.20 -3.66 115.64 115.60 3i4n s THR 855 Ca 0.00 0.43 -0.12 0.00 -1.21 0.00 0.00 61.69 60.79 3i4n s THR 855 Cb 0.00 -3.60 0.09 0.00 -1.51 0.00 0.00 72.50 67.48 3i4n s THR 855 CO 0.00 0.43 0.36 -0.89 -2.21 0.00 0.00 174.62 172.31 3i4n s THR 856 N -1.23 4.67 0.00 5.08 2.01 0.61 -1.12 115.64 125.66 3i4n s THR 856 Ca 0.26 -1.41 0.00 0.00 0.31 0.00 0.00 61.69 60.86 3i4n s THR 856 Cb -0.14 -3.91 0.00 0.00 0.01 0.00 0.00 72.50 68.46 3i4n s THR 856 CO 0.14 -0.65 0.00 0.54 -0.69 0.00 0.00 174.62 173.96 3i4n n ARG 857 N 5.05 2.95 -0.21 4.92 1.74 -1.05 0.50 116.66 130.56 3i4n n ARG 857 Ca -0.11 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 3i4n n ARG 857 Cb 0.42 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.86 3i4n n ARG 857 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3i4n n ASN 858 N 0.00 0.00 0.24 0.55 2.04 -1.25 -2.66 115.26 114.19 3i4n n ASN 858 Ca 0.00 -0.12 0.17 0.00 -0.44 0.00 0.00 54.58 54.18 3i4n n ASN 858 Cb 0.00 0.00 0.86 0.00 -2.53 0.00 0.00 39.78 38.11 3i4n n ASN 858 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 3i4n h SER 859 N 0.00 0.00 0.01 0.53 4.64 -1.81 0.33 113.55 117.26 3i4n h SER 859 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3i4n h SER 859 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3i4n h SER 859 CO 0.00 0.00 -0.46 0.18 -0.87 0.00 0.00 176.83 175.68 3i4n n LEU 860 N -2.67 1.93 0.00 5.97 4.77 -1.26 -4.85 117.00 120.90 3i4n n LEU 860 Ca -0.02 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.26 3i4n n LEU 860 Cb 0.08 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3i4n n LEU 860 CO 0.16 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 3i4n n GLY 861 N 1.41 0.34 3.64 -0.72 0.00 0.12 -4.90 105.19 105.08 3i4n n GLY 861 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 3i4n n GLY 861 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3i4n n ASN 862 N -0.30 3.86 -4.76 1.61 4.13 -1.26 -4.68 115.26 113.86 3i4n n ASN 862 Ca 0.00 0.69 -0.41 0.00 1.68 0.00 0.00 54.58 56.53 3i4n n ASN 862 Cb 0.15 -1.53 -0.00 0.00 -1.54 0.00 0.00 39.78 36.86 3i4n n ASN 862 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 3i4n n VAL 863 N 6.22 1.75 -0.12 2.41 0.31 -1.26 -3.82 118.33 123.82 3i4n n VAL 863 Ca 0.23 -0.44 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 3i4n n VAL 863 Cb 0.41 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.42 3i4n n VAL 863 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3i4n n ILE 864 N 0.84 0.00 -3.48 2.52 5.41 0.18 -4.97 119.36 119.87 3i4n n ILE 864 Ca 0.03 -0.30 0.02 0.00 1.00 0.00 0.00 62.75 63.50 3i4n n ILE 864 Cb 0.38 1.12 -0.05 0.00 -0.71 0.00 0.00 39.64 40.37 3i4n n ILE 864 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 3i4n s GLN 865 N -0.43 0.13 0.20 0.38 -0.21 -1.19 -4.70 119.66 113.85 3i4n s GLN 865 Ca 0.00 0.27 0.01 0.00 0.02 0.00 0.00 55.36 55.66 3i4n s GLN 865 Cb 0.00 0.09 0.14 0.00 1.00 0.00 0.00 33.01 34.24 3i4n s GLN 865 CO 0.00 -0.03 1.49 0.74 -2.12 0.00 0.00 175.29 175.37 3i4n h PHE 866 N 6.15 0.46 -3.16 0.91 -1.00 -1.88 0.18 116.94 118.60 3i4n h PHE 866 Ca -0.21 -0.19 -0.51 0.00 2.81 0.00 0.00 57.97 59.87 3i4n h PHE 866 Cb 1.15 -0.08 -0.40 0.00 3.61 0.00 0.00 35.95 40.23 3i4n h PHE 866 CO 0.19 0.91 -0.76 0.42 -1.61 0.00 0.00 178.31 177.45 3i4n s ILE 867 N -3.71 0.33 -0.20 -0.55 1.09 -1.24 -3.60 121.20 113.31 3i4n s ILE 867 Ca -0.05 -0.52 -0.39 0.00 -1.10 0.00 0.00 60.65 58.59 3i4n s ILE 867 Cb 0.11 -0.95 -0.18 0.00 -1.06 0.00 0.00 42.46 40.39 3i4n s ILE 867 CO 0.82 -0.30 1.18 0.00 -0.10 0.00 0.00 174.94 176.54 3i4n n TYR 868 N 5.12 1.04 -1.29 3.97 9.36 -1.24 0.88 117.16 134.98 3i4n n TYR 868 Ca -0.08 0.99 -0.10 0.00 3.32 0.00 0.00 57.90 62.03 3i4n n TYR 868 Cb 0.47 -1.94 -0.04 0.00 -0.63 0.00 0.00 39.34 37.19 3i4n n TYR 868 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3i4n n GLY 869 N 2.38 1.13 3.80 2.98 0.00 -1.26 1.00 105.19 115.21 3i4n n GLY 869 Ca 0.23 -0.37 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 3i4n n GLY 869 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i4n n GLU 870 N -2.29 -6.28 0.00 1.61 1.02 0.25 -4.64 120.64 110.32 3i4n n GLU 870 Ca -0.10 0.67 0.00 0.00 -0.02 0.00 0.00 57.16 57.71 3i4n n GLU 870 Cb 0.38 -5.60 0.00 0.00 -0.02 0.00 0.00 31.44 26.20 3i4n n GLU 870 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3i4n n ASP 871 N -2.91 0.00 -1.91 1.62 5.75 -0.97 -4.90 116.55 113.24 3i4n n ASP 871 Ca 0.01 -0.00 -0.20 0.00 -0.01 0.00 0.00 54.79 54.59 3i4n n ASP 871 Cb 0.55 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.59 3i4n n ASP 871 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3i4n n GLY 872 N 0.00 0.73 3.66 6.12 0.00 0.28 -4.92 105.19 111.05 3i4n n GLY 872 Ca 0.00 -0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 3i4n n GLY 872 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3i4n s MET 873 N -4.35 3.67 -0.60 1.61 -1.94 -1.25 -0.02 119.30 116.41 3i4n s MET 873 Ca 0.00 -0.35 -0.28 0.00 -1.71 0.00 0.00 55.69 53.35 3i4n s MET 873 Cb 0.00 -3.09 0.01 0.00 2.01 0.00 0.00 34.83 33.77 3i4n s MET 873 CO 0.00 0.42 1.41 0.34 -0.01 0.00 0.00 175.02 177.18 3i4n s ASP 874 N -0.07 6.08 0.00 3.03 -1.08 -0.93 -4.73 116.67 118.97 3i4n s ASP 874 Ca 0.06 0.14 0.00 0.00 -0.52 0.00 0.00 52.55 52.22 3i4n s ASP 874 Cb -0.12 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.79 3i4n s ASP 874 CO 0.01 -1.78 0.00 0.00 0.52 0.00 0.00 175.17 173.93 3i4n n ALA 875 N 9.74 0.00 -0.33 3.66 0.00 -1.26 -0.84 120.51 131.48 3i4n n ALA 875 Ca 0.11 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.69 3i4n n ALA 875 Cb 0.49 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.28 3i4n n ALA 875 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n h ALA 876 N 0.00 1.61 -0.28 0.00 0.00 -1.84 -3.06 119.26 115.69 3i4n h ALA 876 Ca 0.00 0.12 -0.53 0.00 0.00 0.00 0.00 54.91 54.50 3i4n h ALA 876 Cb 0.00 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 3i4n h ALA 876 CO 0.00 -0.23 1.68 0.72 0.00 0.00 0.00 179.25 181.42 3i4n n HIS 877 N -4.91 1.68 -3.87 0.00 8.25 -0.02 -4.82 115.22 111.55 3i4n n HIS 877 Ca 0.24 -2.38 -0.11 0.00 -0.26 0.00 0.00 57.72 55.21 3i4n n HIS 877 Cb 0.65 -1.86 -0.11 0.00 1.12 0.00 0.00 29.99 29.79 3i4n n HIS 877 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3i4n s ILE 878 N 0.06 0.05 0.00 1.59 1.01 -1.16 -4.02 121.20 118.74 3i4n s ILE 878 Ca 0.63 -0.44 -0.11 0.00 0.00 0.00 0.00 60.65 60.72 3i4n s ILE 878 Cb 0.26 -0.31 0.01 0.00 0.01 0.00 0.00 42.46 42.43 3i4n s ILE 878 CO -0.09 -0.24 0.23 -1.61 0.00 0.00 0.00 174.94 173.22 3i4n s GLU 879 N -0.81 0.61 -0.80 2.79 2.02 -1.16 -4.77 118.70 116.58 3i4n s GLU 879 Ca -0.09 -0.35 -0.25 0.00 0.02 0.00 0.00 54.97 54.30 3i4n s GLU 879 Cb -0.05 0.26 -0.06 0.00 0.10 0.00 0.00 34.13 34.38 3i4n s GLU 879 CO 0.01 -0.16 2.02 0.15 0.02 0.00 0.00 175.26 177.29 3i4n s LYS 880 N -1.57 2.41 0.30 1.61 1.02 -1.25 -2.29 119.74 119.97 3i4n s LYS 880 Ca -0.13 0.10 -0.01 0.00 0.02 0.00 0.00 55.97 55.96 3i4n s LYS 880 Cb -0.05 -4.85 -0.04 0.00 -0.52 0.00 0.00 37.83 32.37 3i4n s LYS 880 CO 0.02 -3.39 0.51 -0.65 -0.92 0.00 0.00 175.35 170.93 3i4n s GLN 881 N 7.35 3.52 -0.22 1.68 -0.21 -0.41 -4.76 119.66 126.62 3i4n s GLN 881 Ca 0.74 -0.27 -0.09 0.00 0.02 0.00 0.00 55.36 55.76 3i4n s GLN 881 Cb -0.09 -2.70 -0.04 0.00 1.00 0.00 0.00 33.01 31.17 3i4n s GLN 881 CO 0.07 0.22 0.11 0.45 -2.12 0.00 0.00 175.29 174.02 3i4n s SER 882 N -3.66 5.79 -1.25 5.90 0.15 -1.26 -1.92 113.70 117.44 3i4n s SER 882 Ca 0.40 0.05 -0.15 0.00 0.70 0.00 0.00 55.95 56.95 3i4n s SER 882 Cb -0.10 -2.03 0.13 0.00 -1.71 0.00 0.00 66.02 62.31 3i4n s SER 882 CO 0.33 0.09 1.58 0.18 1.20 0.00 0.00 173.24 176.62 3i4n n LEU 883 N 4.13 5.13 -0.26 3.45 4.77 -0.14 -4.86 117.00 129.23 3i4n n LEU 883 Ca -0.16 -4.23 0.06 0.00 -0.03 0.00 0.00 56.01 51.65 3i4n n LEU 883 Cb 0.52 -1.67 0.17 0.00 -2.33 0.00 0.00 43.42 40.11 3i4n n LEU 883 CO 0.34 0.49 0.85 0.44 -1.33 0.00 0.00 177.39 178.18 3i4n h ASP 884 N 7.29 -0.28 0.00 -1.43 3.32 -1.93 -2.20 116.42 121.20 3i4n h ASP 884 Ca 0.38 0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.62 3i4n h ASP 884 Cb 0.87 0.32 0.00 0.00 0.22 0.00 0.00 39.33 40.74 3i4n h ASP 884 CO 1.35 -0.16 0.06 0.41 -1.72 0.00 0.00 179.24 179.17 3i4n n THR 885 N -5.31 0.30 -0.09 0.35 -1.04 -1.26 -3.35 114.28 103.88 3i4n n THR 885 Ca 0.14 0.13 -0.10 0.00 -2.04 0.00 0.00 64.05 62.19 3i4n n THR 885 Cb 0.49 -1.13 -0.03 0.00 -1.82 0.00 0.00 70.33 67.84 3i4n n THR 885 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i4n n ILE 886 N -0.92 1.50 -3.42 12.58 3.06 -0.83 -4.10 119.36 127.23 3i4n n ILE 886 Ca 0.00 0.11 -0.27 0.00 -2.50 0.00 0.00 62.75 60.10 3i4n n ILE 886 Cb 0.06 -2.33 -0.02 0.00 0.54 0.00 0.00 39.64 37.89 3i4n n ILE 886 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 3i4n s GLY 887 N -4.93 1.67 0.00 4.50 0.00 -1.21 -4.93 107.32 102.42 3i4n s GLY 887 Ca -0.29 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 43.70 3i4n s GLY 887 CO 0.43 -0.65 0.00 0.61 0.00 0.00 0.00 173.10 173.49 3i4n n GLY 888 N -1.16 3.76 3.42 0.20 0.00 -1.26 -4.97 105.19 105.18 3i4n n GLY 888 Ca -0.03 -1.45 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 3i4n n GLY 888 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i4n n SER 889 N 0.00 -1.32 0.30 1.61 3.41 -1.26 -3.95 113.62 112.41 3i4n n SER 889 Ca 0.00 0.87 0.19 0.00 -0.26 0.00 0.00 58.87 59.67 3i4n n SER 889 Cb 0.00 -1.07 1.01 0.00 -0.26 0.00 0.00 64.21 63.89 3i4n n SER 889 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3i4n h ASP 890 N 0.64 0.00 0.00 4.04 3.32 -1.77 -2.24 116.42 120.42 3i4n h ASP 890 Ca -0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.65 3i4n h ASP 890 Cb 1.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.96 3i4n h ASP 890 CO 0.50 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 178.02 3i4n n ALA 891 N -2.15 -0.30 -0.24 3.45 0.00 -1.26 -3.59 120.51 116.41 3i4n n ALA 891 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.42 3i4n n ALA 891 Cb 0.18 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.67 3i4n n ALA 891 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n n ALA 892 N -1.59 -0.05 -0.36 0.00 0.00 -0.86 0.81 120.51 118.46 3i4n n ALA 892 Ca 0.00 0.63 0.04 0.00 0.00 0.00 0.00 53.44 54.11 3i4n n ALA 892 Cb 0.00 -0.29 0.11 0.00 0.00 0.00 0.00 19.45 19.27 3i4n n ALA 892 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3i4n n PHE 893 N -4.94 0.27 0.43 0.00 7.35 -1.08 -1.23 117.46 118.27 3i4n n PHE 893 Ca 0.07 1.19 -0.17 0.00 -0.76 0.00 0.00 57.45 57.78 3i4n n PHE 893 Cb 0.26 -1.02 -0.08 0.00 0.35 0.00 0.00 39.48 38.99 3i4n n PHE 893 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 3i4n h GLU 894 N 0.00 -1.07 0.00 -4.13 5.08 0.34 -0.26 114.58 114.54 3i4n h GLU 894 Ca 0.44 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.87 3i4n h GLU 894 Cb 0.68 0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.17 3i4n h GLU 894 CO -1.00 -0.72 0.68 -0.22 -1.00 0.00 0.00 179.01 176.76 3i4n h LYS 895 N -1.11 0.00 0.00 2.33 3.64 -1.09 -0.91 116.57 119.42 3i4n h LYS 895 Ca -0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 3i4n h LYS 895 Cb 0.86 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 3i4n h LYS 895 CO 0.16 0.00 0.00 -2.13 -2.27 0.00 0.00 179.45 175.21 3i4n n ARG 896 N -2.60 0.00 0.12 1.90 0.63 -0.73 -4.77 116.66 111.21 3i4n n ARG 896 Ca -0.01 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 57.05 3i4n n ARG 896 Cb 0.70 -0.39 0.44 0.00 0.45 0.00 0.00 32.46 33.67 3i4n n ARG 896 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3i4n n TYR 897 N -2.28 0.90 -2.61 -0.14 4.02 -0.15 -4.43 117.16 112.48 3i4n n TYR 897 Ca 0.00 0.30 -0.41 0.00 -0.01 0.00 0.00 57.90 57.77 3i4n n TYR 897 Cb 0.00 -0.98 -0.04 0.00 -0.02 0.00 0.00 39.34 38.30 3i4n n TYR 897 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 3i4n s ARG 898 N -3.19 4.62 -0.08 -0.72 6.06 -0.36 -4.68 118.95 120.60 3i4n s ARG 898 Ca 0.08 1.60 -0.03 0.00 -2.50 0.00 0.00 55.73 54.88 3i4n s ARG 898 Cb 0.11 -3.33 0.04 0.00 0.06 0.00 0.00 34.95 31.83 3i4n s ARG 898 CO 0.52 0.10 0.12 0.08 -2.50 0.00 0.00 175.30 173.62 3i4n s VAL 899 N 0.02 -0.19 -0.33 7.11 1.01 -1.26 -4.92 120.40 121.83 3i4n s VAL 899 Ca 0.49 0.33 0.04 0.00 0.00 0.00 0.00 61.98 62.84 3i4n s VAL 899 Cb -0.26 -0.27 0.10 0.00 0.00 0.00 0.00 36.38 35.94 3i4n s VAL 899 CO 0.32 0.12 0.04 -0.62 0.00 0.00 0.00 175.10 174.96 3i4n s ASP 900 N 2.24 4.68 0.00 3.32 -1.08 -0.33 -4.84 116.67 120.66 3i4n s ASP 900 Ca 0.04 -2.05 0.15 0.00 -0.52 0.00 0.00 52.55 50.16 3i4n s ASP 900 Cb -0.12 -1.57 0.87 0.00 -1.46 0.00 0.00 42.92 40.64 3i4n s ASP 900 CO -0.05 -0.37 1.29 0.18 0.52 0.00 0.00 175.17 176.75 3i4n n LEU 901 N 4.31 0.00 -2.88 -1.34 4.77 -1.26 -1.57 117.00 119.03 3i4n n LEU 901 Ca 0.02 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.70 3i4n n LEU 901 Cb 0.42 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 3i4n n LEU 901 CO 0.21 0.00 0.44 0.18 -1.33 0.00 0.00 177.39 176.89 3i4n n LEU 902 N -0.91 5.18 -3.62 2.23 4.77 -1.26 0.31 117.00 123.70 3i4n n LEU 902 Ca 0.11 -5.43 -0.06 0.00 -0.03 0.00 0.00 56.01 50.60 3i4n n LEU 902 Cb 0.05 -0.65 -0.05 0.00 -2.33 0.00 0.00 43.42 40.44 3i4n n LEU 902 CO 0.08 2.23 0.99 0.21 -1.33 0.00 0.00 177.39 179.57 3i4n s ASN 903 N -3.03 -0.19 0.00 -1.43 3.04 -1.16 -4.99 114.94 107.18 3i4n s ASN 903 Ca 0.48 0.26 0.28 0.00 0.04 0.00 0.00 52.86 53.92 3i4n s ASN 903 Cb 0.32 0.23 1.02 0.00 -1.54 0.00 0.00 41.25 41.28 3i4n s ASN 903 CO -0.18 -0.14 1.73 0.41 -3.04 0.00 0.00 177.10 175.88 3i4n n THR 904 N 0.96 0.00 0.00 -5.21 -1.04 -1.26 -3.02 114.28 104.71 3i4n n THR 904 Ca -0.06 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.82 3i4n n THR 904 Cb 0.58 0.21 0.00 0.00 -1.82 0.00 0.00 70.33 69.29 3i4n n THR 904 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3i4n n ASP 905 N -0.62 4.07 -0.12 8.00 8.00 -1.26 -4.80 116.55 129.82 3i4n n ASP 905 Ca 0.15 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.70 3i4n n ASP 905 Cb 0.31 0.80 -0.03 0.00 -0.02 0.00 0.00 41.12 42.18 3i4n n ASP 905 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3i4n n HIS 906 N -1.24 0.00 -1.60 1.24 8.25 -1.26 -5.01 115.22 115.61 3i4n n HIS 906 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.17 3i4n n HIS 906 Cb 0.01 0.00 0.14 0.00 1.12 0.00 0.00 29.99 31.27 3i4n n HIS 906 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3i4n s THR 907 N -1.67 1.97 0.05 1.59 -1.32 -0.61 -1.18 115.64 114.47 3i4n s THR 907 Ca 0.06 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.26 3i4n s THR 907 Cb 0.08 -2.79 -0.05 0.00 -1.51 0.00 0.00 72.50 68.23 3i4n s THR 907 CO 0.33 0.00 0.91 -0.76 -2.21 0.00 0.00 174.62 172.89 3i4n s LEU 908 N -6.03 4.43 0.00 9.08 1.43 -1.26 -4.83 118.68 121.51 3i4n s LEU 908 Ca 0.65 1.63 -0.30 0.00 -1.03 0.00 0.00 54.13 55.09 3i4n s LEU 908 Cb -0.12 -3.47 -0.06 0.00 0.03 0.00 0.00 46.19 42.56 3i4n s LEU 908 CO 0.53 -0.12 1.52 -0.62 0.23 0.00 0.00 176.35 177.89 3i4n s ASP 909 N 0.38 6.75 0.00 2.29 -1.08 -1.26 -4.73 116.67 119.01 3i4n s ASP 909 Ca 0.46 2.23 0.00 0.00 -0.52 0.00 0.00 52.55 54.72 3i4n s ASP 909 Cb -0.22 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 38.69 3i4n s ASP 909 CO 0.27 -0.81 0.30 -0.81 0.52 0.00 0.00 175.17 174.64 3i4n n PRO 910 N 5.80 0.00 0.09 4.34 -0.04 -1.26 -0.71 135.00 143.21 3i4n n PRO 910 Ca 0.15 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.59 3i4n n PRO 910 Cb 0.43 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 32.39 3i4n n PRO 910 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3i4n h SER 911 N 0.00 0.00 0.05 3.54 4.64 -1.97 -3.34 113.55 116.47 3i4n h SER 911 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 3i4n h SER 911 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3i4n h SER 911 CO 0.00 0.71 -0.65 -0.07 -0.87 0.00 0.00 176.83 175.95 3i4n h LEU 912 N 0.00 0.16 -9.54 5.97 3.38 -1.28 -3.30 115.31 110.69 3i4n h LEU 912 Ca -0.05 -0.87 -0.66 0.00 0.09 0.00 0.00 57.88 56.40 3i4n h LEU 912 Cb 1.59 -0.05 -0.10 0.00 0.09 0.00 0.00 40.66 42.18 3i4n h LEU 912 CO 0.08 1.28 -0.58 -0.22 0.09 0.00 0.00 178.44 179.09 3i4n s LEU 913 N -7.97 3.86 -0.06 1.67 2.96 -1.24 -0.09 118.68 117.82 3i4n s LEU 913 Ca -0.20 0.14 -0.25 0.00 -0.22 0.00 0.00 54.13 53.59 3i4n s LEU 913 Cb 0.01 -2.24 -0.23 0.00 0.50 0.00 0.00 46.19 44.23 3i4n s LEU 913 CO 0.71 0.28 1.03 -0.08 -1.32 0.00 0.00 176.35 176.97 3i4n h GLU 914 N 4.15 0.13 -0.39 1.98 4.81 -1.76 -2.92 114.58 120.57 3i4n h GLU 914 Ca -0.49 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 58.60 3i4n h GLU 914 Cb 1.18 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.60 3i4n h GLU 914 CO 0.62 0.87 0.00 -1.13 -0.73 0.00 0.00 179.01 178.64 3i4n n SER 915 N -4.56 0.39 0.00 1.04 3.41 -1.26 -4.71 113.62 107.93 3i4n n SER 915 Ca -0.09 -1.83 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 3i4n n SER 915 Cb 0.47 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 3i4n n SER 915 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i4n n GLY 916 N 0.25 0.00 0.28 5.00 0.00 -1.10 -3.18 105.19 106.44 3i4n n GLY 916 Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 46.02 46.27 3i4n n GLY 916 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i4n n SER 917 N 0.00 0.19 -0.08 1.61 3.41 -1.26 0.57 113.62 118.06 3i4n n SER 917 Ca 0.00 1.04 0.00 0.00 -0.26 0.00 0.00 58.87 59.65 3i4n n SER 917 Cb 0.00 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 3i4n n SER 917 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3i4n n GLU 918 N -4.28 0.53 -0.01 4.33 0.28 -1.19 -2.36 120.64 117.93 3i4n n GLU 918 Ca 0.27 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 57.27 3i4n n GLU 918 Cb 1.00 -1.04 -0.03 0.00 1.43 0.00 0.00 31.44 32.79 3i4n n GLU 918 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 3i4n n ILE 919 N -0.38 0.16 -1.56 3.84 5.41 0.19 -4.97 119.36 122.07 3i4n n ILE 919 Ca 0.00 -0.15 -0.61 0.00 1.00 0.00 0.00 62.75 63.00 3i4n n ILE 919 Cb 0.02 -0.33 -0.08 0.00 -0.71 0.00 0.00 39.64 38.54 3i4n n ILE 919 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3i4n n LEU 920 N -1.94 0.31 0.00 1.39 4.77 -1.00 -0.93 117.00 119.60 3i4n n LEU 920 Ca -0.04 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 57.10 3i4n n LEU 920 Cb 0.41 -0.92 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 3i4n n LEU 920 CO 0.09 -1.65 0.00 0.61 -1.33 0.00 0.00 177.39 175.11 3i4n n GLY 921 N 2.07 1.89 3.06 -0.72 0.00 0.93 -4.94 105.19 107.48 3i4n n GLY 921 Ca 0.22 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 3i4n n GLY 921 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3i4n n ASP 922 N 1.54 -0.35 0.26 1.61 -0.08 -0.11 -4.72 116.55 114.70 3i4n n ASP 922 Ca 0.00 -0.09 0.15 0.00 -1.51 0.00 0.00 54.79 53.34 3i4n n ASP 922 Cb 0.00 -0.67 0.64 0.00 2.34 0.00 0.00 41.12 43.42 3i4n n ASP 922 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 3i4n h LEU 923 N 10.16 0.00 -1.37 -2.67 3.38 -1.92 -2.76 115.31 120.12 3i4n h LEU 923 Ca -0.01 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 3i4n h LEU 923 Cb 1.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 3i4n h LEU 923 CO 1.30 0.08 -0.30 0.11 0.09 0.00 0.00 178.44 179.72 3i4n h LYS 924 N 0.00 0.00 0.10 1.13 1.57 -1.98 -2.82 116.57 114.56 3i4n h LYS 924 Ca -0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.49 3i4n h LYS 924 Cb 0.55 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 3i4n h LYS 924 CO 0.01 0.30 -1.44 -0.07 -0.57 0.00 0.00 179.45 177.68 3i4n h LEU 925 N 0.00 0.32 0.00 2.94 3.38 -1.87 -3.22 115.31 116.86 3i4n h LEU 925 Ca -0.00 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3i4n h LEU 925 Cb 0.61 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3i4n h LEU 925 CO 0.04 1.35 0.00 0.00 0.09 0.00 0.00 178.44 179.92 3i4n n GLN 926 N -3.42 0.21 -0.09 1.13 1.13 -1.08 -0.11 117.38 115.15 3i4n n GLN 926 Ca -0.13 0.15 -0.17 0.00 -1.94 0.00 0.00 57.00 54.90 3i4n n GLN 926 Cb 1.03 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 29.76 3i4n n GLN 926 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3i4n h VAL 927 N 0.00 1.34 0.21 5.09 2.07 -1.54 -2.55 116.25 120.87 3i4n h VAL 927 Ca 0.00 -2.23 -0.01 0.00 0.82 0.00 0.00 66.70 65.28 3i4n h VAL 927 Cb 0.11 2.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 3i4n h VAL 927 CO 0.00 0.46 -0.10 -0.07 0.02 0.00 0.00 177.57 177.88 3i4n h LEU 928 N -1.00 -0.24 -1.99 2.57 3.38 -1.48 0.16 115.31 116.72 3i4n h LEU 928 Ca -0.16 -0.06 0.13 0.00 0.09 0.00 0.00 57.88 57.89 3i4n h LEU 928 Cb 1.11 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 3i4n h LEU 928 CO -0.09 -0.09 0.44 0.25 0.09 0.00 0.00 178.44 179.04 3i4n h LEU 929 N -0.37 0.00 0.00 1.67 7.12 -0.66 0.39 115.31 123.46 3i4n h LEU 929 Ca -0.03 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 57.98 3i4n h LEU 929 Cb 0.28 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.41 3i4n h LEU 929 CO 0.05 0.00 -0.16 0.44 -0.13 0.00 0.00 178.44 178.64 3i4n h ASP 930 N 0.00 0.00 -1.05 1.25 3.32 -0.86 -2.93 116.42 116.15 3i4n h ASP 930 Ca 0.22 -0.02 0.39 0.00 0.02 0.00 0.00 57.03 57.63 3i4n h ASP 930 Cb 1.10 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.49 3i4n h ASP 930 CO -0.00 0.59 0.60 -0.33 -1.72 0.00 0.00 179.24 178.38 3i4n h GLU 931 N -1.00 0.12 0.52 3.56 5.08 -0.01 1.12 114.58 123.96 3i4n h GLU 931 Ca -0.00 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3i4n h GLU 931 Cb 0.18 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 3i4n h GLU 931 CO -0.00 0.08 -0.32 1.49 -1.00 0.00 0.00 179.01 179.26 3i4n h GLU 932 N 0.12 -0.75 -0.44 2.33 4.81 -1.05 0.37 114.58 119.98 3i4n h GLU 932 Ca 0.81 0.05 0.11 0.00 -0.13 0.00 0.00 59.36 60.20 3i4n h GLU 932 Cb 2.11 0.17 -0.02 0.00 0.63 0.00 0.00 28.75 31.64 3i4n h GLU 932 CO -0.66 -0.50 0.31 -0.92 -0.73 0.00 0.00 179.01 176.51 3i4n h TYR 933 N -0.78 0.08 -0.16 0.92 3.20 0.57 0.07 116.97 120.87 3i4n h TYR 933 Ca -0.07 0.00 -0.22 0.00 3.14 0.00 0.00 58.73 61.59 3i4n h TYR 933 Cb 0.62 -0.02 0.01 0.00 1.54 0.00 0.00 36.73 38.88 3i4n h TYR 933 CO -0.02 0.03 -0.76 0.87 -1.64 0.00 0.00 178.16 176.64 3i4n h LYS 934 N 0.07 0.76 -0.45 1.82 1.57 0.13 -2.30 116.57 118.18 3i4n h LYS 934 Ca 0.21 -0.61 -0.11 0.00 -1.87 0.00 0.00 60.65 58.26 3i4n h LYS 934 Cb 0.73 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 3i4n h LYS 934 CO -0.02 1.22 -0.15 0.37 -0.57 0.00 0.00 179.45 180.31 3i4n h GLN 935 N 0.53 0.90 -0.54 3.15 5.75 0.95 -2.18 115.11 123.66 3i4n h GLN 935 Ca -0.05 -0.36 -0.04 0.00 -0.15 0.00 0.00 58.65 58.05 3i4n h GLN 935 Cb 1.38 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.86 3i4n h GLN 935 CO 0.15 1.01 0.19 -0.07 -2.65 0.00 0.00 178.83 177.46 3i4n h LEU 936 N 0.73 0.74 -0.66 -2.39 3.38 -1.00 -2.05 115.31 114.06 3i4n h LEU 936 Ca 0.11 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 3i4n h LEU 936 Cb 0.71 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3i4n h LEU 936 CO 0.05 0.69 -0.20 0.58 0.09 0.00 0.00 178.44 179.65 3i4n h VAL 937 N 0.79 1.27 -0.82 1.22 2.07 -1.19 -1.18 116.25 118.40 3i4n h VAL 937 Ca 0.18 -1.32 0.05 0.00 0.82 0.00 0.00 66.70 66.43 3i4n h VAL 937 Cb 0.21 1.15 -0.06 0.00 -1.52 0.00 0.00 31.29 31.07 3i4n h VAL 937 CO -0.01 0.45 0.51 0.50 0.02 0.00 0.00 177.57 179.04 3i4n h LYS 938 N 0.73 0.93 0.60 1.57 3.64 -0.85 -2.26 116.57 120.93 3i4n h LYS 938 Ca 0.10 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 3i4n h LYS 938 Cb 0.73 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.32 3i4n h LYS 938 CO 0.06 0.62 -0.51 -0.44 -2.27 0.00 0.00 179.45 176.90 3i4n h ASP 939 N 0.96 -1.37 -0.72 4.20 5.19 -0.71 0.17 116.42 124.14 3i4n h ASP 939 Ca 0.35 0.10 0.10 0.00 -0.62 0.00 0.00 57.03 56.96 3i4n h ASP 939 Cb 0.11 0.44 -0.11 0.00 0.18 0.00 0.00 39.33 39.95 3i4n h ASP 939 CO -0.15 -0.70 -0.31 -1.14 -3.12 0.00 0.00 179.24 173.81 3i4n n ARG 940 N -5.59 -0.20 0.09 3.56 3.00 -0.51 0.22 116.66 117.24 3i4n n ARG 940 Ca -0.13 1.11 0.13 0.00 -0.00 0.00 0.00 57.85 58.96 3i4n n ARG 940 Cb 0.48 -1.64 0.45 0.00 0.00 0.00 0.00 32.46 31.75 3i4n n ARG 940 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 3i4n n LYS 941 N -5.03 0.21 0.03 -0.14 4.76 -1.07 -1.94 118.16 114.98 3i4n n LYS 941 Ca 0.06 0.22 -0.02 0.00 -2.87 0.00 0.00 58.31 55.70 3i4n n LYS 941 Cb 0.27 -1.76 -0.01 0.00 -1.84 0.00 0.00 35.03 31.69 3i4n n LYS 941 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 3i4n h PHE 942 N 0.00 -0.12 -0.59 2.13 -0.00 0.49 -3.07 116.94 115.78 3i4n h PHE 942 Ca 0.00 -0.00 0.12 0.00 -0.00 0.00 0.00 57.97 58.09 3i4n h PHE 942 Cb 0.63 0.04 -0.10 0.00 -0.00 0.00 0.00 35.95 36.52 3i4n h PHE 942 CO 0.00 -0.07 -0.02 -0.07 -0.00 0.00 0.00 178.31 178.15 3i4n h LEU 943 N -0.55 -0.29 0.00 0.59 3.38 -0.92 0.83 115.31 118.35 3i4n h LEU 943 Ca -0.01 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3i4n h LEU 943 Cb 0.10 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3i4n h LEU 943 CO 0.02 -0.12 0.00 0.54 0.09 0.00 0.00 178.44 178.98 3i4n n ARG 944 N -5.29 0.01 -0.04 1.13 1.74 -0.82 0.52 116.66 113.91 3i4n n ARG 944 Ca 0.08 0.40 0.03 0.00 -0.77 0.00 0.00 57.85 57.58 3i4n n ARG 944 Cb 0.33 -1.50 -0.16 0.00 -1.02 0.00 0.00 32.46 30.12 3i4n n ARG 944 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3i4n n GLU 945 N -1.42 0.73 -0.07 5.56 2.13 0.28 -4.07 120.64 123.77 3i4n n GLU 945 Ca 0.01 -0.12 -0.15 0.00 0.66 0.00 0.00 57.16 57.56 3i4n n GLU 945 Cb 0.02 -1.49 -0.14 0.00 0.27 0.00 0.00 31.44 30.11 3i4n n GLU 945 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3i4n n VAL 946 N -2.39 1.55 -3.59 6.31 0.31 -0.32 -4.62 118.33 115.57 3i4n n VAL 946 Ca -0.14 -0.70 -0.37 0.00 -0.01 0.00 0.00 64.34 63.12 3i4n n VAL 946 Cb 0.75 -1.18 -0.06 0.00 -0.91 0.00 0.00 33.84 32.45 3i4n n VAL 946 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3i4n n PHE 947 N -3.14 4.29 0.17 3.52 3.01 0.18 -4.90 117.46 120.59 3i4n n PHE 947 Ca -0.35 -4.08 0.13 0.00 1.01 0.00 0.00 57.45 54.17 3i4n n PHE 947 Cb 1.06 -1.19 0.68 0.00 -0.01 0.00 0.00 39.48 40.02 3i4n n PHE 947 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3i4n h VAL 948 N 3.96 0.85 0.22 -4.37 2.07 -1.80 -2.34 116.25 114.83 3i4n h VAL 948 Ca 0.17 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.70 3i4n h VAL 948 Cb 0.81 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 3i4n h VAL 948 CO 0.89 0.00 -0.35 0.44 0.02 0.00 0.00 177.57 178.56 3i4n h ASP 949 N 0.00 -1.00 0.00 0.57 3.32 -1.90 -3.47 116.42 113.95 3i4n h ASP 949 Ca 0.09 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3i4n h ASP 949 Cb 0.38 0.36 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3i4n h ASP 949 CO -0.00 -0.46 0.00 0.61 -1.72 0.00 0.00 179.24 177.67 3i4n n GLY 950 N -1.45 0.92 2.58 2.75 0.00 -0.88 -4.66 105.19 104.46 3i4n n GLY 950 Ca -0.08 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.47 3i4n n GLY 950 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3i4n n GLU 951 N 0.00 0.00 0.00 1.61 4.07 -1.26 -4.56 120.64 120.49 3i4n n GLU 951 Ca 0.00 0.00 0.07 0.00 -0.06 0.00 0.00 57.16 57.17 3i4n n GLU 951 Cb 0.00 -1.04 -0.01 0.00 -0.06 0.00 0.00 31.44 30.33 3i4n n GLU 951 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3i4n n ALA 952 N 2.87 3.19 -2.55 4.31 0.00 -1.26 -4.93 120.51 122.13 3i4n n ALA 952 Ca 0.22 -0.48 -0.41 0.00 0.00 0.00 0.00 53.44 52.77 3i4n n ALA 952 Cb -0.04 -0.50 -0.09 0.00 0.00 0.00 0.00 19.45 18.82 3i4n n ALA 952 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3i4n s ASN 953 N -1.82 6.20 0.17 0.00 0.01 -1.26 -0.96 114.94 117.28 3i4n s ASN 953 Ca 0.11 -0.18 0.00 0.00 -0.71 0.00 0.00 52.86 52.08 3i4n s ASN 953 Cb 0.11 -2.21 -0.04 0.00 0.41 0.00 0.00 41.25 39.52 3i4n s ASN 953 CO 0.39 -0.35 0.05 0.26 -1.51 0.00 0.00 177.10 175.93 3i4n s TRP 954 N 2.08 1.09 -0.16 2.20 0.52 -0.81 -4.94 118.94 118.92 3i4n s TRP 954 Ca 0.13 -1.17 -0.29 0.00 0.02 0.00 0.00 56.10 54.79 3i4n s TRP 954 Cb -0.16 -0.61 -0.01 0.00 -1.15 0.00 0.00 33.47 31.53 3i4n s TRP 954 CO 0.12 -0.40 1.21 -1.25 0.02 0.00 0.00 176.95 176.65 3i4n s PRO 955 N -4.01 4.26 -0.14 4.98 0.04 -1.26 -1.28 135.00 137.58 3i4n s PRO 955 Ca 0.27 1.61 -0.13 0.00 0.04 0.00 0.00 61.00 62.79 3i4n s PRO 955 Cb 0.07 -3.71 0.04 0.00 0.04 0.00 0.00 34.50 30.94 3i4n s PRO 955 CO 0.05 -0.65 0.38 -0.51 0.04 0.00 0.00 177.00 176.31 3i4n s LEU 956 N 3.22 0.51 0.72 -3.56 1.43 -0.97 -4.92 118.68 115.12 3i4n s LEU 956 Ca 0.53 0.77 -0.15 0.00 -1.03 0.00 0.00 54.13 54.25 3i4n s LEU 956 Cb -0.21 1.31 0.03 0.00 0.03 0.00 0.00 46.19 47.35 3i4n s LEU 956 CO 0.14 -0.14 1.18 -2.16 0.23 0.00 0.00 176.35 175.61 3i4n s PRO 957 N 0.26 2.27 -0.21 1.29 0.04 -1.26 -2.97 135.00 134.43 3i4n s PRO 957 Ca -0.01 1.67 -0.08 0.00 0.04 0.00 0.00 61.00 62.63 3i4n s PRO 957 Cb -0.03 -1.86 0.03 0.00 0.04 0.00 0.00 34.50 32.68 3i4n s PRO 957 CO -0.00 -1.71 0.16 0.28 0.04 0.00 0.00 177.00 175.76 3i4n n VAL 958 N -2.67-11.82 -2.38 -0.36 0.31 -1.26 -4.88 118.33 95.27 3i4n n VAL 958 Ca 0.13 2.28 -0.43 0.00 -0.01 0.00 0.00 64.34 66.31 3i4n n VAL 958 Cb 0.51 -6.44 -0.02 0.00 -0.91 0.00 0.00 33.84 26.97 3i4n n VAL 958 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3i4n s ASN 959 N -0.91 6.93 -0.07 4.52 2.47 -1.26 -4.90 114.94 121.72 3i4n s ASN 959 Ca -0.18 1.79 0.07 0.00 0.42 0.00 0.00 52.86 54.96 3i4n s ASN 959 Cb 0.01 -2.54 -0.24 0.00 -1.45 0.00 0.00 41.25 37.03 3i4n s ASN 959 CO 0.73 -0.75 0.56 -0.38 -3.72 0.00 0.00 177.10 173.54 3i4n n ILE 960 N 5.22 1.66 -0.07 -5.21 5.41 -1.26 -2.94 119.36 122.16 3i4n n ILE 960 Ca 0.14 -0.75 -0.07 0.00 1.00 0.00 0.00 62.75 63.06 3i4n n ILE 960 Cb 0.45 -1.24 -0.01 0.00 -0.71 0.00 0.00 39.64 38.13 3i4n n ILE 960 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 3i4n h ARG 961 N 0.02 -0.04 -0.01 0.38 2.43 -2.00 -1.91 114.38 113.25 3i4n h ARG 961 Ca -0.33 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 58.70 3i4n h ARG 961 Cb 2.03 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 31.57 3i4n h ARG 961 CO 0.08 -0.03 -0.64 0.00 -1.51 0.00 0.00 179.97 177.87 3i4n h ARG 962 N -0.05 0.03 0.00 0.20 3.08 -1.97 0.38 114.38 116.05 3i4n h ARG 962 Ca 0.14 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.17 3i4n h ARG 962 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 3i4n h ARG 962 CO -0.32 0.66 0.00 0.97 -1.07 0.00 0.00 179.97 180.21 3i4n h ILE 963 N 0.02 0.00 0.00 2.04 2.10 -1.25 -0.73 117.51 119.69 3i4n h ILE 963 Ca -0.01 -0.23 -0.39 0.00 1.08 0.00 0.00 64.86 65.31 3i4n h ILE 963 Cb 1.13 1.14 -0.07 0.00 -1.09 0.00 0.00 36.82 37.93 3i4n h ILE 963 CO 0.09 0.00 -2.47 -0.38 -1.08 0.00 0.00 178.15 174.31 3i4n n ILE 964 N -2.90 1.50 -0.36 2.19 5.41 -0.83 -3.51 119.36 120.86 3i4n n ILE 964 Ca -0.01 -0.56 0.29 0.00 1.00 0.00 0.00 62.75 63.47 3i4n n ILE 964 Cb 0.18 -1.47 0.59 0.00 -0.71 0.00 0.00 39.64 38.23 3i4n n ILE 964 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 3i4n h GLN 965 N -0.08 0.23 0.18 0.38 4.20 0.45 0.97 115.11 121.46 3i4n h GLN 965 Ca -0.58 -0.01 -0.26 0.00 0.06 0.00 0.00 58.65 57.86 3i4n h GLN 965 Cb 1.88 -0.05 0.03 0.00 0.30 0.00 0.00 27.48 29.63 3i4n h GLN 965 CO -0.11 0.15 -1.16 -0.91 -0.67 0.00 0.00 178.83 176.14 3i4n h ASN 966 N 0.24 0.61 -1.07 1.46 2.35 -1.34 -3.21 115.58 114.62 3i4n h ASN 966 Ca 0.65 -0.93 0.31 0.00 -0.55 0.00 0.00 56.30 55.78 3i4n h ASN 966 Cb 1.95 -0.20 -0.12 0.00 0.05 0.00 0.00 38.32 40.00 3i4n h ASN 966 CO -0.27 1.55 0.65 0.00 -1.65 0.00 0.00 177.43 177.71 3i4n h ALA 967 N 0.09 2.14 -3.00 -0.83 0.00 0.71 -1.22 119.26 117.15 3i4n h ALA 967 Ca -0.21 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3i4n h ALA 967 Cb 1.87 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.76 3i4n h ALA 967 CO 0.19 -0.67 0.00 1.04 0.00 0.00 0.00 179.25 179.81 3i4n n GLN 968 N -4.83 0.00 0.07 0.00 1.13 0.11 -3.25 117.38 110.61 3i4n n GLN 968 Ca 0.30 0.00 0.14 0.00 -1.94 0.00 0.00 57.00 55.50 3i4n n GLN 968 Cb 0.99 0.00 0.25 0.00 0.11 0.00 0.00 30.24 31.58 3i4n n GLN 968 CO 0.00 0.00 0.00 -0.56 -1.44 0.00 0.00 177.06 175.06 3i4n h GLN 969 N 0.00 0.00 0.00 -1.09 3.07 -1.70 0.45 115.11 115.84 3i4n h GLN 969 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.72 3i4n h GLN 969 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.56 3i4n h GLN 969 CO 0.00 0.00 -0.08 1.15 0.09 0.00 0.00 178.83 179.99 3i4n h THR 970 N 0.00 0.27 0.00 1.86 2.02 -1.28 -2.84 112.91 112.94 3i4n h THR 970 Ca 0.23 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.88 3i4n h THR 970 Cb 2.37 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 70.19 3i4n h THR 970 CO -0.00 0.07 -0.10 0.49 0.37 0.00 0.00 175.52 176.35 3i4n n PHE 971 N -3.31 0.00 -0.33 3.16 3.01 0.16 -4.97 117.46 115.17 3i4n n PHE 971 Ca -0.01 -0.72 0.00 0.00 1.01 0.00 0.00 57.45 57.73 3i4n n PHE 971 Cb 0.26 -0.12 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 3i4n n PHE 971 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 3i4n n HIS 972 N -1.02 0.00 -0.29 1.38 8.25 -1.07 -4.69 115.22 117.78 3i4n n HIS 972 Ca 0.11 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.45 3i4n n HIS 972 Cb 0.61 -1.01 -0.03 0.00 1.12 0.00 0.00 29.99 30.68 3i4n n HIS 972 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 3i4n n ILE 973 N -0.62 0.00 -3.12 1.59 5.41 -1.25 -4.85 119.36 116.52 3i4n n ILE 973 Ca 0.00 0.00 -0.40 0.00 1.00 0.00 0.00 62.75 63.35 3i4n n ILE 973 Cb 0.15 -0.11 -0.06 0.00 -0.71 0.00 0.00 39.64 38.92 3i4n n ILE 973 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 3i4n s ASP 974 N 1.50 6.70 0.00 4.38 -4.77 -1.26 -4.93 116.67 118.29 3i4n s ASP 974 Ca 0.27 0.86 0.02 0.00 -3.30 0.00 0.00 52.55 50.40 3i4n s ASP 974 Cb -0.30 -2.35 0.13 0.00 -1.09 0.00 0.00 42.92 39.31 3i4n s ASP 974 CO 0.13 -0.25 0.56 1.41 0.70 0.00 0.00 175.17 177.72 3i4n n HIS 975 N 4.89 0.00 -0.04 2.11 8.25 -1.26 -3.67 115.22 125.50 3i4n n HIS 975 Ca -0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.40 3i4n n HIS 975 Cb 0.50 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.59 3i4n n HIS 975 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3i4n n THR 976 N -0.58 0.83 -0.68 1.59 -2.24 -1.26 -5.00 114.28 106.94 3i4n n THR 976 Ca 0.02 0.29 -0.31 0.00 -2.27 0.00 0.00 64.05 61.77 3i4n n THR 976 Cb 0.01 -1.91 0.17 0.00 -2.10 0.00 0.00 70.33 66.50 3i4n n THR 976 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3i4n n LYS 977 N -3.55 -0.84 -3.01 -0.78 5.02 -1.24 -4.97 118.16 108.79 3i4n n LYS 977 Ca -0.07 -0.20 -0.36 0.00 -2.02 0.00 0.00 58.31 55.67 3i4n n LYS 977 Cb 0.26 -2.11 -0.06 0.00 -0.02 0.00 0.00 35.03 33.10 3i4n n LYS 977 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3i4n s PRO 978 N -4.16 4.30 0.00 1.97 0.04 -1.24 -4.93 135.00 130.98 3i4n s PRO 978 Ca 0.63 0.97 0.00 0.00 0.04 0.00 0.00 61.00 62.64 3i4n s PRO 978 Cb -0.22 -2.75 0.00 0.00 0.04 0.00 0.00 34.50 31.58 3i4n s PRO 978 CO 0.63 0.30 0.00 0.45 0.04 0.00 0.00 177.00 178.42 3i4n n SER 979 N 0.43 -1.35 -1.11 6.66 2.88 0.87 -4.78 113.62 117.23 3i4n n SER 979 Ca 0.00 -0.11 -0.04 0.00 -1.33 0.00 0.00 58.87 57.40 3i4n n SER 979 Cb 0.51 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.93 3i4n n SER 979 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3i4n n ASP 980 N -2.35 -0.40 -4.96 -3.46 5.75 -1.26 -3.20 116.55 106.67 3i4n n ASP 980 Ca 0.00 -1.96 -0.22 0.00 -0.01 0.00 0.00 54.79 52.60 3i4n n ASP 980 Cb 0.00 0.12 -0.01 0.00 -1.03 0.00 0.00 41.12 40.20 3i4n n ASP 980 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3i4n s LEU 981 N 0.00 4.03 0.08 -2.12 1.43 -1.26 -4.67 118.68 116.17 3i4n s LEU 981 Ca 0.09 0.19 0.04 0.00 -1.03 0.00 0.00 54.13 53.42 3i4n s LEU 981 Cb 0.11 -3.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.23 3i4n s LEU 981 CO -0.05 -0.33 0.05 -0.89 0.23 0.00 0.00 176.35 175.37 3i4n s THR 982 N -2.23 4.34 0.61 5.49 2.01 -1.26 -4.67 115.64 119.93 3i4n s THR 982 Ca 0.41 -0.83 0.31 0.00 0.31 0.00 0.00 61.69 61.89 3i4n s THR 982 Cb -0.09 -3.08 0.36 0.00 0.01 0.00 0.00 72.50 69.70 3i4n s THR 982 CO 0.33 0.14 2.08 0.40 -0.69 0.00 0.00 174.62 176.88 3i4n h ILE 983 N 2.73 0.30 0.13 1.82 2.04 -1.99 0.23 117.51 122.78 3i4n h ILE 983 Ca -0.47 0.00 -0.27 0.00 1.00 0.00 0.00 64.86 65.11 3i4n h ILE 983 Cb 1.16 0.80 0.03 0.00 -0.74 0.00 0.00 36.82 38.07 3i4n h ILE 983 CO 0.63 0.00 -1.15 0.11 0.00 0.00 0.00 178.15 177.74 3i4n h LYS 984 N 0.00 0.55 0.24 2.37 1.57 -1.98 -3.00 116.57 116.31 3i4n h LYS 984 Ca 0.07 -0.77 -0.01 0.00 -1.87 0.00 0.00 60.65 58.08 3i4n h LYS 984 Cb 0.54 0.26 -0.00 0.00 0.08 0.00 0.00 32.23 33.10 3i4n h LYS 984 CO -0.00 1.34 -0.17 -0.44 -0.57 0.00 0.00 179.45 179.61 3i4n h ASP 985 N 0.12 -0.45 0.00 0.86 3.32 -0.94 0.50 116.42 119.83 3i4n h ASP 985 Ca -0.18 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.90 3i4n h ASP 985 Cb 1.85 0.14 0.00 0.00 0.22 0.00 0.00 39.33 41.54 3i4n h ASP 985 CO 0.22 -0.25 0.00 -0.38 -1.72 0.00 0.00 179.24 177.11 3i4n n ILE 986 N -3.35 0.00 -0.15 0.35 5.41 -0.82 -0.33 119.36 120.48 3i4n n ILE 986 Ca -0.05 1.36 -0.07 0.00 1.00 0.00 0.00 62.75 64.99 3i4n n ILE 986 Cb 0.17 -1.97 -0.01 0.00 -0.71 0.00 0.00 39.64 37.12 3i4n n ILE 986 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3i4n h VAL 987 N 0.00 0.20 -0.52 1.39 2.07 -1.59 -2.27 116.25 115.53 3i4n h VAL 987 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 3i4n h VAL 987 Cb 0.00 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 29.96 3i4n h VAL 987 CO 0.00 0.00 -0.12 -0.07 0.02 0.00 0.00 177.57 177.40 3i4n h LEU 988 N -0.23 0.99 -1.41 2.57 3.38 -0.79 -2.72 115.31 117.10 3i4n h LEU 988 Ca 0.19 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 3i4n h LEU 988 Cb 0.54 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3i4n h LEU 988 CO -0.59 1.11 -0.12 1.23 0.09 0.00 0.00 178.44 180.16 3i4n h GLY 989 N 0.94 0.26 0.86 0.83 0.00 -0.39 -2.47 103.07 103.10 3i4n h GLY 989 Ca 0.13 -0.16 -0.11 0.00 0.00 0.00 0.00 47.33 47.20 3i4n h GLY 989 CO 0.05 0.15 -0.32 -2.08 0.00 0.00 0.00 176.54 174.34 3i4n h VAL 990 N 0.23 1.34 -0.76 4.60 2.07 -1.32 -1.32 116.25 121.10 3i4n h VAL 990 Ca 0.05 -1.55 0.20 0.00 0.82 0.00 0.00 66.70 66.22 3i4n h VAL 990 Cb 0.36 1.90 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 3i4n h VAL 990 CO 0.02 0.47 0.53 0.50 0.02 0.00 0.00 177.57 179.12 3i4n h LYS 991 N 0.18 0.10 0.13 1.57 3.64 -1.13 -1.90 116.57 119.16 3i4n h LYS 991 Ca 0.01 -0.01 -0.32 0.00 -1.27 0.00 0.00 60.65 59.07 3i4n h LYS 991 Cb 0.91 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.70 3i4n h LYS 991 CO 0.07 0.07 -1.57 -0.44 -2.27 0.00 0.00 179.45 175.31 3i4n h ASP 992 N 0.10 0.45 -0.86 4.20 3.32 -1.20 -3.18 116.42 119.24 3i4n h ASP 992 Ca 0.37 -0.62 0.22 0.00 0.02 0.00 0.00 57.03 57.01 3i4n h ASP 992 Cb 1.30 -0.15 -0.13 0.00 0.22 0.00 0.00 39.33 40.58 3i4n h ASP 992 CO -0.04 1.52 0.30 0.25 -1.72 0.00 0.00 179.24 179.54 3i4n h LEU 993 N 0.08 0.15 -0.34 1.55 5.85 -0.42 0.20 115.31 122.38 3i4n h LEU 993 Ca -0.26 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.63 3i4n h LEU 993 Cb 2.04 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 43.25 3i4n h LEU 993 CO 0.17 -0.07 0.21 1.56 -0.34 0.00 0.00 178.44 179.97 3i4n h GLN 994 N 0.30 0.45 0.00 1.25 4.20 -1.57 -2.47 115.11 117.28 3i4n h GLN 994 Ca 0.53 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.21 3i4n h GLN 994 Cb 1.03 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.71 3i4n h GLN 994 CO -0.58 0.33 0.01 0.39 -0.67 0.00 0.00 178.83 178.31 3i4n n GLU 995 N -4.83 0.00 0.00 1.46 -0.58 0.70 -1.70 120.64 115.68 3i4n n GLU 995 Ca -0.01 0.10 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 3i4n n GLU 995 Cb 0.04 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 29.40 3i4n n GLU 995 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3i4n n ASN 996 N -1.06 0.51 -3.34 1.62 3.02 -0.93 -4.81 115.26 110.26 3i4n n ASN 996 Ca 0.00 -0.77 -0.37 0.00 -0.03 0.00 0.00 54.58 53.41 3i4n n ASN 996 Cb 0.01 0.33 -0.03 0.00 -0.61 0.00 0.00 39.78 39.48 3i4n n ASN 996 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3i4n n LEU 997 N -0.33 7.87 -4.73 3.41 4.77 -0.69 -4.91 117.00 122.39 3i4n n LEU 997 Ca 0.00 -4.08 -0.42 0.00 -0.03 0.00 0.00 56.01 51.48 3i4n n LEU 997 Cb 0.02 -1.49 -0.03 0.00 -2.33 0.00 0.00 43.42 39.59 3i4n n LEU 997 CO 0.00 1.69 0.98 -0.76 -1.33 0.00 0.00 177.39 177.97 3i4n s LEU 998 N 0.41 4.40 -0.06 2.23 1.02 -1.26 -4.92 118.68 120.51 3i4n s LEU 998 Ca 0.62 2.29 -0.03 0.00 0.02 0.00 0.00 54.13 57.04 3i4n s LEU 998 Cb 0.16 -3.60 -0.03 0.00 0.02 0.00 0.00 46.19 42.75 3i4n s LEU 998 CO -0.06 -0.53 -0.07 0.52 0.02 0.00 0.00 176.35 176.23 3i4n n VAL 999 N 3.21 0.32 -4.65 -1.59 0.31 -1.26 -4.88 118.33 109.78 3i4n n VAL 999 Ca 0.08 -0.09 -0.33 0.00 -0.01 0.00 0.00 64.34 63.99 3i4n n VAL 999 Cb 0.43 -1.48 -0.14 0.00 -0.91 0.00 0.00 33.84 31.75 3i4n n VAL 999 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3i4n s LEU 1000N -6.20 2.78 -0.04 7.52 1.43 -1.26 -5.01 118.68 117.90 3i4n s LEU 1000Ca -0.08 -0.32 -0.22 0.00 -1.03 0.00 0.00 54.13 52.48 3i4n s LEU 1000Cb 0.03 -1.64 -0.27 0.00 0.03 0.00 0.00 46.19 44.34 3i4n s LEU 1000CO 0.10 0.15 0.96 -0.09 0.23 0.00 0.00 176.35 177.70 3i4n h ARG 1001N 6.85 0.28 0.00 1.70 2.43 -1.93 -3.47 114.38 120.23 3i4n h ARG 1001Ca -0.28 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.51 3i4n h ARG 1001Cb 1.20 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.88 3i4n h ARG 1001CO 0.57 1.13 0.00 0.41 -1.51 0.00 0.00 179.97 180.56 3i4n n GLY 1002N 1.39 0.00 0.35 2.80 0.00 -1.26 -4.88 105.19 103.60 3i4n n GLY 1002Ca -0.12 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.04 3i4n n GLY 1002CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3i4n n LYS 1003N 0.02 1.31 -3.64 1.61 3.00 -1.26 -4.54 118.16 114.66 3i4n n LYS 1003Ca 0.00 -0.71 -0.19 0.00 -0.00 0.00 0.00 58.31 57.41 3i4n n LYS 1003Cb 0.00 -1.49 -0.04 0.00 0.00 0.00 0.00 35.03 33.50 3i4n n LYS 1003CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 3i4n n ASN 1004N -0.23 2.38 0.00 3.14 0.23 -1.26 -5.03 115.26 114.50 3i4n n ASN 1004Ca 0.17 -2.39 0.00 0.00 -0.53 0.00 0.00 54.58 51.83 3i4n n ASN 1004Cb 0.33 0.35 0.00 0.00 -2.08 0.00 0.00 39.78 38.38 3i4n n ASN 1004CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 3i4n n GLU 1005N -0.74 0.00 -0.21 -3.83 4.07 -1.26 -1.49 120.64 117.18 3i4n n GLU 1005Ca -0.11 0.19 -0.04 0.00 -0.06 0.00 0.00 57.16 57.14 3i4n n GLU 1005Cb 0.40 -1.10 -0.03 0.00 -0.06 0.00 0.00 31.44 30.65 3i4n n GLU 1005CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 3i4n n ILE 1006N -0.91 -0.33 0.18 6.31 5.41 -1.26 0.32 119.36 129.08 3i4n n ILE 1006Ca 0.00 1.24 -0.14 0.00 1.00 0.00 0.00 62.75 64.85 3i4n n ILE 1006Cb 0.00 -1.57 -0.07 0.00 -0.71 0.00 0.00 39.64 37.30 3i4n n ILE 1006CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3i4n h ILE 1007N 0.00 0.36 -0.32 1.39 1.08 -1.93 -1.71 117.51 116.38 3i4n h ILE 1007Ca 0.11 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.65 3i4n h ILE 1007Cb 0.24 0.36 -0.08 0.00 -3.07 0.00 0.00 36.82 34.27 3i4n h ILE 1007CO -0.49 0.00 -0.25 1.56 -0.69 0.00 0.00 178.15 178.28 3i4n h GLN 1008N -0.62 -0.21 -0.39 2.37 1.08 0.99 -1.53 115.11 116.81 3i4n h GLN 1008Ca -0.01 0.01 0.08 0.00 -1.45 0.00 0.00 58.65 57.29 3i4n h GLN 1008Cb 0.58 0.05 -0.08 0.00 -0.05 0.00 0.00 27.48 27.97 3i4n h GLN 1008CO -0.08 -0.14 -0.19 -0.97 -0.95 0.00 0.00 178.83 176.49 3i4n h ASN 1009N -0.22 -0.66 -0.15 1.46 -0.73 -0.27 0.48 115.58 115.50 3i4n h ASN 1009Ca 0.16 0.15 0.04 0.00 1.87 0.00 0.00 56.30 58.53 3i4n h ASN 1009Cb 0.47 0.36 -0.01 0.00 0.27 0.00 0.00 38.32 39.41 3i4n h ASN 1009CO -0.45 -0.23 0.22 0.00 -0.37 0.00 0.00 177.43 176.60 3i4n h ALA 1010N 1.13 1.64 -0.03 1.57 0.00 -0.39 -0.77 119.26 122.41 3i4n h ALA 1010Ca 0.19 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3i4n h ALA 1010Cb 0.42 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3i4n h ALA 1010CO -0.47 -0.30 0.00 0.37 0.00 0.00 0.00 179.25 178.86 3i4n h GLN 1011N 0.00 0.06 -0.47 0.00 5.75 0.79 -0.11 115.11 121.13 3i4n h GLN 1011Ca 0.07 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.60 3i4n h GLN 1011Cb 0.51 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.01 3i4n h GLN 1011CO -0.00 0.33 0.21 0.00 -2.65 0.00 0.00 178.83 176.72 3i4n h ARG 1012N -0.22 0.41 0.04 1.69 3.08 -0.86 -2.36 114.38 116.16 3i4n h ARG 1012Ca 0.01 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 3i4n h ARG 1012Cb 0.30 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 3i4n h ARG 1012CO 0.00 0.27 -0.03 -0.44 -1.07 0.00 0.00 179.97 178.70 3i4n h ASP 1013N 0.42 -0.07 0.00 7.04 3.32 -1.42 -1.18 116.42 124.52 3i4n h ASP 1013Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3i4n h ASP 1013Cb 0.16 0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3i4n h ASP 1013CO -0.18 -0.05 0.13 0.00 -1.72 0.00 0.00 179.24 177.43 3i4n n ALA 1014N -2.14 0.83 -1.72 3.45 0.00 -0.06 -3.82 120.51 117.05 3i4n n ALA 1014Ca -0.07 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3i4n n ALA 1014Cb 0.06 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.53 3i4n n ALA 1014CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3i4n n VAL 1015N -1.93 0.00 0.00 0.00 0.31 -0.76 -4.70 118.33 111.25 3i4n n VAL 1015Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 3i4n n VAL 1015Cb 0.15 -0.44 0.00 0.00 -0.91 0.00 0.00 33.84 32.64 3i4n n VAL 1015CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3i4n n THR 1016N -0.36 0.00 -0.32 2.52 -1.04 -0.52 -1.90 114.28 112.66 3i4n n THR 1016Ca 0.00 0.00 0.31 0.00 -2.04 0.00 0.00 64.05 62.32 3i4n n THR 1016Cb 0.00 0.00 0.57 0.00 -1.82 0.00 0.00 70.33 69.08 3i4n n THR 1016CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3i4n n LEU 1017N 0.00 0.32 0.16 -4.42 7.94 -1.26 -1.22 117.00 118.53 3i4n n LEU 1017Ca 0.00 1.57 -0.07 0.00 -1.11 0.00 0.00 56.01 56.40 3i4n n LEU 1017Cb 0.00 -0.77 -0.03 0.00 0.53 0.00 0.00 43.42 43.15 3i4n n LEU 1017CO 0.00 -1.75 0.35 0.15 -1.11 0.00 0.00 177.39 175.02 3i4n h PHE 1018N 0.00 -0.40 -0.98 1.96 3.57 -1.74 -2.93 116.94 116.42 3i4n h PHE 1018Ca 0.82 -0.01 0.35 0.00 3.53 0.00 0.00 57.97 62.65 3i4n h PHE 1018Cb 2.20 0.13 -0.17 0.00 2.79 0.00 0.00 35.95 40.91 3i4n h PHE 1018CO -0.01 -0.25 0.39 0.00 -2.23 0.00 0.00 178.31 176.22 3i4n h LEU 1021N -0.51 -0.20 0.02 0.00 5.85 0.11 0.15 115.31 120.74 3i4n h LEU 1021Ca 0.06 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.91 3i4n h LEU 1021Cb 0.65 0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.83 3i4n h LEU 1021CO -0.48 -0.07 -0.53 0.25 -0.34 0.00 0.00 178.44 177.27 3i4n h LEU 1022N 0.11 -1.62 -2.28 2.25 5.85 0.31 -0.66 115.31 119.27 3i4n h LEU 1022Ca 0.24 0.18 0.00 0.00 0.84 0.00 0.00 57.88 59.14 3i4n h LEU 1022Cb 0.35 0.61 0.00 0.00 0.37 0.00 0.00 40.66 41.99 3i4n h LEU 1022CO -0.40 -0.52 0.00 0.03 -0.34 0.00 0.00 178.44 177.21 3i4n h ARG 1023N -0.68 0.00 -0.03 1.25 3.08 0.35 0.20 114.38 118.56 3i4n h ARG 1023Ca 0.01 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.83 3i4n h ARG 1023Cb 0.72 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.77 3i4n h ARG 1023CO -0.34 0.00 -0.90 1.03 -1.07 0.00 0.00 179.97 178.69 3i4n h SER 1024N 0.00 0.63 0.10 7.04 0.87 0.78 -3.28 113.55 119.69 3i4n h SER 1024Ca 0.00 -0.48 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 3i4n h SER 1024Cb 0.07 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 61.84 3i4n h SER 1024CO 0.00 1.27 -1.43 0.54 -0.53 0.00 0.00 176.83 176.67 3i4n n ARG 1025N -3.80 0.35 -1.38 2.24 5.12 -0.31 -4.31 116.66 114.56 3i4n n ARG 1025Ca -0.07 -0.08 -0.21 0.00 -1.93 0.00 0.00 57.85 55.55 3i4n n ARG 1025Cb 0.81 -1.53 0.11 0.00 -1.16 0.00 0.00 32.46 30.68 3i4n n ARG 1025CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3i4n n LEU 1026N -1.94 5.66 -4.77 0.55 4.77 0.56 -4.57 117.00 117.27 3i4n n LEU 1026Ca 0.00 -4.23 -0.38 0.00 -0.03 0.00 0.00 56.01 51.37 3i4n n LEU 1026Cb 0.46 -0.66 -0.06 0.00 -2.33 0.00 0.00 43.42 40.82 3i4n n LEU 1026CO 0.44 1.58 0.66 0.00 -1.33 0.00 0.00 177.39 178.74 3i4n s ALA 1027N -3.54 3.24 0.00 -1.18 0.00 -1.24 -4.86 121.76 114.18 3i4n s ALA 1027Ca 0.54 0.56 0.00 0.00 0.00 0.00 0.00 51.96 53.06 3i4n s ALA 1027Cb 0.44 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 20.37 3i4n s ALA 1027CO 0.02 0.16 1.00 2.41 0.00 0.00 0.00 175.76 179.34 3i4n n THR 1028N 0.76 0.00 -0.28 0.00 -1.04 -1.26 0.76 114.28 113.22 3i4n n THR 1028Ca 0.01 1.50 -0.10 0.00 -2.04 0.00 0.00 64.05 63.42 3i4n n THR 1028Cb 0.49 -2.14 -0.08 0.00 -1.82 0.00 0.00 70.33 66.78 3i4n n THR 1028CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 3i4n h ARG 1029N 0.00 -0.10 -0.45 -2.82 2.47 -1.83 0.06 114.38 111.71 3i4n h ARG 1029Ca 0.00 0.01 0.08 0.00 -1.26 0.00 0.00 59.98 58.81 3i4n h ARG 1029Cb 0.00 0.02 -0.10 0.00 -1.65 0.00 0.00 29.97 28.25 3i4n h ARG 1029CO 0.00 -0.07 -0.39 -0.09 0.56 0.00 0.00 179.97 179.99 3i4n h ARG 1030N -0.10 -0.26 -0.44 0.04 2.43 -1.72 0.45 114.38 114.78 3i4n h ARG 1030Ca 0.11 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.38 3i4n h ARG 1030Cb 0.39 0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 29.90 3i4n h ARG 1030CO -0.70 -0.18 -0.36 0.28 -1.51 0.00 0.00 179.97 177.51 3i4n h VAL 1031N -0.27 0.18 0.00 0.20 2.07 0.23 -1.66 116.25 117.00 3i4n h VAL 1031Ca 0.17 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.51 3i4n h VAL 1031Cb 0.57 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 3i4n h VAL 1031CO -0.59 0.00 -1.38 -0.07 0.02 0.00 0.00 177.57 175.54 3i4n h LEU 1032N -0.26 0.00 0.00 2.57 4.07 -0.87 -3.23 115.31 117.60 3i4n h LEU 1032Ca 0.17 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.13 3i4n h LEU 1032Cb 0.56 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.30 3i4n h LEU 1032CO -0.58 0.62 -0.39 1.67 -1.08 0.00 0.00 178.44 178.69 3i4n n GLN 1033N -2.93 0.32 -0.28 1.13 7.27 0.15 -3.42 117.38 119.63 3i4n n GLN 1033Ca -0.10 0.42 0.08 0.00 0.07 0.00 0.00 57.00 57.47 3i4n n GLN 1033Cb 0.86 -1.39 0.22 0.00 2.41 0.00 0.00 30.24 32.34 3i4n n GLN 1033CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 3i4n h GLU 1034N -0.70 0.42 -2.19 3.69 5.08 -1.38 -3.32 114.58 116.18 3i4n h GLU 1034Ca 0.00 -0.03 -0.55 0.00 -1.00 0.00 0.00 59.36 57.78 3i4n h GLU 1034Cb 0.39 -0.09 -0.36 0.00 0.50 0.00 0.00 28.75 29.18 3i4n h GLU 1034CO 0.00 0.28 -0.96 2.48 -1.00 0.00 0.00 179.01 179.81 3i4n n TYR 1035N -5.02 -1.09 -0.46 4.33 0.18 -1.16 -5.06 117.16 108.88 3i4n n TYR 1035Ca 0.17 -3.19 -0.04 0.00 1.88 0.00 0.00 57.90 56.72 3i4n n TYR 1035Cb 0.49 0.28 -0.05 0.00 -0.38 0.00 0.00 39.34 39.68 3i4n n TYR 1035CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 3i4n n ARG 1036N 2.62 0.00 -3.12 -3.48 5.12 -1.22 -4.66 116.66 111.92 3i4n n ARG 1036Ca 0.28 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.87 3i4n n ARG 1036Cb 0.49 -0.36 -0.06 0.00 -1.16 0.00 0.00 32.46 31.37 3i4n n ARG 1036CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3i4n s LEU 1037N 0.00 4.07 0.00 0.55 2.01 -1.22 -4.79 118.68 119.30 3i4n s LEU 1037Ca 0.27 1.30 0.04 0.00 0.01 0.00 0.00 54.13 55.74 3i4n s LEU 1037Cb -0.17 -4.08 0.04 0.00 0.01 0.00 0.00 46.19 41.99 3i4n s LEU 1037CO 0.12 -0.20 0.31 0.35 1.01 0.00 0.00 176.35 177.93 3i4n n THR 1038N -0.33 0.00 0.02 5.49 -2.24 -1.26 -4.52 114.28 111.43 3i4n n THR 1038Ca 0.03 -0.74 -0.10 0.00 -2.27 0.00 0.00 64.05 60.98 3i4n n THR 1038Cb 0.53 -0.83 -0.08 0.00 -2.10 0.00 0.00 70.33 67.86 3i4n n THR 1038CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3i4n h LYS 1039N 0.00 -0.14 0.00 -0.78 1.63 -1.98 -2.42 116.57 112.88 3i4n h LYS 1039Ca -0.10 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 3i4n h LYS 1039Cb 0.48 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 3i4n h LYS 1039CO 0.15 0.34 0.00 0.94 -3.45 0.00 0.00 179.45 177.43 3i4n n GLN 1040N -4.84 0.00 -0.31 1.90 7.27 -1.26 -0.28 117.38 119.86 3i4n n GLN 1040Ca -0.07 0.77 0.10 0.00 0.07 0.00 0.00 57.00 57.87 3i4n n GLN 1040Cb 0.27 -1.43 0.21 0.00 2.41 0.00 0.00 30.24 31.70 3i4n n GLN 1040CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3i4n n ALA 1041N -2.41 0.37 0.43 1.69 0.00 -1.26 -0.42 120.51 118.91 3i4n n ALA 1041Ca 0.00 0.95 -0.20 0.00 0.00 0.00 0.00 53.44 54.19 3i4n n ALA 1041Cb 0.00 -0.65 -0.10 0.00 0.00 0.00 0.00 19.45 18.70 3i4n n ALA 1041CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3i4n h PHE 1042N 0.00 -1.29 -0.61 0.00 3.57 -0.50 -0.30 116.94 117.81 3i4n h PHE 1042Ca 0.49 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 62.16 3i4n h PHE 1042Cb 0.94 0.46 -0.02 0.00 2.79 0.00 0.00 35.95 40.11 3i4n h PHE 1042CO -0.53 -0.72 0.55 -0.44 -2.23 0.00 0.00 178.31 174.95 3i4n h ASP 1043N -1.18 0.00 0.00 0.41 3.32 0.22 0.89 116.42 120.08 3i4n h ASP 1043Ca -0.10 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 3i4n h ASP 1043Cb 0.95 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.50 3i4n h ASP 1043CO 0.10 0.00 -0.00 -0.25 -1.72 0.00 0.00 179.24 177.37 3i4n h TRP 1044N 0.00 -0.01 -1.00 4.55 7.01 -0.48 -2.09 115.95 123.94 3i4n h TRP 1044Ca 0.29 -0.00 0.41 0.00 2.11 0.00 0.00 58.89 61.70 3i4n h TRP 1044Cb 1.40 0.00 -0.18 0.00 -2.10 0.00 0.00 29.16 28.28 3i4n h TRP 1044CO 0.00 -0.00 0.49 0.28 -2.79 0.00 0.00 178.44 176.42 3i4n n VAL 1045N -2.03 -0.42 0.31 2.65 0.31 -0.19 -0.47 118.33 118.49 3i4n n VAL 1045Ca -0.00 2.04 -0.12 0.00 -0.01 0.00 0.00 64.34 66.25 3i4n n VAL 1045Cb 0.00 -3.28 -0.06 0.00 -0.91 0.00 0.00 33.84 29.59 3i4n n VAL 1045CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3i4n h LEU 1046N 0.00 -0.67 -1.77 7.52 3.38 -0.90 -2.34 115.31 120.54 3i4n h LEU 1046Ca 0.83 0.02 0.27 0.00 0.09 0.00 0.00 57.88 59.09 3i4n h LEU 1046Cb 2.16 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 43.02 3i4n h LEU 1046CO -0.78 -0.45 0.69 0.77 0.09 0.00 0.00 178.44 178.76 3i4n h SER 1047N -0.85 0.17 0.27 -0.43 4.64 -0.03 -0.56 113.55 116.76 3i4n h SER 1047Ca -0.08 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 3i4n h SER 1047Cb 0.60 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3i4n h SER 1047CO 0.13 0.05 -0.13 0.78 -0.87 0.00 0.00 176.83 176.79 3i4n h ASN 1048N 0.16 -0.31 -0.97 4.97 2.35 -1.24 -2.79 115.58 117.76 3i4n h ASN 1048Ca 0.50 -0.22 0.24 0.00 -0.55 0.00 0.00 56.30 56.27 3i4n h ASN 1048Cb 1.70 0.08 -0.07 0.00 0.05 0.00 0.00 38.32 40.08 3i4n h ASN 1048CO -0.10 0.16 0.64 0.40 -1.65 0.00 0.00 177.43 176.88 3i4n h ILE 1049N -0.89 0.60 0.00 2.81 2.04 -0.72 0.39 117.51 121.74 3i4n h ILE 1049Ca -0.04 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.70 3i4n h ILE 1049Cb 0.51 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 3i4n h ILE 1049CO 0.06 0.07 0.00 1.21 0.00 0.00 0.00 178.15 179.49 3i4n n GLU 1050N -4.52 0.00 -0.07 2.37 4.07 -0.31 -1.51 120.64 120.66 3i4n n GLU 1050Ca 0.22 0.22 -0.09 0.00 -0.06 0.00 0.00 57.16 57.44 3i4n n GLU 1050Cb 0.80 -0.89 -0.02 0.00 -0.06 0.00 0.00 31.44 31.27 3i4n n GLU 1050CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3i4n h ALA 1051N -2.12 0.34 -1.22 4.31 0.00 -1.20 -1.60 119.26 117.77 3i4n h ALA 1051Ca 0.00 -0.03 0.35 0.00 0.00 0.00 0.00 54.91 55.23 3i4n h ALA 1051Cb 0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 3i4n h ALA 1051CO 0.00 -0.17 0.88 0.37 0.00 0.00 0.00 179.25 180.33 3i4n h GLN 1052N 0.35 0.01 0.14 0.00 4.15 -0.31 0.46 115.11 119.91 3i4n h GLN 1052Ca 0.10 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 3i4n h GLN 1052Cb -0.01 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.68 3i4n h GLN 1052CO -0.02 0.01 -0.07 0.35 -1.93 0.00 0.00 178.83 177.17 3i4n h PHE 1053N 0.01 -0.17 -1.09 3.99 3.57 -0.34 -3.08 116.94 119.83 3i4n h PHE 1053Ca 0.58 -0.00 0.31 0.00 3.53 0.00 0.00 57.97 62.40 3i4n h PHE 1053Cb 2.32 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 41.07 3i4n h PHE 1053CO -0.00 -0.11 1.15 -0.07 -2.23 0.00 0.00 178.31 177.05 3i4n h LEU 1054N -0.51 0.00 0.16 0.59 3.38 0.39 0.96 115.31 120.29 3i4n h LEU 1054Ca -0.02 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.64 3i4n h LEU 1054Cb 0.14 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.93 3i4n h LEU 1054CO 0.03 0.00 -1.32 0.03 0.09 0.00 0.00 178.44 177.27 3i4n h ARG 1055N 0.00 0.61 0.00 1.13 3.08 -0.42 -3.25 114.38 115.53 3i4n h ARG 1055Ca 0.52 -0.87 0.00 0.00 0.07 0.00 0.00 59.98 59.69 3i4n h ARG 1055Cb 2.80 0.30 0.00 0.00 0.08 0.00 0.00 29.97 33.15 3i4n h ARG 1055CO -0.01 1.41 0.00 0.43 -1.07 0.00 0.00 179.97 180.73 3i4n n SER 1056N -3.77 0.00 -3.27 7.04 7.64 0.33 -4.76 113.62 116.83 3i4n n SER 1056Ca -0.15 -0.50 -0.21 0.00 1.01 0.00 0.00 58.87 59.02 3i4n n SER 1056Cb 1.03 0.00 0.17 0.00 -1.01 0.00 0.00 64.21 64.40 3i4n n SER 1056CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3i4n n VAL 1057N -0.72 0.00 -4.26 0.44 0.31 -1.19 -2.19 118.33 110.73 3i4n n VAL 1057Ca 0.03 -0.42 -0.34 0.00 -0.01 0.00 0.00 64.34 63.60 3i4n n VAL 1057Cb 0.02 -1.28 -0.11 0.00 -0.91 0.00 0.00 33.84 31.56 3i4n n VAL 1057CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3i4n s VAL 1058N -2.56 4.22 -0.45 2.52 1.01 0.96 -2.49 120.40 123.62 3i4n s VAL 1058Ca 0.51 -0.24 -0.29 0.00 0.00 0.00 0.00 61.98 61.96 3i4n s VAL 1058Cb -0.04 -2.87 0.02 0.00 0.00 0.00 0.00 36.38 33.49 3i4n s VAL 1058CO 0.38 0.48 1.27 -1.00 0.00 0.00 0.00 175.10 176.24 3i4n s HIS 1059N 0.36 2.61 -0.28 5.22 3.76 -1.26 -4.95 115.29 120.75 3i4n s HIS 1059Ca -0.02 0.69 -0.30 0.00 -0.15 0.00 0.00 55.06 55.29 3i4n s HIS 1059Cb -0.13 -4.38 -0.07 0.00 1.11 0.00 0.00 32.58 29.10 3i4n s HIS 1059CO 0.02 -1.61 2.24 -2.30 -0.85 0.00 0.00 174.74 172.23 3i4n n PRO 1060N 7.97 1.66 0.00 8.40 -0.02 -1.26 -1.40 135.00 150.35 3i4n n PRO 1060Ca 0.14 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3i4n n PRO 1060Cb 0.49 -3.06 0.00 0.00 -0.02 0.00 0.00 33.50 30.91 3i4n n PRO 1060CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i4n n GLY 1061N 5.99 0.77 3.59 -1.23 0.00 -1.04 -4.85 105.19 108.42 3i4n n GLY 1061Ca 0.34 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.86 3i4n n GLY 1061CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i4n n GLU 1062N 0.00 1.25 -1.37 1.61 -0.58 -0.49 -1.42 120.64 119.64 3i4n n GLU 1062Ca 0.00 0.45 -0.29 0.00 -0.42 0.00 0.00 57.16 56.90 3i4n n GLU 1062Cb 0.00 -2.04 0.02 0.00 -0.57 0.00 0.00 31.44 28.86 3i4n n GLU 1062CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3i4n n MET 1063N 2.21 2.38 -0.18 3.49 2.81 -1.26 -2.68 117.12 123.89 3i4n n MET 1063Ca 0.16 -2.61 0.16 0.00 -1.81 0.00 0.00 57.70 53.60 3i4n n MET 1063Cb 0.23 -2.06 0.28 0.00 -0.71 0.00 0.00 33.22 30.95 3i4n n MET 1063CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3i4n n VAL 1064N -0.01 -0.14 0.29 2.03 0.31 -1.21 -1.45 118.33 118.15 3i4n n VAL 1064Ca 0.48 0.82 -0.12 0.00 -0.01 0.00 0.00 64.34 65.51 3i4n n VAL 1064Cb 0.52 -1.33 -0.06 0.00 -0.91 0.00 0.00 33.84 32.06 3i4n n VAL 1064CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3i4n h GLY 1065N 0.00 -0.85 0.55 2.92 0.00 -1.22 0.95 103.07 105.41 3i4n h GLY 1065Ca 0.38 0.33 0.18 0.00 0.00 0.00 0.00 47.33 48.22 3i4n h GLY 1065CO -0.25 -0.30 0.53 -2.08 0.00 0.00 0.00 176.54 174.44 3i4n h VAL 1066N -0.76 0.71 0.00 4.60 2.07 -1.37 -0.90 116.25 120.60 3i4n h VAL 1066Ca -0.07 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.36 3i4n h VAL 1066Cb 0.59 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 3i4n h VAL 1066CO 0.11 0.05 0.00 -0.11 0.02 0.00 0.00 177.57 177.64 3i4n n LEU 1067N -4.43 0.61 -0.19 2.57 -0.00 -0.92 -2.45 117.00 112.19 3i4n n LEU 1067Ca 0.16 0.11 0.19 0.00 -0.00 0.00 0.00 56.01 56.47 3i4n n LEU 1067Cb 0.67 0.00 0.35 0.00 -0.00 0.00 0.00 43.42 44.43 3i4n n LEU 1067CO 0.34 0.00 0.63 0.00 -0.00 0.00 0.00 177.39 178.36 3i4n n ALA 1068N -1.92 0.62 0.05 1.96 0.00 0.32 0.37 120.51 121.91 3i4n n ALA 1068Ca 0.00 0.59 -0.03 0.00 0.00 0.00 0.00 53.44 54.00 3i4n n ALA 1068Cb 0.00 -0.60 -0.01 0.00 0.00 0.00 0.00 19.45 18.84 3i4n n ALA 1068CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n h ALA 1069N 1.15 -0.83 -0.61 0.00 0.00 -1.23 -2.56 119.26 115.18 3i4n h ALA 1069Ca 0.50 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.50 3i4n h ALA 1069Cb 1.34 0.30 -0.11 0.00 0.00 0.00 0.00 17.79 19.31 3i4n h ALA 1069CO -0.44 -0.84 -0.13 1.96 0.00 0.00 0.00 179.25 179.81 3i4n h GLN 1070N -0.15 0.01 -1.40 0.00 4.20 0.26 0.30 115.11 118.32 3i4n h GLN 1070Ca -0.01 -0.00 0.41 0.00 0.06 0.00 0.00 58.65 59.11 3i4n h GLN 1070Cb 0.13 -0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.83 3i4n h GLN 1070CO -0.01 0.01 0.98 0.77 -0.67 0.00 0.00 178.83 179.91 3i4n h SER 1071N 0.01 0.11 0.00 1.46 0.02 -1.12 1.02 113.55 115.05 3i4n h SER 1071Ca 0.30 0.04 -0.26 0.00 -0.84 0.00 0.00 61.79 61.03 3i4n h SER 1071Cb 0.46 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 3i4n h SER 1071CO -0.62 -0.02 -1.49 -0.38 -1.14 0.00 0.00 176.83 173.18 3i4n n ILE 1072N -4.27 1.52 1.10 3.27 5.41 0.88 -4.19 119.36 123.08 3i4n n ILE 1072Ca 0.33 -0.08 0.08 0.00 1.00 0.00 0.00 62.75 64.08 3i4n n ILE 1072Cb 1.44 -2.05 0.47 0.00 -0.71 0.00 0.00 39.64 38.79 3i4n n ILE 1072CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3i4n n GLY 1073N 1.41 -0.55 0.04 7.39 0.00 -0.18 -3.05 105.19 110.26 3i4n n GLY 1073Ca -0.34 -0.10 -0.02 0.00 0.00 0.00 0.00 46.02 45.56 3i4n n GLY 1073CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3i4n h GLU 1074N 0.00 0.00 -0.15 1.61 4.22 0.87 -3.29 114.58 117.84 3i4n h GLU 1074Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 3i4n h GLU 1074Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3i4n h GLU 1074CO 0.00 0.00 0.00 -0.35 -2.18 0.00 0.00 179.01 176.48 3i4n n PRO 1075N -3.98 0.36 -0.05 0.92 -0.04 -1.18 -2.13 135.00 128.90 3i4n n PRO 1075Ca -0.03 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.25 3i4n n PRO 1075Cb 0.10 -1.08 -0.13 0.00 -0.04 0.00 0.00 33.50 32.36 3i4n n PRO 1075CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3i4n h ALA 1076N 1.56 0.08 0.00 0.55 0.00 -1.60 -3.33 119.26 116.52 3i4n h ALA 1076Ca 0.00 -0.79 -0.10 0.00 0.00 0.00 0.00 54.91 54.02 3i4n h ALA 1076Cb 0.08 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3i4n h ALA 1076CO 0.00 0.35 -0.46 1.15 0.00 0.00 0.00 179.25 180.29 3i4n h THR 1077N -0.81 0.93 0.00 0.00 2.02 -1.58 -3.01 112.91 110.47 3i4n h THR 1077Ca -0.15 -1.88 0.00 0.00 0.77 0.00 0.00 66.41 65.14 3i4n h THR 1077Cb 1.28 2.16 0.00 0.00 -1.74 0.00 0.00 68.15 69.85 3i4n h THR 1077CO -0.02 0.45 0.00 0.00 0.37 0.00 0.00 175.52 176.32 3i4n n GLN 1078N -3.42 0.96 -3.40 6.66 1.13 -1.22 -4.64 117.38 113.45 3i4n n GLN 1078Ca 0.01 0.00 -0.45 0.00 -1.94 0.00 0.00 57.00 54.62 3i4n n GLN 1078Cb 0.61 -1.47 -0.03 0.00 0.11 0.00 0.00 30.24 29.46 3i4n n GLN 1078CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 3i4n s MET 1079N -1.01 3.45 -1.03 -1.09 -1.94 -1.14 -5.00 119.30 111.55 3i4n s MET 1079Ca 0.00 -2.54 -0.22 0.00 -1.71 0.00 0.00 55.69 51.23 3i4n s MET 1079Cb 0.00 -4.31 0.07 0.00 2.01 0.00 0.00 34.83 32.61 3i4n s MET 1079CO 0.00 -1.27 1.40 0.99 -0.01 0.00 0.00 175.02 176.14 3i4n s THR 1080N 0.01 4.13 0.54 2.05 2.01 -1.26 -4.92 115.64 118.20 3i4n s THR 1080Ca 0.19 -1.06 0.09 0.00 0.31 0.00 0.00 61.69 61.22 3i4n s THR 1080Cb -0.12 -5.01 0.07 0.00 0.01 0.00 0.00 72.50 67.45 3i4n s THR 1080CO -0.08 -1.85 0.74 -0.76 -0.69 0.00 0.00 174.62 171.98 3i4n s LEU 1081N 4.37 3.24 -0.58 4.42 1.43 -1.26 -5.15 118.68 125.15 3i4n s LEU 1081Ca 0.44 -0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 52.71 3i4n s LEU 1081Cb -0.01 -1.92 0.15 0.00 0.03 0.00 0.00 46.19 44.44 3i4n s LEU 1081CO -0.08 -1.21 0.49 -0.54 0.23 0.00 0.00 176.35 175.24 3i4n s LYS 1093N -4.60 2.88 -0.29 1.70 3.01 -1.26 -5.07 119.74 116.11 3i4n s LYS 1093Ca 0.60 -1.97 -0.14 0.00 -1.01 0.00 0.00 55.97 53.45 3i4n s LYS 1093Cb -0.07 -4.13 0.11 0.00 -1.01 0.00 0.00 37.83 32.73 3i4n s LYS 1093CO 0.38 -1.26 0.72 0.14 0.51 0.00 0.00 175.35 175.84 3i4n s VAL 1094N 1.04 -0.33 -0.45 3.17 -7.23 -1.26 -5.07 120.40 110.27 3i4n s VAL 1094Ca 0.09 0.00 -0.43 0.00 -1.81 0.00 0.00 61.98 59.82 3i4n s VAL 1094Cb -0.23 -1.00 -0.18 0.00 0.56 0.00 0.00 36.38 35.53 3i4n s VAL 1094CO -0.02 0.00 1.90 0.41 -0.31 0.00 0.00 175.10 177.08 3i4n n THR 1095N 4.63 0.07 -4.15 5.32 -1.04 -1.26 -4.89 114.28 112.96 3i4n n THR 1095Ca -0.17 -0.04 -0.11 0.00 -2.04 0.00 0.00 64.05 61.69 3i4n n THR 1095Cb 0.56 -0.75 -0.10 0.00 -1.82 0.00 0.00 70.33 68.21 3i4n n THR 1095CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3i4n s SER 1096N 4.75 1.09 0.57 8.00 1.04 -1.26 -4.79 113.70 123.10 3i4n s SER 1096Ca 1.10 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 56.61 3i4n s SER 1096Cb -1.36 0.08 0.00 0.00 0.10 0.00 0.00 66.02 64.85 3i4n s SER 1096CO 0.69 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 175.11 3i4n n GLY 1097N 0.22 1.75 0.41 7.32 0.00 -1.26 -4.16 105.19 109.48 3i4n n GLY 1097Ca -0.14 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 3i4n n GLY 1097CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3i4n h VAL 1098N 0.00 0.02 -0.47 1.61 2.07 -1.91 0.20 116.25 117.78 3i4n h VAL 1098Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 3i4n h VAL 1098Cb 0.00 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.77 3i4n h VAL 1098CO 0.00 0.00 0.23 1.55 0.02 0.00 0.00 177.57 179.37 3i4n h PRO 1099N -0.12 0.67 -0.67 1.57 0.13 -2.00 -2.62 132.00 128.96 3i4n h PRO 1099Ca 0.19 -0.10 0.01 0.00 -0.87 0.00 0.00 66.00 65.24 3i4n h PRO 1099Cb 0.52 -0.12 -0.03 0.00 0.13 0.00 0.00 31.00 31.49 3i4n h PRO 1099CO -0.83 0.57 0.45 -0.09 -0.23 0.00 0.00 178.00 177.86 3i4n h ARG 1100N 0.61 0.86 -0.70 0.86 9.65 -1.55 -0.45 114.38 123.66 3i4n h ARG 1100Ca 0.16 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.98 3i4n h ARG 1100Cb 0.11 -0.19 -0.03 0.00 -1.39 0.00 0.00 29.97 28.46 3i4n h ARG 1100CO -0.02 0.57 0.40 1.25 2.80 0.00 0.00 179.97 184.96 3i4n h LEU 1101N 0.88 0.85 -0.19 3.80 5.85 -0.26 -0.37 115.31 125.88 3i4n h LEU 1101Ca 0.25 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.85 3i4n h LEU 1101Cb -0.05 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.76 3i4n h LEU 1101CO -0.06 0.68 -0.15 0.50 -0.34 0.00 0.00 178.44 179.06 3i4n h LYS 1102N 0.97 0.43 -1.07 1.25 3.64 -1.00 -2.33 116.57 118.46 3i4n h LYS 1102Ca 0.25 -0.22 0.29 0.00 -1.27 0.00 0.00 60.65 59.70 3i4n h LYS 1102Cb 0.00 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 31.72 3i4n h LYS 1102CO -0.04 0.77 0.68 1.49 -2.27 0.00 0.00 179.45 180.08 3i4n h GLU 1103N 0.10 0.35 0.00 1.90 4.81 -0.11 -1.71 114.58 119.93 3i4n h GLU 1103Ca 0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 3i4n h GLU 1103Cb 0.68 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.98 3i4n h GLU 1103CO 0.04 0.23 0.00 -0.89 -0.73 0.00 0.00 179.01 177.66 3i4n n ILE 1104N -4.68 0.00 0.23 2.32 5.41 -0.25 -2.07 119.36 120.32 3i4n n ILE 1104Ca 0.27 0.80 0.09 0.00 1.00 0.00 0.00 62.75 64.91 3i4n n ILE 1104Cb 0.95 -1.64 0.26 0.00 -0.71 0.00 0.00 39.64 38.49 3i4n n ILE 1104CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3i4n h LEU 1105N 0.00 0.00 -1.15 1.39 3.38 -1.19 0.83 115.31 118.57 3i4n h LEU 1105Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3i4n h LEU 1105Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3i4n h LEU 1105CO 0.00 0.00 -0.02 0.59 0.09 0.00 0.00 178.44 179.10 3i4n n ASN 1106N -2.75 1.80 -3.35 -0.43 3.02 -0.66 -1.45 115.26 111.44 3i4n n ASN 1106Ca 0.04 -1.58 -0.18 0.00 -0.03 0.00 0.00 54.58 52.83 3i4n n ASN 1106Cb 0.96 0.01 0.06 0.00 -0.61 0.00 0.00 39.78 40.20 3i4n n ASN 1106CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3i4n n VAL 1107N 0.38 -8.43 -1.44 2.41 0.31 0.29 -4.73 118.33 107.12 3i4n n VAL 1107Ca 0.17 -1.21 -0.49 0.00 -0.01 0.00 0.00 64.34 62.80 3i4n n VAL 1107Cb 0.41 -6.02 -0.08 0.00 -0.91 0.00 0.00 33.84 27.24 3i4n n VAL 1107CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i4n n ALA 1108N -3.40 0.81 0.44 3.52 0.00 -0.88 -4.84 120.51 116.17 3i4n n ALA 1108Ca -0.07 -0.16 0.11 0.00 0.00 0.00 0.00 53.44 53.31 3i4n n ALA 1108Cb 0.61 -2.52 0.45 0.00 0.00 0.00 0.00 19.45 17.99 3i4n n ALA 1108CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i4n n LYS 1109N 8.25 0.15 -2.73 0.00 5.02 -1.26 -4.18 118.16 123.40 3i4n n LYS 1109Ca 0.46 0.37 -0.08 0.00 -2.02 0.00 0.00 58.31 57.05 3i4n n LYS 1109Cb 0.20 -1.78 0.06 0.00 -0.02 0.00 0.00 35.03 33.49 3i4n n LYS 1109CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3i4n n ASN 1110N -2.07 -2.58 -4.62 4.39 6.94 -1.26 -5.14 115.26 110.93 3i4n n ASN 1110Ca 0.03 -3.11 -0.51 0.00 -0.02 0.00 0.00 54.58 50.97 3i4n n ASN 1110Cb 0.23 1.67 -0.06 0.00 -2.36 0.00 0.00 39.78 39.27 3i4n n ASN 1110CO 0.00 0.00 0.00 1.15 -1.03 0.00 0.00 177.26 177.38 3i4n n MET 1111N 1.46 1.40 -0.12 -3.83 0.00 -1.26 -4.91 117.12 109.86 3i4n n MET 1111Ca 0.07 0.50 -0.08 0.00 0.00 0.00 0.00 57.70 58.20 3i4n n MET 1111Cb 0.65 -2.18 -0.06 0.00 0.00 0.00 0.00 33.22 31.63 3i4n n MET 1111CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 3i4n h LYS 1112N 5.09 -0.19 -6.13 3.17 1.57 -1.99 -3.36 116.57 114.72 3i4n h LYS 1112Ca -0.47 0.01 -0.58 0.00 -1.87 0.00 0.00 60.65 57.75 3i4n h LYS 1112Cb 1.31 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.62 3i4n h LYS 1112CO 0.81 -0.13 -0.06 0.99 -0.57 0.00 0.00 179.45 180.50 3i4n s THR 1113N -4.58 4.85 0.00 -0.16 2.01 -1.26 -4.96 115.64 111.54 3i4n s THR 1113Ca -0.08 1.16 0.00 0.00 0.31 0.00 0.00 61.69 63.07 3i4n s THR 1113Cb 0.05 -3.88 0.00 0.00 0.01 0.00 0.00 72.50 68.69 3i4n s THR 1113CO 0.37 0.51 0.00 -0.81 -0.69 0.00 0.00 174.62 174.00 3i4n n PRO 1114N 2.12 2.81 0.00 4.92 -0.04 -1.26 -4.88 135.00 138.67 3i4n n PRO 1114Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 3i4n n PRO 1114Cb 0.51 -0.71 0.00 0.00 -0.04 0.00 0.00 33.50 33.27 3i4n n PRO 1114CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3i4n n SER 1115N -1.01 0.00 0.00 3.54 2.88 -1.26 -4.08 113.62 113.69 3i4n n SER 1115Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3i4n n SER 1115Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 3i4n n SER 1115CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3i4n n LEU 1116N 0.00 0.00 -4.57 2.46 7.94 -1.26 -4.38 117.00 117.19 3i4n n LEU 1116Ca 0.00 0.00 -0.43 0.00 -1.11 0.00 0.00 56.01 54.47 3i4n n LEU 1116Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 3i4n n LEU 1116CO 0.00 0.00 0.72 -0.89 -1.11 0.00 0.00 177.39 176.11 3i4n s THR 1117N 0.00 4.52 -0.14 1.96 2.01 0.41 -1.50 115.64 122.90 3i4n s THR 1117Ca 0.00 0.79 -0.04 0.00 0.31 0.00 0.00 61.69 62.75 3i4n s THR 1117Cb 0.00 -4.40 -0.03 0.00 0.01 0.00 0.00 72.50 68.08 3i4n s THR 1117CO 0.00 -0.76 0.01 0.68 -0.69 0.00 0.00 174.62 173.86 3i4n s VAL 1118N 3.63 4.36 0.07 3.82 -7.23 0.16 -0.33 120.40 124.89 3i4n s VAL 1118Ca 0.36 -0.20 -0.05 0.00 -1.81 0.00 0.00 61.98 60.28 3i4n s VAL 1118Cb -0.11 -2.90 -0.05 0.00 0.56 0.00 0.00 36.38 33.88 3i4n s VAL 1118CO 0.24 0.53 0.31 -0.31 -0.31 0.00 0.00 175.10 175.56 3i4n s TYR 1119N -0.14 3.53 0.00 2.82 1.51 -1.26 -2.44 117.35 121.37 3i4n s TYR 1119Ca 0.05 0.53 0.00 0.00 -1.01 0.00 0.00 57.07 56.64 3i4n s TYR 1119Cb -0.13 -1.97 0.00 0.00 -0.11 0.00 0.00 41.96 39.75 3i4n s TYR 1119CO 0.02 0.53 0.00 1.28 -1.11 0.00 0.00 175.55 176.27 3i4n n LEU 1120N 0.57 0.00 -4.60 -1.29 4.32 -1.26 -0.06 117.00 114.68 3i4n n LEU 1120Ca -0.07 0.00 -0.25 0.00 -0.02 0.00 0.00 56.01 55.67 3i4n n LEU 1120Cb 0.52 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 42.23 3i4n n LEU 1120CO 0.46 0.00 -0.33 -0.70 -1.22 0.00 0.00 177.39 175.60 3i4n s GLU 1121N 0.00 1.97 0.00 3.23 2.12 -0.98 0.21 118.70 125.25 3i4n s GLU 1121Ca 0.00 -1.86 0.00 0.00 0.36 0.00 0.00 54.97 53.47 3i4n s GLU 1121Cb 0.00 -1.82 0.00 0.00 0.26 0.00 0.00 34.13 32.57 3i4n s GLU 1121CO 0.00 0.11 0.00 -2.30 -0.54 0.00 0.00 175.26 172.53 3i4n n PRO 1122N -0.90 0.00 0.01 4.30 -0.02 -1.26 -2.41 135.00 134.72 3i4n n PRO 1122Ca -0.04 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.39 3i4n n PRO 1122Cb 0.63 0.00 0.18 0.00 -0.02 0.00 0.00 33.50 34.29 3i4n n PRO 1122CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3i4n h GLY 1123N 0.00 0.55 -6.57 -1.23 0.00 -2.01 -3.38 103.07 90.42 3i4n h GLY 1123Ca 0.00 -0.46 -0.46 0.00 0.00 0.00 0.00 47.33 46.40 3i4n h GLY 1123CO 0.00 0.42 1.57 1.42 0.00 0.00 0.00 176.54 179.95 3i4n n HIS 1124N -4.10 0.48 0.00 5.60 8.25 -1.01 -4.37 115.22 120.05 3i4n n HIS 1124Ca -0.01 -0.87 0.00 0.00 -0.26 0.00 0.00 57.72 56.58 3i4n n HIS 1124Cb 0.42 -0.98 0.00 0.00 1.12 0.00 0.00 29.99 30.56 3i4n n HIS 1124CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3i4n n ALA 1125N 7.50 0.10 0.25 -1.41 0.00 -1.26 -4.10 120.51 121.58 3i4n n ALA 1125Ca 0.37 -0.10 0.02 0.00 0.00 0.00 0.00 53.44 53.74 3i4n n ALA 1125Cb 0.31 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.88 3i4n n ALA 1125CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n n ALA 1126N -1.90 1.57 -1.42 0.00 0.00 -1.26 -3.62 120.51 113.88 3i4n n ALA 1126Ca 0.00 -0.02 -0.24 0.00 0.00 0.00 0.00 53.44 53.18 3i4n n ALA 1126Cb 0.00 -1.07 -0.11 0.00 0.00 0.00 0.00 19.45 18.27 3i4n n ALA 1126CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3i4n n ASP 1127N -1.10 1.58 -0.32 0.00 -0.08 -1.26 -4.76 116.55 110.61 3i4n n ASP 1127Ca 0.03 -2.53 -0.06 0.00 -1.51 0.00 0.00 54.79 50.72 3i4n n ASP 1127Cb 0.02 -1.46 -0.04 0.00 2.34 0.00 0.00 41.12 41.98 3i4n n ASP 1127CO 0.00 0.00 0.00 1.67 0.12 0.00 0.00 177.20 178.99 3i4n n GLN 1128N 8.08 -0.28 0.01 -0.67 -0.06 -1.26 -0.58 117.38 122.62 3i4n n GLN 1128Ca 0.43 1.18 -0.08 0.00 -2.00 0.00 0.00 57.00 56.54 3i4n n GLN 1128Cb 0.46 -1.74 0.09 0.00 -4.06 0.00 0.00 30.24 24.98 3i4n n GLN 1128CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 3i4n h GLU 1129N 0.00 0.52 -1.00 3.69 4.81 -1.96 -3.09 114.58 117.55 3i4n h GLU 1129Ca 0.18 -0.30 0.39 0.00 -0.13 0.00 0.00 59.36 59.50 3i4n h GLU 1129Cb 0.37 0.02 -0.17 0.00 0.63 0.00 0.00 28.75 29.60 3i4n h GLU 1129CO -0.75 0.89 0.55 0.37 -0.73 0.00 0.00 179.01 179.34 3i4n h GLN 1130N 0.41 0.09 0.61 1.92 5.75 -1.22 0.49 115.11 123.15 3i4n h GLN 1130Ca 0.02 -0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.49 3i4n h GLN 1130Cb 1.00 -0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.52 3i4n h GLN 1130CO 0.09 0.06 -0.35 0.00 -2.65 0.00 0.00 178.83 175.98 3i4n h ALA 1131N 1.96 -1.19 -0.81 3.38 0.00 -1.44 0.48 119.26 121.62 3i4n h ALA 1131Ca 0.81 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 55.62 3i4n h ALA 1131Cb 2.08 0.45 -0.11 0.00 0.00 0.00 0.00 17.79 20.20 3i4n h ALA 1131CO -0.72 -1.15 -0.54 0.87 0.00 0.00 0.00 179.25 177.71 3i4n h LYS 1132N -0.89 -0.11 0.00 0.00 1.57 -0.23 0.69 116.57 117.59 3i4n h LYS 1132Ca -0.08 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3i4n h LYS 1132Cb 0.71 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.04 3i4n h LYS 1132CO 0.10 -0.08 0.00 1.28 -0.57 0.00 0.00 179.45 180.18 3i4n n LEU 1133N -5.32 0.00 -0.31 2.94 4.77 -0.18 0.82 117.00 119.71 3i4n n LEU 1133Ca 0.02 0.86 0.16 0.00 -0.03 0.00 0.00 56.01 57.01 3i4n n LEU 1133Cb 0.31 -0.36 0.33 0.00 -2.33 0.00 0.00 43.42 41.37 3i4n n LEU 1133CO -0.10 -0.36 0.94 0.40 -1.33 0.00 0.00 177.39 176.94 3i4n h ILE 1134N 0.00 0.24 0.05 -0.08 2.04 -0.48 0.15 117.51 119.43 3i4n h ILE 1134Ca 0.00 -0.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 3i4n h ILE 1134Cb 0.00 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.14 3i4n h ILE 1134CO 0.00 0.03 -0.02 -0.09 0.00 0.00 0.00 178.15 178.07 3i4n h ARG 1135N 0.17 -0.06 0.00 2.37 1.12 0.11 -1.60 114.38 116.49 3i4n h ARG 1135Ca 0.60 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.48 3i4n h ARG 1135Cb 1.28 0.01 0.00 0.00 -0.01 0.00 0.00 29.97 31.25 3i4n h ARG 1135CO -0.71 0.04 0.00 0.43 -3.11 0.00 0.00 179.97 176.62 3i4n n SER 1136N -5.08 0.00 -0.00 -3.80 7.64 0.24 -0.70 113.62 111.92 3i4n n SER 1136Ca -0.08 -0.37 0.08 0.00 1.01 0.00 0.00 58.87 59.51 3i4n n SER 1136Cb 0.09 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.19 3i4n n SER 1136CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i4n n ALA 1137N -0.82 3.68 0.00 -0.43 0.00 -0.61 -4.51 120.51 117.82 3i4n n ALA 1137Ca 0.04 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.04 3i4n n ALA 1137Cb 0.02 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 18.89 3i4n n ALA 1137CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3i4n n ILE 1138N -1.59 0.00 -1.59 0.00 -5.35 0.12 -3.45 119.36 107.51 3i4n n ILE 1138Ca 0.01 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.19 3i4n n ILE 1138Cb 0.31 -0.28 -0.08 0.00 -1.74 0.00 0.00 39.64 37.84 3i4n n ILE 1138CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 3i4n n GLU 1139N -1.60 1.05 -0.22 6.28 2.13 -0.34 -1.04 120.64 126.90 3i4n n GLU 1139Ca 0.00 -2.00 -0.08 0.00 0.66 0.00 0.00 57.16 55.74 3i4n n GLU 1139Cb 0.24 -3.48 -0.01 0.00 0.27 0.00 0.00 31.44 28.46 3i4n n GLU 1139CO 0.00 0.00 0.00 1.58 -0.41 0.00 0.00 177.13 178.30 3i4n n HIS 1140N 13.73 0.02 -3.67 4.31 -0.00 -0.39 -4.41 115.22 124.80 3i4n n HIS 1140Ca 0.45 0.15 -0.09 0.00 -0.00 0.00 0.00 57.72 58.24 3i4n n HIS 1140Cb 0.45 -0.31 -0.10 0.00 -0.00 0.00 0.00 29.99 30.03 3i4n n HIS 1140CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 3i4n s THR 1141N -0.07 -0.31 0.27 3.57 2.01 -0.23 -4.80 115.64 116.08 3i4n s THR 1141Ca 0.12 0.11 0.09 0.00 0.31 0.00 0.00 61.69 62.33 3i4n s THR 1141Cb -0.17 -0.68 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 3i4n s THR 1141CO 0.09 0.05 0.01 0.42 -0.69 0.00 0.00 174.62 174.49 3i4n s THR 1142N 1.96 3.47 0.28 -0.82 -4.23 -1.26 0.39 115.64 115.42 3i4n s THR 1142Ca -0.06 -1.89 -0.02 0.00 -1.18 0.00 0.00 61.69 58.54 3i4n s THR 1142Cb -0.10 -2.87 0.33 0.00 1.34 0.00 0.00 72.50 71.21 3i4n s THR 1142CO -0.14 -0.37 1.62 0.25 -0.54 0.00 0.00 174.62 175.44 3i4n h LEU 1143N 1.86 -0.30 -2.10 4.79 5.85 -1.75 0.31 115.31 123.97 3i4n h LEU 1143Ca -0.44 0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.53 3i4n h LEU 1143Cb 1.25 0.37 -0.00 0.00 0.37 0.00 0.00 40.66 42.65 3i4n h LEU 1143CO 0.60 -0.23 0.31 0.50 -0.34 0.00 0.00 178.44 179.28 3i4n h LYS 1144N 0.10 0.00 0.00 1.25 3.64 -1.81 -1.34 116.57 118.40 3i4n h LYS 1144Ca 0.51 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.74 3i4n h LYS 1144Cb 1.00 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 3i4n h LYS 1144CO -0.75 0.00 -0.73 0.66 -2.27 0.00 0.00 179.45 176.36 3i4n h SER 1145N 0.00 0.00 0.00 4.20 4.64 -0.72 -3.32 113.55 118.34 3i4n h SER 1145Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3i4n h SER 1145Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 3i4n h SER 1145CO -0.00 0.73 -0.90 1.33 -0.87 0.00 0.00 176.83 177.12 3i4n n VAL 1146N -3.31 0.00 -2.61 0.95 0.24 -0.55 -4.95 118.33 108.10 3i4n n VAL 1146Ca 0.01 -0.07 -0.43 0.00 -2.04 0.00 0.00 64.34 61.81 3i4n n VAL 1146Cb 0.82 0.98 -0.02 0.00 -1.47 0.00 0.00 33.84 34.15 3i4n n VAL 1146CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3i4n s THR 1147N -2.77 4.60 -0.11 3.34 2.01 -0.93 -0.09 115.64 121.69 3i4n s THR 1147Ca 0.07 1.93 -0.28 0.00 0.31 0.00 0.00 61.69 63.72 3i4n s THR 1147Cb 0.14 -4.24 -0.25 0.00 0.01 0.00 0.00 72.50 68.16 3i4n s THR 1147CO 0.77 -0.15 0.89 0.40 -0.69 0.00 0.00 174.62 175.84 3i4n h ILE 1148N 5.42 1.70 -1.91 1.82 2.04 -0.49 -3.46 117.51 122.62 3i4n h ILE 1148Ca -0.22 -2.08 -0.01 0.00 1.00 0.00 0.00 64.86 63.56 3i4n h ILE 1148Cb 1.08 3.11 -0.20 0.00 -0.74 0.00 0.00 36.82 40.07 3i4n h ILE 1148CO 0.97 0.54 0.32 0.00 0.00 0.00 0.00 178.15 179.98 3i4n s ALA 1149N -2.70 -1.82 0.13 1.87 0.00 -1.16 -5.03 121.76 113.06 3i4n s ALA 1149Ca -0.18 1.36 0.10 0.00 0.00 0.00 0.00 51.96 53.24 3i4n s ALA 1149Cb -0.02 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.88 3i4n s ALA 1149CO 0.69 -0.38 -0.24 -1.54 0.00 0.00 0.00 175.76 174.29 3i4n s SER 1150N -1.28 3.07 0.02 0.00 1.04 -1.26 -0.04 113.70 115.25 3i4n s SER 1150Ca -0.07 -0.75 -0.11 0.00 0.48 0.00 0.00 55.95 55.50 3i4n s SER 1150Cb -0.00 -0.20 0.01 0.00 0.10 0.00 0.00 66.02 65.93 3i4n s SER 1150CO 0.06 0.12 0.22 -1.61 0.98 0.00 0.00 173.24 173.01 3i4n s GLU 1151N -2.14 0.64 -0.21 4.02 2.02 0.25 -4.98 118.70 118.30 3i4n s GLU 1151Ca 0.13 -0.45 0.01 0.00 0.02 0.00 0.00 54.97 54.68 3i4n s GLU 1151Cb -0.09 0.27 0.04 0.00 0.10 0.00 0.00 34.13 34.45 3i4n s GLU 1151CO 0.06 -0.18 -0.12 0.96 0.02 0.00 0.00 175.26 176.01 3i4n s ILE 1152N -1.94 1.80 0.47 -1.63 -4.36 -1.26 0.14 121.20 114.41 3i4n s ILE 1152Ca -0.10 -1.12 0.08 0.00 -0.26 0.00 0.00 60.65 59.25 3i4n s ILE 1152Cb -0.04 -1.84 0.03 0.00 1.25 0.00 0.00 42.46 41.85 3i4n s ILE 1152CO -0.00 0.18 0.58 -0.31 0.24 0.00 0.00 174.94 175.62 3i4n s TYR 1153N 1.33 2.34 -0.40 1.37 1.51 0.41 -4.95 117.35 118.96 3i4n s TYR 1153Ca -0.02 -0.53 -0.06 0.00 -1.01 0.00 0.00 57.07 55.45 3i4n s TYR 1153Cb -0.17 -2.26 0.09 0.00 -0.11 0.00 0.00 41.96 39.51 3i4n s TYR 1153CO -0.08 -0.55 0.20 -0.47 -1.11 0.00 0.00 175.55 173.54 3i4n s TYR 1154N -2.49 3.42 -0.35 2.71 5.04 -1.26 -1.76 117.35 122.66 3i4n s TYR 1154Ca 0.54 -1.91 -0.00 0.00 -2.44 0.00 0.00 57.07 53.25 3i4n s TYR 1154Cb -0.07 -2.95 0.13 0.00 0.35 0.00 0.00 41.96 39.42 3i4n s TYR 1154CO 0.33 -0.89 0.19 0.34 -1.34 0.00 0.00 175.55 174.17 3i4n s ASP 1155N 1.92 3.34 0.00 4.32 -1.08 -1.01 -4.88 116.67 119.27 3i4n s ASP 1155Ca 0.04 -2.06 0.18 0.00 -0.52 0.00 0.00 52.55 50.19 3i4n s ASP 1155Cb -0.23 -0.58 0.80 0.00 -1.46 0.00 0.00 42.92 41.45 3i4n s ASP 1155CO -0.01 -0.34 1.56 -0.81 0.52 0.00 0.00 175.17 176.09 3i4n n PRO 1156N 4.24 0.08 -3.35 4.34 -0.04 -1.25 -4.48 135.00 134.55 3i4n n PRO 1156Ca 0.06 0.17 -0.45 0.00 -0.04 0.00 0.00 63.50 63.25 3i4n n PRO 1156Cb 0.38 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.27 3i4n n PRO 1156CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3i4n s ASP 1157N -2.87 6.17 0.00 3.54 2.15 -1.26 -4.77 116.67 119.63 3i4n s ASP 1157Ca 0.11 -1.52 0.00 0.00 0.43 0.00 0.00 52.55 51.57 3i4n s ASP 1157Cb 0.12 -2.20 0.00 0.00 -0.30 0.00 0.00 42.92 40.54 3i4n s ASP 1157CO 0.31 -0.75 0.92 -0.81 -0.17 0.00 0.00 175.17 174.67 3i4n n PRO 1158N 5.26 0.54 -0.01 4.34 -0.04 -1.26 -2.66 135.00 141.16 3i4n n PRO 1158Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 3i4n n PRO 1158Cb 0.42 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 3i4n n PRO 1158CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3i4n n ARG 1159N 1.44 0.00 0.00 0.54 1.74 -1.26 -5.11 116.66 114.00 3i4n n ARG 1159Ca 0.00 -0.24 0.00 0.00 -0.77 0.00 0.00 57.85 56.84 3i4n n ARG 1159Cb 0.27 -0.24 0.00 0.00 -1.02 0.00 0.00 32.46 31.47 3i4n n ARG 1159CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3i4n n SER 1160N 0.00 0.00 -4.56 0.55 3.41 -1.09 -4.86 113.62 107.07 3i4n n SER 1160Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.30 3i4n n SER 1160Cb 0.50 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.35 3i4n n SER 1160CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3i4n s THR 1161N -1.26 3.39 -1.37 6.66 2.01 -1.26 -4.56 115.64 119.24 3i4n s THR 1161Ca 0.00 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 60.99 3i4n s THR 1161Cb 0.00 -2.50 0.00 0.00 0.01 0.00 0.00 72.50 70.01 3i4n s THR 1161CO 0.00 0.30 0.49 0.52 -0.69 0.00 0.00 174.62 175.23 3i4n n VAL 1162N 1.29 0.32 -4.35 3.82 0.31 -1.26 -4.31 118.33 114.15 3i4n n VAL 1162Ca -0.15 0.11 -0.34 0.00 -0.01 0.00 0.00 64.34 63.95 3i4n n VAL 1162Cb 0.52 -1.11 -0.14 0.00 -0.91 0.00 0.00 33.84 32.21 3i4n n VAL 1162CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3i4n s ILE 1163N -1.98 3.19 0.02 2.52 1.01 -1.26 -5.03 121.20 119.67 3i4n s ILE 1163Ca 0.00 -0.59 -0.25 0.00 0.00 0.00 0.00 60.65 59.81 3i4n s ILE 1163Cb 0.00 -2.39 -0.17 0.00 0.01 0.00 0.00 42.46 39.91 3i4n s ILE 1163CO 0.00 0.48 1.32 1.55 0.00 0.00 0.00 174.94 178.29 3i4n h PRO 1164N 7.35 -0.30 0.00 2.79 0.13 -2.02 -3.07 132.00 136.87 3i4n h PRO 1164Ca -0.34 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3i4n h PRO 1164Cb 1.18 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3i4n h PRO 1164CO 0.59 0.01 0.43 -0.85 -0.23 0.00 0.00 178.00 177.95 3i4n n GLU 1165N -5.09 0.03 -0.05 0.86 0.28 -1.26 -1.43 120.64 113.98 3i4n n GLU 1165Ca -0.09 0.36 -0.05 0.00 -0.16 0.00 0.00 57.16 57.22 3i4n n GLU 1165Cb 0.24 -2.03 -0.02 0.00 1.43 0.00 0.00 31.44 31.06 3i4n n GLU 1165CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3i4n n ASP 1166N -1.57 1.06 0.00 -1.84 9.92 -1.17 -4.81 116.55 118.14 3i4n n ASP 1166Ca -0.00 0.21 0.00 0.00 -0.53 0.00 0.00 54.79 54.47 3i4n n ASP 1166Cb 0.44 -0.64 0.00 0.00 -0.64 0.00 0.00 41.12 40.28 3i4n n ASP 1166CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3i4n n GLU 1167N -3.57 0.00 -0.32 -1.24 -0.58 -0.52 -0.08 120.64 114.32 3i4n n GLU 1167Ca -0.07 0.00 0.28 0.00 -0.42 0.00 0.00 57.16 56.95 3i4n n GLU 1167Cb 0.27 0.00 0.53 0.00 -0.57 0.00 0.00 31.44 31.67 3i4n n GLU 1167CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3i4n h GLU 1168N 0.00 0.03 -0.07 3.49 5.08 -1.87 0.16 114.58 121.40 3i4n h GLU 1168Ca 0.00 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 3i4n h GLU 1168Cb 0.00 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 3i4n h GLU 1168CO 0.00 0.02 0.15 0.82 -1.00 0.00 0.00 179.01 179.00 3i4n h ILE 1169N 0.03 0.21 0.00 3.13 2.04 -0.84 -1.97 117.51 120.11 3i4n h ILE 1169Ca 0.80 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.66 3i4n h ILE 1169Cb 2.03 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.98 3i4n h ILE 1169CO -0.78 0.00 0.00 -0.38 0.00 0.00 0.00 178.15 176.99 3i4n n ILE 1170N -3.36 0.00 -0.16 -0.67 5.41 0.57 -3.59 119.36 117.56 3i4n n ILE 1170Ca -0.01 0.42 -0.07 0.00 1.00 0.00 0.00 62.75 64.09 3i4n n ILE 1170Cb 0.24 -1.29 -0.01 0.00 -0.71 0.00 0.00 39.64 37.87 3i4n n ILE 1170CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 3i4n h GLN 1171N 0.00 -0.21 0.00 0.38 7.50 -1.63 0.69 115.11 121.84 3i4n h GLN 1171Ca 0.00 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.16 3i4n h GLN 1171Cb 0.00 0.05 0.00 0.00 0.05 0.00 0.00 27.48 27.58 3i4n h GLN 1171CO 0.00 -0.14 0.05 -0.07 -1.50 0.00 0.00 178.83 177.17 3i4n h LEU 1172N -0.22 0.00 -3.85 1.46 3.38 -1.58 -0.32 115.31 114.18 3i4n h LEU 1172Ca 0.19 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.62 3i4n h LEU 1172Cb 0.55 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.01 3i4n h LEU 1172CO -0.62 0.00 0.37 1.57 0.09 0.00 0.00 178.44 179.85 3i4n n HIS 1173N -2.99 2.76 0.00 1.13 -0.00 0.24 -3.99 115.22 112.37 3i4n n HIS 1173Ca -0.03 -2.40 0.00 0.00 0.46 0.00 0.00 57.72 55.75 3i4n n HIS 1173Cb 0.12 -0.99 0.00 0.00 -0.12 0.00 0.00 29.99 28.99 3i4n n HIS 1173CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 3i4n n PHE 1174N -0.97 0.00 -2.44 1.57 3.01 -0.14 -4.85 117.46 113.63 3i4n n PHE 1174Ca 0.54 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.61 3i4n n PHE 1174Cb 1.00 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.44 3i4n n PHE 1174CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3i4n s SER 1175N -1.44 6.31 0.00 4.37 1.04 -1.12 -2.98 113.70 119.89 3i4n s SER 1175Ca 0.00 -2.01 0.00 0.00 0.48 0.00 0.00 55.95 54.42 3i4n s SER 1175Cb 0.00 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.54 3i4n s SER 1175CO 0.00 -1.71 0.00 -0.11 0.98 0.00 0.00 173.24 172.40 3i4n n LEU 1176N 10.03 0.00 -3.22 2.42 0.00 -1.26 -5.04 117.00 119.93 3i4n n LEU 1176Ca 0.45 0.00 -0.30 0.00 0.00 0.00 0.00 56.01 56.16 3i4n n LEU 1176Cb 0.47 0.00 0.03 0.00 0.00 0.00 0.00 43.42 43.92 3i4n n LEU 1176CO 0.72 0.00 -1.28 0.18 0.00 0.00 0.00 177.39 177.02 3i4n n LEU 1177N 0.00 -4.14 0.00 -1.96 4.77 -1.16 -5.00 117.00 109.51 3i4n n LEU 1177Ca 0.00 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3i4n n LEU 1177Cb 0.00 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.54 3i4n n LEU 1177CO 0.00 -4.02 0.00 0.47 -1.33 0.00 0.00 177.39 172.51 3i4n n ASP 1178N 2.82 0.00 -2.80 -1.43 8.00 -1.26 -5.13 116.55 116.75 3i4n n ASP 1178Ca -0.02 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.38 3i4n n ASP 1178Cb 0.50 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.67 3i4n n ASP 1178CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3i4n n GLU 1179N 0.00 1.08 0.00 -1.24 1.02 -1.26 -5.19 120.64 115.04 3i4n n GLU 1179Ca 0.00 -2.33 0.00 0.00 -0.02 0.00 0.00 57.16 54.81 3i4n n GLU 1179Cb 0.00 -0.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.52 3i4n n GLU 1179CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3i4n n GLN 1187N 0.02 0.00 0.00 3.49 10.64 -1.26 -5.35 117.38 124.92 3i4n n GLN 1187Ca 0.07 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.24 3i4n n GLN 1187Cb 0.75 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.13 3i4n n GLN 1187CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 3i4n n GLN 1188N 0.00 1.55 -3.77 2.61 6.02 -1.26 -2.38 117.38 120.15 3i4n n GLN 1188Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.86 3i4n n GLN 1188Cb 0.00 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.15 3i4n n GLN 1188CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3i4n s SER 1189N -0.84 -0.30 0.40 1.08 0.15 -1.26 -4.61 113.70 108.31 3i4n s SER 1189Ca 0.00 0.56 0.13 0.00 0.70 0.00 0.00 55.95 57.34 3i4n s SER 1189Cb 0.00 0.59 0.81 0.00 -1.71 0.00 0.00 66.02 65.71 3i4n s SER 1189CO 0.00 -0.14 1.88 1.55 1.20 0.00 0.00 173.24 177.73 3i4n h PRO 1190N 5.48 0.00 -5.95 5.44 0.13 -1.86 -3.43 132.00 131.82 3i4n h PRO 1190Ca -0.27 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.30 3i4n h PRO 1190Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 3i4n h PRO 1190CO 0.32 0.31 1.50 -1.58 -0.23 0.00 0.00 178.00 178.33 3i4n s TRP 1191N -4.31 1.20 -0.20 1.56 0.23 -1.26 -2.41 118.94 113.75 3i4n s TRP 1191Ca -0.03 0.72 -0.11 0.00 -2.03 0.00 0.00 56.10 54.65 3i4n s TRP 1191Cb 0.15 -3.88 -0.05 0.00 0.03 0.00 0.00 33.47 29.71 3i4n s TRP 1191CO 0.71 -3.73 0.19 -1.17 0.96 0.00 0.00 176.95 173.92 3i4n s LEU 1192N 8.88 4.19 -0.28 2.99 2.96 -0.72 -4.54 118.68 132.16 3i4n s LEU 1192Ca 0.98 0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 55.12 3i4n s LEU 1192Cb -0.29 -2.19 0.01 0.00 0.50 0.00 0.00 46.19 44.21 3i4n s LEU 1192CO 0.33 0.11 0.06 -0.22 -1.32 0.00 0.00 176.35 175.31 3i4n s LEU 1193N 0.63 3.66 -0.19 -0.68 2.96 -0.97 -0.45 118.68 123.65 3i4n s LEU 1193Ca 0.11 -0.64 -0.01 0.00 -0.22 0.00 0.00 54.13 53.37 3i4n s LEU 1193Cb -0.12 -1.85 0.01 0.00 0.50 0.00 0.00 46.19 44.72 3i4n s LEU 1193CO 0.02 -0.15 -0.14 -0.60 -1.32 0.00 0.00 176.35 174.15 3i4n s ARG 1194N 1.49 3.15 -0.07 1.98 3.52 0.37 -3.38 118.95 126.01 3i4n s ARG 1194Ca 0.03 -0.75 0.01 0.00 -0.13 0.00 0.00 55.73 54.89 3i4n s ARG 1194Cb -0.17 -2.73 -0.03 0.00 -1.56 0.00 0.00 34.95 30.47 3i4n s ARG 1194CO 0.01 -0.18 -0.09 -0.51 -0.81 0.00 0.00 175.30 173.72 3i4n s LEU 1195N 1.31 3.05 -0.12 -0.88 1.43 -1.02 0.84 118.68 123.29 3i4n s LEU 1195Ca 0.04 -0.08 -0.01 0.00 -1.03 0.00 0.00 54.13 53.06 3i4n s LEU 1195Cb -0.14 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.41 3i4n s LEU 1195CO -0.08 0.34 -0.11 -0.70 0.23 0.00 0.00 176.35 176.03 3i4n s GLU 1196N -0.70 3.32 0.07 1.70 2.12 0.95 -1.83 118.70 124.33 3i4n s GLU 1196Ca 0.11 -0.64 0.03 0.00 0.36 0.00 0.00 54.97 54.83 3i4n s GLU 1196Cb -0.11 -2.67 -0.04 0.00 0.26 0.00 0.00 34.13 31.57 3i4n s GLU 1196CO 0.01 0.29 0.07 -0.51 -0.54 0.00 0.00 175.26 174.59 3i4n s LEU 1197N 0.16 3.77 -0.02 2.70 1.43 -1.22 0.26 118.68 125.76 3i4n s LEU 1197Ca -0.06 -0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 52.73 3i4n s LEU 1197Cb -0.15 -2.43 -0.03 0.00 0.03 0.00 0.00 46.19 43.61 3i4n s LEU 1197CO 0.04 0.18 1.01 -0.62 0.23 0.00 0.00 176.35 177.19 3i4n s ASP 1198N -2.32 7.32 -0.03 2.29 -1.08 0.87 -4.62 116.67 119.10 3i4n s ASP 1198Ca 0.28 1.66 -0.25 0.00 -0.52 0.00 0.00 52.55 53.72 3i4n s ASP 1198Cb -0.12 -2.57 -0.19 0.00 -1.46 0.00 0.00 42.92 38.58 3i4n s ASP 1198CO 0.21 -0.32 1.16 -0.09 0.52 0.00 0.00 175.17 176.64 3i4n h ARG 1199N 6.88 -0.11 -0.30 4.34 2.43 -1.95 -0.79 114.38 124.88 3i4n h ARG 1199Ca -0.39 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 58.86 3i4n h ARG 1199Cb 1.20 0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 30.70 3i4n h ARG 1199CO 0.78 0.36 -0.25 0.00 -1.51 0.00 0.00 179.97 179.35 3i4n h ALA 1200N 0.21 -0.10 0.39 2.80 0.00 -1.99 -2.76 119.26 117.82 3i4n h ALA 1200Ca -0.01 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3i4n h ALA 1200Cb 0.52 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3i4n h ALA 1200CO 0.02 -0.66 -0.50 0.00 0.00 0.00 0.00 179.25 178.11 3i4n h ALA 1201N 0.86 -1.10 0.00 0.00 0.00 -1.92 -2.64 119.26 114.45 3i4n h ALA 1201Ca 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i4n h ALA 1201Cb 0.47 0.77 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3i4n h ALA 1201CO -0.43 -1.16 0.00 -1.33 0.00 0.00 0.00 179.25 176.33 3i4n n MET 1202N -5.41 0.00 0.00 0.00 2.00 -0.31 -0.20 117.12 113.21 3i4n n MET 1202Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.59 3i4n n MET 1202Cb 0.44 -1.03 0.00 0.00 0.00 0.00 0.00 33.22 32.62 3i4n n MET 1202CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3i4n n ASN 1203N -0.27 4.27 0.00 7.83 3.02 -1.00 -0.71 115.26 128.39 3i4n n ASN 1203Ca 0.00 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.59 3i4n n ASN 1203Cb 0.00 0.34 0.23 0.00 -0.61 0.00 0.00 39.78 39.74 3i4n n ASN 1203CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3i4n n ASP 1204N -1.98 0.00 -0.24 6.41 -0.08 0.73 -2.25 116.55 119.14 3i4n n ASP 1204Ca 0.00 -1.14 0.00 0.00 -1.51 0.00 0.00 54.79 52.14 3i4n n ASP 1204Cb 0.45 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.91 3i4n n ASP 1204CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3i4n n LYS 1205N -0.68 0.00 -2.66 -0.67 5.02 -1.24 -5.10 118.16 112.83 3i4n n LYS 1205Ca 0.06 -0.34 -0.02 0.00 -2.02 0.00 0.00 58.31 55.99 3i4n n LYS 1205Cb 0.03 -0.23 -0.02 0.00 -0.02 0.00 0.00 35.03 34.79 3i4n n LYS 1205CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3i4n n ASP 1206N 0.00 -4.29 -4.13 4.39 8.00 -0.95 -5.04 116.55 114.52 3i4n n ASP 1206Ca 0.00 1.22 -0.10 0.00 0.71 0.00 0.00 54.79 56.62 3i4n n ASP 1206Cb 0.54 -3.28 -0.09 0.00 -0.02 0.00 0.00 41.12 38.27 3i4n n ASP 1206CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3i4n s LEU 1207N -0.30 1.44 -0.11 0.64 1.43 0.11 -4.94 118.68 116.95 3i4n s LEU 1207Ca -0.10 -1.20 -0.06 0.00 -1.03 0.00 0.00 54.13 51.74 3i4n s LEU 1207Cb 0.01 0.49 0.04 0.00 0.03 0.00 0.00 46.19 46.76 3i4n s LEU 1207CO 0.27 -0.80 0.26 -0.89 0.23 0.00 0.00 176.35 175.42 3i4n s THR 1208N -4.07 -0.03 0.17 5.49 2.01 -1.26 -4.87 115.64 113.08 3i4n s THR 1208Ca 0.27 0.12 -0.23 0.00 0.31 0.00 0.00 61.69 62.16 3i4n s THR 1208Cb 0.06 -0.39 0.07 0.00 0.01 0.00 0.00 72.50 72.25 3i4n s THR 1208CO 0.05 0.05 1.59 0.24 -0.69 0.00 0.00 174.62 175.85 3i4n h MET 1209N 6.94 -0.22 -0.92 4.92 0.00 -1.96 0.36 114.93 124.05 3i4n h MET 1209Ca -0.38 0.02 0.09 0.00 0.00 0.00 0.00 59.70 59.42 3i4n h MET 1209Cb 1.16 0.05 -0.12 0.00 0.00 0.00 0.00 31.60 32.70 3i4n h MET 1209CO 0.37 -0.15 -0.57 0.78 0.00 0.00 0.00 176.91 177.33 3i4n h GLY 1210N -0.23 -0.81 0.00 8.32 0.00 -1.96 -2.44 103.07 105.95 3i4n h GLY 1210Ca 0.19 0.77 0.00 0.00 0.00 0.00 0.00 47.33 48.29 3i4n h GLY 1210CO -0.61 0.01 0.00 -1.06 0.00 0.00 0.00 176.54 174.88 3i4n n GLN 1211N -5.28 0.00 0.00 4.80 6.02 0.01 -1.51 117.38 121.41 3i4n n GLN 1211Ca 0.02 0.59 0.00 0.00 -0.01 0.00 0.00 57.00 57.60 3i4n n GLN 1211Cb 0.28 -1.31 0.00 0.00 1.02 0.00 0.00 30.24 30.23 3i4n n GLN 1211CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3i4n n VAL 1212N -1.87 0.00 -0.30 5.09 0.31 -0.55 0.11 118.33 121.11 3i4n n VAL 1212Ca 0.00 0.17 0.13 0.00 -0.01 0.00 0.00 64.34 64.63 3i4n n VAL 1212Cb 0.00 -0.27 0.31 0.00 -0.91 0.00 0.00 33.84 32.96 3i4n n VAL 1212CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3i4n h GLY 1213N 0.00 1.52 -0.07 2.92 0.00 -1.59 0.52 103.07 106.37 3i4n h GLY 1213Ca 0.00 -0.15 0.19 0.00 0.00 0.00 0.00 47.33 47.37 3i4n h GLY 1213CO 0.00 -0.28 0.85 0.83 0.00 0.00 0.00 176.54 177.93 3i4n h GLU 1214N 0.37 0.00 0.02 4.80 4.39 0.18 1.87 114.58 126.21 3i4n h GLU 1214Ca 0.56 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 60.05 3i4n h GLU 1214Cb 1.07 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.70 3i4n h GLU 1214CO -0.54 0.00 -1.13 -0.09 -1.16 0.00 0.00 179.01 176.08 3i4n h ARG 1215N 0.00 0.04 -0.44 2.33 9.65 0.69 -3.24 114.38 123.41 3i4n h ARG 1215Ca 0.32 -0.07 0.09 0.00 -1.10 0.00 0.00 59.98 59.22 3i4n h ARG 1215Cb 2.01 0.03 -0.09 0.00 -1.39 0.00 0.00 29.97 30.52 3i4n h ARG 1215CO -0.00 1.03 -0.20 0.82 2.80 0.00 0.00 179.97 184.42 3i4n h ILE 1216N -0.87 0.40 -0.70 1.20 2.04 0.27 1.18 117.51 121.03 3i4n h ILE 1216Ca -0.30 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.71 3i4n h ILE 1216Cb 1.35 0.40 -0.11 0.00 -0.74 0.00 0.00 36.82 37.71 3i4n h ILE 1216CO -0.14 0.00 0.07 0.50 0.00 0.00 0.00 178.15 178.58 3i4n h LYS 1217N -0.11 0.16 0.00 2.37 1.63 0.15 0.21 116.57 120.98 3i4n h LYS 1217Ca 0.21 -0.01 -0.09 0.00 -0.85 0.00 0.00 60.65 59.91 3i4n h LYS 1217Cb 0.44 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.02 3i4n h LYS 1217CO -0.51 0.11 -0.54 -0.56 -3.45 0.00 0.00 179.45 174.50 3i4n h GLN 1218N 0.17 0.00 -0.49 1.90 3.07 -1.10 0.86 115.11 119.51 3i4n h GLN 1218Ca 0.38 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 59.09 3i4n h GLN 1218Cb 0.65 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.19 3i4n h GLN 1218CO -0.56 0.36 0.18 1.15 0.09 0.00 0.00 178.83 180.05 3i4n h THR 1219N 0.00 1.22 0.00 1.86 2.02 0.44 -3.35 112.91 115.10 3i4n h THR 1219Ca -0.02 -0.69 -0.25 0.00 0.77 0.00 0.00 66.41 66.22 3i4n h THR 1219Cb 1.32 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 68.44 3i4n h THR 1219CO 0.05 0.26 -1.72 0.49 0.37 0.00 0.00 175.52 174.97 3i4n n PHE 1220N -4.55 0.25 0.00 3.16 3.01 -0.24 -5.07 117.46 114.02 3i4n n PHE 1220Ca 0.01 0.11 0.00 0.00 1.01 0.00 0.00 57.45 58.58 3i4n n PHE 1220Cb 0.17 -0.85 0.00 0.00 -0.01 0.00 0.00 39.48 38.78 3i4n n PHE 1220CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3i4n n LYS 1221N -4.37 0.00 -3.05 -1.08 5.02 0.30 -4.68 118.16 110.29 3i4n n LYS 1221Ca -0.35 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.49 3i4n n LYS 1221Cb 0.69 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.69 3i4n n LYS 1221CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3i4n s ASN 1222N -4.00 6.95 0.00 4.39 -0.87 -1.26 -3.38 114.94 116.77 3i4n s ASN 1222Ca 0.00 -2.79 0.00 0.00 -1.57 0.00 0.00 52.86 48.50 3i4n s ASN 1222Cb 0.00 -2.34 0.00 0.00 -0.02 0.00 0.00 41.25 38.89 3i4n s ASN 1222CO 0.00 -0.74 0.00 -0.90 -2.57 0.00 0.00 177.10 172.89 3i4n n ASP 1223N 5.21 0.00 -3.75 -1.22 5.75 -1.26 -5.04 116.55 116.23 3i4n n ASP 1223Ca 0.28 0.00 -0.28 0.00 -0.01 0.00 0.00 54.79 54.78 3i4n n ASP 1223Cb 0.45 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.37 3i4n n ASP 1223CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3i4n s LEU 1224N 0.00 1.48 0.19 -2.12 2.96 -1.22 -2.67 118.68 117.30 3i4n s LEU 1224Ca 0.00 -1.00 -0.30 0.00 -0.22 0.00 0.00 54.13 52.61 3i4n s LEU 1224Cb 0.00 -0.69 -0.08 0.00 0.50 0.00 0.00 46.19 45.92 3i4n s LEU 1224CO 0.00 -0.32 0.95 0.12 -1.32 0.00 0.00 176.35 175.78 3i4n s PHE 1225N 1.78 3.91 -0.03 5.38 5.36 -0.63 -4.69 117.98 129.06 3i4n s PHE 1225Ca 0.00 1.87 -0.04 0.00 -0.96 0.00 0.00 56.93 57.80 3i4n s PHE 1225Cb -0.17 -3.02 0.01 0.00 -0.34 0.00 0.00 43.02 39.50 3i4n s PHE 1225CO -0.11 0.34 0.11 0.08 -1.46 0.00 0.00 175.22 174.17 3i4n s VAL 1226N -0.74 0.03 0.25 3.12 1.01 -1.26 -2.19 120.40 120.61 3i4n s VAL 1226Ca 0.43 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.22 3i4n s VAL 1226Cb -0.25 -0.23 -0.01 0.00 0.00 0.00 0.00 36.38 35.89 3i4n s VAL 1226CO 0.31 -0.12 0.11 -0.38 0.00 0.00 0.00 175.10 175.02 3i4n n ILE 1227N 2.58 0.00 -3.63 2.22 5.41 -0.99 -4.99 119.36 119.96 3i4n n ILE 1227Ca -0.15 -1.50 -0.03 0.00 1.00 0.00 0.00 62.75 62.06 3i4n n ILE 1227Cb 0.58 0.57 -0.04 0.00 -0.71 0.00 0.00 39.64 40.04 3i4n n ILE 1227CO 0.00 0.00 0.00 -1.66 0.00 0.00 0.00 176.55 174.89 3i4n s TRP 1228N -2.56 -0.10 0.00 1.39 -2.14 -1.26 -3.00 118.94 111.27 3i4n s TRP 1228Ca 0.15 0.17 0.00 0.00 2.66 0.00 0.00 56.10 59.08 3i4n s TRP 1228Cb 0.01 0.49 0.00 0.00 -3.10 0.00 0.00 33.47 30.86 3i4n s TRP 1228CO 0.11 -0.09 0.00 -1.13 -2.66 0.00 0.00 176.95 173.18 3i4n n SER 1229N 0.61 0.00 -3.99 -2.66 3.41 -0.85 -5.01 113.62 105.14 3i4n n SER 1229Ca -0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.49 3i4n n SER 1229Cb 0.59 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.42 3i4n n SER 1229CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3i4n s GLU 1230N 0.00 0.33 0.49 4.33 2.02 -1.26 -4.79 118.70 119.82 3i4n s GLU 1230Ca 0.00 -0.61 0.16 0.00 0.02 0.00 0.00 54.97 54.54 3i4n s GLU 1230Cb 0.00 0.06 0.87 0.00 0.10 0.00 0.00 34.13 35.15 3i4n s GLU 1230CO 0.00 -0.04 1.42 -0.44 0.02 0.00 0.00 175.26 176.22 3i4n h ASP 1231N 4.68 0.00 0.11 -0.19 3.32 -1.97 -1.60 116.42 120.77 3i4n h ASP 1231Ca -0.32 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.72 3i4n h ASP 1231Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 3i4n h ASP 1231CO 0.41 0.00 -0.05 -1.13 -1.72 0.00 0.00 179.24 176.75 3i4n h ASN 1232N 0.00 -0.12 -1.46 6.45 -0.73 -1.99 -3.47 115.58 114.26 3i4n h ASN 1232Ca 0.00 0.00 -0.40 0.00 1.87 0.00 0.00 56.30 57.77 3i4n h ASN 1232Cb 0.91 0.03 0.21 0.00 0.27 0.00 0.00 38.32 39.74 3i4n h ASN 1232CO 0.00 -0.05 -1.74 0.47 -0.37 0.00 0.00 177.43 175.74 3i4n n ASP 1233N -2.59 -2.72 0.01 1.15 8.00 -0.60 -4.94 116.55 114.86 3i4n n ASP 1233Ca -0.02 -0.08 0.01 0.00 0.71 0.00 0.00 54.79 55.41 3i4n n ASP 1233Cb 0.06 -0.66 -0.10 0.00 -0.02 0.00 0.00 41.12 40.40 3i4n n ASP 1233CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 3i4n n GLU 1234N 0.70 0.64 -3.87 -1.24 0.28 -1.26 -4.78 120.64 111.10 3i4n n GLU 1234Ca -0.00 0.10 -0.36 0.00 -0.16 0.00 0.00 57.16 56.74 3i4n n GLU 1234Cb 0.60 -1.71 -0.13 0.00 1.43 0.00 0.00 31.44 31.63 3i4n n GLU 1234CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 3i4n s LYS 1235N -2.99 2.75 0.01 3.44 1.02 -1.26 -5.02 119.74 117.69 3i4n s LYS 1235Ca -0.05 -1.06 -0.22 0.00 0.02 0.00 0.00 55.97 54.66 3i4n s LYS 1235Cb 0.09 -3.20 -0.05 0.00 -0.52 0.00 0.00 37.83 34.15 3i4n s LYS 1235CO 0.83 -0.51 0.66 -0.51 -0.92 0.00 0.00 175.35 174.90 3i4n s LEU 1236N 1.36 4.42 0.21 3.17 1.43 -1.26 -4.77 118.68 123.23 3i4n s LEU 1236Ca -0.01 1.26 -0.13 0.00 -1.03 0.00 0.00 54.13 54.21 3i4n s LEU 1236Cb -0.18 -3.04 0.00 0.00 0.03 0.00 0.00 46.19 43.00 3i4n s LEU 1236CO -0.01 0.05 0.45 -0.63 0.23 0.00 0.00 176.35 176.44 3i4n s ILE 1237N -0.05 0.02 -0.10 -0.59 1.01 -1.26 -3.45 121.20 116.79 3i4n s ILE 1237Ca 0.34 -1.21 -0.03 0.00 0.00 0.00 0.00 60.65 59.75 3i4n s ILE 1237Cb -0.19 -1.92 0.05 0.00 0.01 0.00 0.00 42.46 40.42 3i4n s ILE 1237CO 0.19 -0.11 0.15 -0.63 0.00 0.00 0.00 174.94 174.54 3i4n s ILE 1238N -3.96 -0.24 0.37 2.92 1.01 -0.76 -2.02 121.20 118.53 3i4n s ILE 1238Ca 0.17 0.27 0.05 0.00 0.00 0.00 0.00 60.65 61.14 3i4n s ILE 1238Cb 0.00 -0.34 -0.01 0.00 0.01 0.00 0.00 42.46 42.12 3i4n s ILE 1238CO 0.03 0.08 0.53 -0.13 0.00 0.00 0.00 174.94 175.45 3i4n s ARG 1239N 2.27 3.07 0.00 2.79 0.52 -1.16 -2.44 118.95 124.00 3i4n s ARG 1239Ca 0.04 -0.89 0.00 0.00 -0.52 0.00 0.00 55.73 54.36 3i4n s ARG 1239Cb -0.13 -2.74 0.00 0.00 0.52 0.00 0.00 34.95 32.60 3i4n s ARG 1239CO -0.06 -0.06 0.00 0.00 0.02 0.00 0.00 175.30 175.20 3i4n n ARG 1241N -0.36 0.64 0.00 0.00 1.74 -0.93 -2.30 116.66 115.45 3i4n n ARG 1241Ca 0.00 -1.91 0.00 0.00 -0.77 0.00 0.00 57.85 55.17 3i4n n ARG 1241Cb 0.00 1.14 0.00 0.00 -1.02 0.00 0.00 32.46 32.58 3i4n n ARG 1241CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3i4n n VAL 1242N -0.48 0.00 -3.81 1.55 0.31 -1.26 -1.61 118.33 113.04 3i4n n VAL 1242Ca -0.02 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.22 3i4n n VAL 1242Cb 0.34 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.22 3i4n n VAL 1242CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3i4n s VAL 1243N 2.80 0.05 0.00 2.52 0.11 -1.09 -4.11 120.40 120.68 3i4n s VAL 1243Ca 0.00 -0.98 0.00 0.00 -2.93 0.00 0.00 61.98 58.07 3i4n s VAL 1243Cb 0.00 -1.60 0.00 0.00 -1.53 0.00 0.00 36.38 33.25 3i4n s VAL 1243CO 0.00 -0.24 0.00 0.54 -3.33 0.00 0.00 175.10 172.07 3i4n n ARG 1244N -0.26 2.22 -2.90 1.54 1.74 -1.00 -4.95 116.66 113.05 3i4n n ARG 1244Ca -0.10 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.78 3i4n n ARG 1244Cb 0.63 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 32.12 3i4n n ARG 1244CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3i4n s PRO 1245N 0.00 2.38 0.00 5.56 0.04 -1.26 -5.10 135.00 136.62 3i4n s PRO 1245Ca 0.00 -1.33 0.00 0.00 0.04 0.00 0.00 61.00 59.71 3i4n s PRO 1245Cb 0.00 -2.61 0.00 0.00 0.04 0.00 0.00 34.50 31.93 3i4n s PRO 1245CO 0.00 -0.77 0.00 1.17 0.04 0.00 0.00 177.00 177.44 3i4n n LYS 1246N -2.24 0.00 0.00 4.56 4.81 -1.26 -5.19 118.16 118.84 3i4n n LYS 1246Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 3i4n n LYS 1246Cb 0.60 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.65 3i4n n LYS 1246CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3i4n n ALA 1254N 0.00 0.00 0.00 3.14 0.00 -1.26 -5.11 120.51 117.28 3i4n n ALA 1254Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3i4n n ALA 1254Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3i4n n ALA 1254CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3i4n n GLU 1255N 0.00 0.00 0.00 0.00 0.00 -1.26 -5.12 120.64 114.26 3i4n n GLU 1255Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 57.16 56.97 3i4n n GLU 1255Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 31.44 31.30 3i4n n GLU 1255CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 3i4n h GLU 1256N 0.00 0.20 -0.36 5.31 5.08 -2.04 -3.36 114.58 119.41 3i4n h GLU 1256Ca 0.00 -0.33 0.11 0.00 -1.00 0.00 0.00 59.36 58.13 3i4n h GLU 1256Cb 0.00 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3i4n h GLU 1256CO 0.00 1.16 0.49 0.22 -1.00 0.00 0.00 179.01 179.88 3i4n h ASP 1257N -0.56 0.00 -0.06 1.42 1.82 -2.00 -0.37 116.42 116.67 3i4n h ASP 1257Ca -0.15 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.46 3i4n h ASP 1257Cb 1.48 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.49 3i4n h ASP 1257CO 0.07 0.00 -0.06 -0.74 -1.61 0.00 0.00 179.24 176.90 3i4n h HIS 1258N 0.00 0.19 0.11 0.28 2.76 -2.01 -3.35 115.15 113.12 3i4n h HIS 1258Ca 0.17 -0.06 -0.28 0.00 -2.20 0.00 0.00 60.37 58.01 3i4n h HIS 1258Cb 1.15 -0.04 -0.00 0.00 1.55 0.00 0.00 27.41 30.07 3i4n h HIS 1258CO 0.00 0.60 -1.35 0.52 -1.30 0.00 0.00 177.93 176.40 3i4n h MET 1259N -0.28 0.23 -1.30 5.26 2.86 -1.30 -3.27 114.93 117.13 3i4n h MET 1259Ca 0.01 -0.40 0.00 0.00 -2.06 0.00 0.00 59.70 57.25 3i4n h MET 1259Cb 0.57 0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.38 3i4n h MET 1259CO 0.02 1.14 0.00 -0.11 1.06 0.00 0.00 176.91 179.02 3i4n n LEU 1260N -3.47 2.93 0.00 1.22 -0.00 -0.40 -1.32 117.00 115.95 3i4n n LEU 1260Ca -0.11 -1.42 0.00 0.00 -0.00 0.00 0.00 56.01 54.48 3i4n n LEU 1260Cb 1.03 -0.52 0.00 0.00 -0.00 0.00 0.00 43.42 43.92 3i4n n LEU 1260CO 0.52 0.51 -0.05 1.17 -0.00 0.00 0.00 177.39 179.53 3i4n n LYS 1261N 0.76 2.82 0.08 1.96 4.81 -1.24 -4.65 118.16 122.70 3i4n n LYS 1261Ca 0.00 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.24 3i4n n LYS 1261Cb 0.43 -0.55 -0.11 0.00 0.02 0.00 0.00 35.03 34.82 3i4n n LYS 1261CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 3i4n h LYS 1262N 0.00 0.58 0.00 1.64 1.57 -1.25 -2.52 116.57 116.58 3i4n h LYS 1262Ca 0.00 -0.72 0.00 0.00 -1.87 0.00 0.00 60.65 58.06 3i4n h LYS 1262Cb 0.05 0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.59 3i4n h LYS 1262CO 0.00 1.31 0.00 -0.89 -0.57 0.00 0.00 179.45 179.30 3i4n n ILE 1263N -3.78 0.00 0.04 1.86 5.41 -0.92 -2.25 119.36 119.72 3i4n n ILE 1263Ca -0.11 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.62 3i4n n ILE 1263Cb 0.94 -0.47 -0.01 0.00 -0.71 0.00 0.00 39.64 39.39 3i4n n ILE 1263CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 3i4n h GLU 1264N 0.00 -0.12 -0.05 0.38 4.57 -1.71 -3.34 114.58 114.31 3i4n h GLU 1264Ca 0.00 0.01 -0.23 0.00 -1.18 0.00 0.00 59.36 57.96 3i4n h GLU 1264Cb 0.00 0.03 0.01 0.00 -0.16 0.00 0.00 28.75 28.62 3i4n h GLU 1264CO 0.00 -0.08 -0.89 -0.91 -1.18 0.00 0.00 179.01 175.95 3i4n h ASN 1265N -0.31 0.68 -1.40 1.04 2.35 -1.68 -2.96 115.58 113.30 3i4n h ASN 1265Ca -0.01 -0.51 0.46 0.00 -0.55 0.00 0.00 56.30 55.69 3i4n h ASN 1265Cb 0.09 -0.21 -0.12 0.00 0.05 0.00 0.00 38.32 38.14 3i4n h ASN 1265CO 0.02 1.29 0.92 0.74 -1.65 0.00 0.00 177.43 178.75 3i4n h THR 1266N 0.33 0.10 0.01 2.81 2.02 -1.64 0.61 112.91 117.15 3i4n h THR 1266Ca -0.08 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 3i4n h THR 1266Cb 1.51 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.96 3i4n h THR 1266CO 0.16 0.01 -0.01 0.24 0.37 0.00 0.00 175.52 176.30 3i4n h MET 1267N 0.06 -0.02 0.00 6.66 2.86 -1.65 -2.80 114.93 120.05 3i4n h MET 1267Ca 0.84 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.48 3i4n h MET 1267Cb 2.74 0.00 0.00 0.00 0.06 0.00 0.00 31.60 34.41 3i4n h MET 1267CO -0.37 0.76 0.00 1.28 1.06 0.00 0.00 176.91 179.64 3i4n n LEU 1268N -4.68 0.00 0.02 1.22 4.77 0.20 -3.73 117.00 114.80 3i4n n LEU 1268Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 3i4n n LEU 1268Cb 0.38 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3i4n n LEU 1268CO 0.29 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.73 3i4n n GLU 1269N -0.80 0.00 0.00 3.23 1.02 -0.62 -4.11 120.64 119.36 3i4n n GLU 1269Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 3i4n n GLU 1269Cb 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.43 3i4n n GLU 1269CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3i4n n ASN 1270N -2.58 0.62 -4.09 1.62 3.02 -1.05 -4.66 115.26 108.13 3i4n n ASN 1270Ca 0.00 -1.80 -0.32 0.00 -0.03 0.00 0.00 54.58 52.43 3i4n n ASN 1270Cb 0.00 -0.31 -0.16 0.00 -0.61 0.00 0.00 39.78 38.70 3i4n n ASN 1270CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3i4n s ILE 1271N -1.31 1.94 0.25 2.41 1.01 -1.24 -5.00 121.20 119.25 3i4n s ILE 1271Ca 0.00 -0.88 0.11 0.00 0.00 0.00 0.00 60.65 59.88 3i4n s ILE 1271Cb 0.00 -1.77 -0.05 0.00 0.01 0.00 0.00 42.46 40.65 3i4n s ILE 1271CO 0.00 0.51 -0.14 -0.89 0.00 0.00 0.00 174.94 174.42 3i4n s THR 1272N 1.34 2.82 -0.04 2.92 2.01 -1.26 -2.51 115.64 120.91 3i4n s THR 1272Ca 0.05 -2.11 -0.08 0.00 0.31 0.00 0.00 61.69 59.86 3i4n s THR 1272Cb -0.13 -2.46 -0.03 0.00 0.01 0.00 0.00 72.50 69.89 3i4n s THR 1272CO -0.12 -0.31 -0.16 0.18 -0.69 0.00 0.00 174.62 173.52 3i4n n LEU 1273N -0.46 1.35 -4.40 4.42 4.32 0.16 -4.83 117.00 117.56 3i4n n LEU 1273Ca -0.07 0.21 -0.21 0.00 -0.02 0.00 0.00 56.01 55.91 3i4n n LEU 1273Cb 0.58 -0.48 -0.09 0.00 -1.62 0.00 0.00 43.42 41.81 3i4n n LEU 1273CO 0.37 -0.38 -0.20 -0.13 -1.22 0.00 0.00 177.39 175.83 3i4n s ARG 1274N -2.36 1.71 0.00 3.23 0.52 -1.18 -5.01 118.95 115.86 3i4n s ARG 1274Ca -0.14 -1.99 0.00 0.00 -0.52 0.00 0.00 55.73 53.08 3i4n s ARG 1274Cb 0.03 -0.32 0.00 0.00 0.52 0.00 0.00 34.95 35.17 3i4n s ARG 1274CO 0.19 -0.44 0.00 0.41 0.02 0.00 0.00 175.30 175.49 3i4n n GLY 1275N -0.69 -2.34 3.94 -3.53 0.00 -1.22 -1.07 105.19 100.27 3i4n n GLY 1275Ca -0.01 -1.30 -0.28 0.00 0.00 0.00 0.00 46.02 44.42 3i4n n GLY 1275CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i4n s VAL 1276N -3.23 2.07 0.49 1.61 1.01 -0.20 -4.53 120.40 117.61 3i4n s VAL 1276Ca 0.00 -0.14 -0.22 0.00 0.00 0.00 0.00 61.98 61.62 3i4n s VAL 1276Cb 0.00 -2.92 -0.07 0.00 0.00 0.00 0.00 36.38 33.39 3i4n s VAL 1276CO 0.00 0.00 1.18 -0.70 0.00 0.00 0.00 175.10 175.58 3i4n s GLU 1277N -5.61 3.59 0.00 2.72 2.56 -1.26 -3.71 118.70 116.99 3i4n s GLU 1277Ca 0.68 1.78 0.00 0.00 0.00 0.00 0.00 54.97 57.43 3i4n s GLU 1277Cb -0.06 -2.29 0.00 0.00 2.00 0.00 0.00 34.13 33.78 3i4n s GLU 1277CO 0.49 -0.70 0.00 0.09 -0.56 0.00 0.00 175.26 174.59 3i4n n ASN 1278N -0.75 0.00 -4.57 -1.70 3.02 -1.26 -4.45 115.26 105.54 3i4n n ASN 1278Ca 0.09 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.50 3i4n n ASN 1278Cb 0.48 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.55 3i4n n ASN 1278CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3i4n s ILE 1279N 0.00 3.00 0.21 2.41 1.09 -1.24 -4.24 121.20 122.42 3i4n s ILE 1279Ca 0.00 -0.00 0.06 0.00 -1.10 0.00 0.00 60.65 59.61 3i4n s ILE 1279Cb 0.00 -3.66 -0.04 0.00 -1.06 0.00 0.00 42.46 37.70 3i4n s ILE 1279CO 0.00 -0.00 0.13 -1.61 -0.10 0.00 0.00 174.94 173.35 3i4n s GLU 1280N 8.70 2.78 -0.43 2.79 8.01 -1.26 -1.27 118.70 138.02 3i4n s GLU 1280Ca 0.86 -1.02 -0.19 0.00 0.01 0.00 0.00 54.97 54.63 3i4n s GLU 1280Cb -0.08 -2.53 0.02 0.00 -4.31 0.00 0.00 34.13 27.23 3i4n s GLU 1280CO 0.15 0.44 0.61 0.54 0.01 0.00 0.00 175.26 177.01 3i4n n ARG 1281N -0.66 -2.33 -3.80 1.61 1.74 -1.26 -3.30 116.66 108.66 3i4n n ARG 1281Ca -0.08 2.05 -0.36 0.00 -0.77 0.00 0.00 57.85 58.69 3i4n n ARG 1281Cb 0.56 -5.28 -0.07 0.00 -1.02 0.00 0.00 32.46 26.65 3i4n n ARG 1281CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3i4n s VAL 1282N -2.49 5.41 0.04 1.55 1.01 -1.26 -3.48 120.40 121.19 3i4n s VAL 1282Ca 0.26 0.18 0.09 0.00 0.00 0.00 0.00 61.98 62.52 3i4n s VAL 1282Cb -0.07 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 3i4n s VAL 1282CO 0.78 0.50 -0.25 -0.69 0.00 0.00 0.00 175.10 175.45 3i4n s VAL 1283N -0.12 2.27 0.29 2.92 1.01 -0.55 -4.98 120.40 121.25 3i4n s VAL 1283Ca 0.10 -1.34 -0.03 0.00 0.00 0.00 0.00 61.98 60.71 3i4n s VAL 1283Cb -0.11 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.32 3i4n s VAL 1283CO 0.00 0.37 0.54 -0.04 0.00 0.00 0.00 175.10 175.96 3i4n s MET 1284N -1.27 3.59 -0.28 2.72 -1.94 -1.26 -1.39 119.30 119.47 3i4n s MET 1284Ca 0.12 -0.10 -0.16 0.00 -1.71 0.00 0.00 55.69 53.85 3i4n s MET 1284Cb -0.10 -2.67 0.10 0.00 2.01 0.00 0.00 34.83 34.17 3i4n s MET 1284CO 0.03 0.22 0.75 -1.64 -0.01 0.00 0.00 175.02 174.36 3i4n s MET 1285N -3.69 0.63 -1.24 2.03 -1.94 -0.62 -4.93 119.30 109.54 3i4n s MET 1285Ca 0.42 1.13 -0.11 0.00 -1.71 0.00 0.00 55.69 55.42 3i4n s MET 1285Cb -0.11 0.18 0.18 0.00 2.01 0.00 0.00 34.83 37.10 3i4n s MET 1285CO 0.31 -0.14 1.65 1.17 -0.01 0.00 0.00 175.02 178.00 3i4n n LYS 1286N 4.29 3.56 -0.50 2.03 4.81 -1.26 0.15 118.16 131.23 3i4n n LYS 1286Ca -0.19 -3.74 -0.28 0.00 -0.87 0.00 0.00 58.31 53.23 3i4n n LYS 1286Cb 0.58 -2.94 0.21 0.00 0.02 0.00 0.00 35.03 32.90 3i4n n LYS 1286CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3i4n n TYR 1287N 4.45 -2.14 -4.19 5.64 0.53 -0.63 -4.69 117.16 116.13 3i4n n TYR 1287Ca 0.37 -0.16 -0.23 0.00 -1.02 0.00 0.00 57.90 56.86 3i4n n TYR 1287Cb 0.39 -1.49 -0.06 0.00 -1.03 0.00 0.00 39.34 37.15 3i4n n TYR 1287CO 0.00 0.00 0.00 0.34 -1.02 0.00 0.00 176.86 176.18 3i4n s ASP 1288N -2.23 5.08 -0.29 7.72 -1.08 -1.26 -2.44 116.67 122.17 3i4n s ASP 1288Ca 0.56 -0.40 -0.18 0.00 -0.52 0.00 0.00 52.55 52.01 3i4n s ASP 1288Cb -0.13 -1.16 0.13 0.00 -1.46 0.00 0.00 42.92 40.30 3i4n s ASP 1288CO 0.56 0.00 0.97 -0.60 0.52 0.00 0.00 175.17 176.62 3i4n s ARG 1289N -3.60 0.44 0.33 4.34 3.52 -1.26 -4.81 118.95 117.91 3i4n s ARG 1289Ca 0.31 0.69 -0.09 0.00 -0.13 0.00 0.00 55.73 56.51 3i4n s ARG 1289Cb -0.08 0.13 -0.06 0.00 -1.56 0.00 0.00 34.95 33.37 3i4n s ARG 1289CO 0.22 -0.08 0.66 0.15 -0.81 0.00 0.00 175.30 175.45 3i4n s LYS 1290N 1.06 3.77 -0.14 5.12 1.02 -1.26 0.86 119.74 130.17 3i4n s LYS 1290Ca -0.06 0.32 -0.32 0.00 0.02 0.00 0.00 55.97 55.94 3i4n s LYS 1290Cb -0.04 -2.51 0.13 0.00 -0.52 0.00 0.00 37.83 34.88 3i4n s LYS 1290CO -0.13 0.12 1.09 0.08 -0.92 0.00 0.00 175.35 175.59 3i4n s VAL 1291N -2.14 0.00 -0.38 3.17 1.01 -0.56 -4.86 120.40 116.64 3i4n s VAL 1291Ca 0.49 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 62.18 3i4n s VAL 1291Cb -0.11 -1.00 -0.08 0.00 0.00 0.00 0.00 36.38 35.20 3i4n s VAL 1291CO 0.27 0.00 2.32 -2.65 0.00 0.00 0.00 175.10 175.04 3i4n n PRO 1292N 0.03 1.37 -1.87 2.72 -0.02 -1.26 0.26 135.00 136.22 3i4n n PRO 1292Ca -0.04 0.26 -0.37 0.00 -2.02 0.00 0.00 63.50 61.33 3i4n n PRO 1292Cb 0.59 -3.11 0.04 0.00 -0.02 0.00 0.00 33.50 31.01 3i4n n PRO 1292CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3i4n s SER 1293N 9.72 5.19 0.40 2.55 0.15 0.23 -4.85 113.70 127.09 3i4n s SER 1293Ca 1.03 2.61 0.14 0.00 0.70 0.00 0.00 55.95 60.43 3i4n s SER 1293Cb -0.41 -2.62 0.97 0.00 -1.71 0.00 0.00 66.02 62.25 3i4n s SER 1293CO 0.35 -1.61 1.88 1.55 1.20 0.00 0.00 173.24 176.61 3i4n h PRO 1294N 1.19 0.50 0.00 5.44 0.13 -1.92 0.13 132.00 137.47 3i4n h PRO 1294Ca -0.51 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 3i4n h PRO 1294Cb 1.30 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3i4n h PRO 1294CO 0.56 0.33 0.00 0.00 -0.23 0.00 0.00 178.00 178.67 3i4n h THR 1295N 0.52 0.00 0.00 1.56 1.03 -2.01 -3.48 112.91 110.53 3i4n h THR 1295Ca 0.43 -0.31 0.00 0.00 -0.01 0.00 0.00 66.41 66.52 3i4n h THR 1295Cb 0.89 1.12 0.00 0.00 -1.07 0.00 0.00 68.15 69.09 3i4n h THR 1295CO -0.17 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 175.95 3i4n n GLY 1296N 0.07 2.78 3.31 2.99 0.00 0.45 -3.27 105.19 111.51 3i4n n GLY 1296Ca 0.02 -0.68 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 3i4n n GLY 1296CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i4n n GLU 1297N 0.00 -1.09 -3.46 1.61 4.71 -1.25 -4.04 120.64 117.12 3i4n n GLU 1297Ca 0.00 -0.29 -0.34 0.00 -0.01 0.00 0.00 57.16 56.52 3i4n n GLU 1297Cb 0.00 -1.71 -0.05 0.00 -1.01 0.00 0.00 31.44 28.67 3i4n n GLU 1297CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 3i4n s TYR 1298N -2.27 3.54 0.02 -0.32 1.51 -1.26 0.75 117.35 119.32 3i4n s TYR 1298Ca 0.55 0.89 -0.07 0.00 -1.01 0.00 0.00 57.07 57.44 3i4n s TYR 1298Cb -0.14 -2.25 -0.00 0.00 -0.11 0.00 0.00 41.96 39.45 3i4n s TYR 1298CO 0.67 0.41 0.13 0.08 -1.11 0.00 0.00 175.55 175.74 3i4n s VAL 1299N -1.55 0.10 -0.49 0.71 1.01 0.14 -4.78 120.40 115.54 3i4n s VAL 1299Ca 0.39 -0.86 -0.28 0.00 0.00 0.00 0.00 61.98 61.23 3i4n s VAL 1299Cb -0.13 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 3i4n s VAL 1299CO 0.20 -0.47 1.71 -0.54 0.00 0.00 0.00 175.10 175.99 3i4n s LYS 1300N -1.99 3.08 -0.63 2.72 1.02 -1.26 -1.49 119.74 121.18 3i4n s LYS 1300Ca -0.10 0.87 0.06 0.00 0.02 0.00 0.00 55.97 56.82 3i4n s LYS 1300Cb -0.04 -4.24 0.23 0.00 -0.52 0.00 0.00 37.83 33.26 3i4n s LYS 1300CO -0.01 -2.18 0.68 -1.91 -0.92 0.00 0.00 175.35 171.01 3i4n n GLU 1301N 8.73 2.25 -0.94 1.68 2.13 0.25 -4.94 120.64 129.80 3i4n n GLU 1301Ca 0.19 -4.52 -0.38 0.00 0.66 0.00 0.00 57.16 53.11 3i4n n GLU 1301Cb 0.49 -2.19 0.05 0.00 0.27 0.00 0.00 31.44 30.07 3i4n n GLU 1301CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3i4n n PRO 1302N 1.11 -0.28 -3.64 5.31 -0.04 -1.26 -4.40 135.00 131.81 3i4n n PRO 1302Ca 0.28 -0.08 -0.07 0.00 -0.04 0.00 0.00 63.50 63.59 3i4n n PRO 1302Cb 0.41 -1.12 -0.07 0.00 -0.04 0.00 0.00 33.50 32.68 3i4n n PRO 1302CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3i4n s GLU 1303N -2.25 0.46 0.38 0.54 -1.05 -1.02 -4.69 118.70 111.07 3i4n s GLU 1303Ca 0.39 0.62 -0.26 0.00 -0.15 0.00 0.00 54.97 55.58 3i4n s GLU 1303Cb 0.07 0.19 -0.09 0.00 -0.44 0.00 0.00 34.13 33.86 3i4n s GLU 1303CO 0.66 -0.07 1.17 -1.58 0.95 0.00 0.00 175.26 176.39 3i4n s TRP 1304N 0.58 3.14 -0.13 4.83 0.52 -1.24 -1.61 118.94 125.03 3i4n s TRP 1304Ca -0.01 1.56 -0.14 0.00 0.02 0.00 0.00 56.10 57.54 3i4n s TRP 1304Cb -0.05 -3.39 0.04 0.00 -1.15 0.00 0.00 33.47 28.92 3i4n s TRP 1304CO -0.09 -1.24 0.39 0.08 0.02 0.00 0.00 176.95 176.11 3i4n s VAL 1305N -1.38 0.01 0.16 4.03 1.01 0.40 -4.56 120.40 120.07 3i4n s VAL 1305Ca 0.55 -0.07 -0.15 0.00 0.00 0.00 0.00 61.98 62.32 3i4n s VAL 1305Cb -0.31 -0.57 -0.07 0.00 0.00 0.00 0.00 36.38 35.43 3i4n s VAL 1305CO 0.39 -0.04 0.56 -0.76 0.00 0.00 0.00 175.10 175.26 3i4n s LEU 1306N -0.03 4.33 0.01 3.92 1.43 -1.02 -1.59 118.68 125.72 3i4n s LEU 1306Ca -0.02 1.10 0.06 0.00 -1.03 0.00 0.00 54.13 54.23 3i4n s LEU 1306Cb -0.03 -3.31 -0.02 0.00 0.03 0.00 0.00 46.19 42.86 3i4n s LEU 1306CO 0.01 0.09 -0.17 -1.61 0.23 0.00 0.00 176.35 174.90 3i4n s GLU 1307N -1.99 1.30 0.00 1.70 2.02 -0.48 -0.67 118.70 120.57 3i4n s GLU 1307Ca 0.39 -0.72 0.00 0.00 0.02 0.00 0.00 54.97 54.66 3i4n s GLU 1307Cb -0.15 -1.30 0.00 0.00 0.10 0.00 0.00 34.13 32.78 3i4n s GLU 1307CO 0.19 0.34 0.00 -2.37 0.02 0.00 0.00 175.26 173.45 3i4n n THR 1308N 2.32 0.00 -2.14 3.63 5.66 -0.56 -1.48 114.28 121.71 3i4n n THR 1308Ca -0.16 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.83 3i4n n THR 1308Cb 0.54 -0.88 -0.02 0.00 -1.55 0.00 0.00 70.33 68.43 3i4n n THR 1308CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 3i4n n ASP 1309N -1.62 -0.05 -3.70 1.09 -0.08 -1.21 -4.30 116.55 106.68 3i4n n ASP 1309Ca 0.00 -1.78 -0.05 0.00 -1.51 0.00 0.00 54.79 51.45 3i4n n ASP 1309Cb 0.00 -0.02 -0.02 0.00 2.34 0.00 0.00 41.12 43.42 3i4n n ASP 1309CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 3i4n s GLY 1310N -1.05 -0.28 -0.05 0.27 0.00 -1.26 -4.42 107.32 100.53 3i4n s GLY 1310Ca 0.09 0.25 -0.02 0.00 0.00 0.00 0.00 44.72 45.04 3i4n s GLY 1310CO -0.05 0.06 0.06 0.14 0.00 0.00 0.00 173.10 173.32 3i4n s VAL 1311N -3.38 -0.10 -0.45 1.40 1.01 -1.26 -4.62 120.40 113.01 3i4n s VAL 1311Ca 0.10 0.37 0.07 0.00 0.00 0.00 0.00 61.98 62.52 3i4n s VAL 1311Cb -0.02 -0.20 0.25 0.00 0.00 0.00 0.00 36.38 36.41 3i4n s VAL 1311CO -0.00 0.14 0.74 -3.20 0.00 0.00 0.00 175.10 172.78 3i4n n ASN 1312N 5.29 -1.63 -0.22 3.32 2.85 -1.26 -4.92 115.26 118.70 3i4n n ASN 1312Ca -0.03 -3.07 -0.02 0.00 -0.11 0.00 0.00 54.58 51.35 3i4n n ASN 1312Cb 0.50 0.82 0.09 0.00 1.24 0.00 0.00 39.78 42.44 3i4n n ASN 1312CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 3i4n h LEU 1313N 3.97 0.48 0.00 1.20 5.85 -1.94 -3.00 115.31 121.87 3i4n h LEU 1313Ca -0.06 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3i4n h LEU 1313Cb 0.97 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.95 3i4n h LEU 1313CO 0.38 0.31 0.00 -1.54 -0.34 0.00 0.00 178.44 177.25 3i4n n SER 1314N -4.83 0.00 0.00 1.25 3.41 -1.26 -2.30 113.62 109.89 3i4n n SER 1314Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 3i4n n SER 1314Cb 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 3i4n n SER 1314CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3i4n n GLU 1315N -0.33 0.00 0.00 4.33 1.02 -1.21 -4.82 120.64 119.63 3i4n n GLU 1315Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3i4n n GLU 1315Cb 0.00 -0.08 0.00 0.00 -0.02 0.00 0.00 31.44 31.34 3i4n n GLU 1315CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3i4n n VAL 1316N -2.03 0.00 -0.11 2.62 0.31 -0.97 0.12 118.33 118.26 3i4n n VAL 1316Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.12 3i4n n VAL 1316Cb 0.00 -0.68 -0.09 0.00 -0.91 0.00 0.00 33.84 32.16 3i4n n VAL 1316CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 3i4n n MET 1317N -0.58 0.52 -0.26 5.55 0.00 -1.17 -4.49 117.12 116.69 3i4n n MET 1317Ca 0.00 0.18 0.00 0.00 -0.00 0.00 0.00 57.70 57.88 3i4n n MET 1317Cb 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 33.22 31.83 3i4n n MET 1317CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 3i4n n THR 1318N -3.62 1.20 -4.49 1.12 -2.24 0.32 -4.64 114.28 101.92 3i4n n THR 1318Ca -0.43 -0.26 -0.31 0.00 -2.27 0.00 0.00 64.05 60.78 3i4n n THR 1318Cb 0.87 -1.22 -0.11 0.00 -2.10 0.00 0.00 70.33 67.77 3i4n n THR 1318CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3i4n s VAL 1319N 0.58 3.31 0.36 2.28 1.01 -1.23 -5.06 120.40 121.65 3i4n s VAL 1319Ca 0.00 -1.00 -0.25 0.00 0.00 0.00 0.00 61.98 60.73 3i4n s VAL 1319Cb 0.00 -2.45 -0.10 0.00 0.00 0.00 0.00 36.38 33.84 3i4n s VAL 1319CO 0.00 0.33 0.98 -2.16 0.00 0.00 0.00 175.10 174.25 3i4n s PRO 1320N -1.56 4.42 0.00 2.72 0.04 -1.26 -3.73 135.00 135.64 3i4n s PRO 1320Ca 0.17 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.58 3i4n s PRO 1320Cb -0.11 -2.66 0.00 0.00 0.04 0.00 0.00 34.50 31.77 3i4n s PRO 1320CO 0.08 0.12 0.00 0.41 0.04 0.00 0.00 177.00 177.65 3i4n n GLY 1321N 0.37 1.34 3.59 0.56 0.00 -1.26 -4.94 105.19 104.85 3i4n n GLY 1321Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 3i4n n GLY 1321CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3i4n s ILE 1322N -2.44 3.26 -0.40 -0.61 -4.36 -1.24 -2.32 121.20 113.09 3i4n s ILE 1322Ca 0.00 -1.72 -0.19 0.00 -0.26 0.00 0.00 60.65 58.48 3i4n s ILE 1322Cb 0.00 -2.65 0.01 0.00 1.25 0.00 0.00 42.46 41.07 3i4n s ILE 1322CO 0.00 -0.18 0.58 -0.62 0.24 0.00 0.00 174.94 174.96 3i4n s ASP 1323N -3.04 6.32 -0.10 4.36 -1.08 0.58 -4.62 116.67 119.09 3i4n s ASP 1323Ca 0.27 -0.23 0.00 0.00 -0.52 0.00 0.00 52.55 52.07 3i4n s ASP 1323Cb -0.08 -2.29 0.10 0.00 -1.46 0.00 0.00 42.92 39.18 3i4n s ASP 1323CO 0.16 -0.65 1.58 -0.81 0.52 0.00 0.00 175.17 175.97 3i4n n PRO 1324N 6.00 1.26 0.00 4.34 -0.04 -1.26 -3.15 135.00 142.15 3i4n n PRO 1324Ca -0.03 -0.55 0.00 0.00 -0.04 0.00 0.00 63.50 62.88 3i4n n PRO 1324Cb 0.48 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.73 3i4n n PRO 1324CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 3i4n n THR 1325N 0.64 0.00 0.98 0.52 5.66 -1.26 -4.83 114.28 115.99 3i4n n THR 1325Ca 0.11 0.00 0.10 0.00 -3.05 0.00 0.00 64.05 61.21 3i4n n THR 1325Cb 0.62 -0.21 -0.07 0.00 -1.55 0.00 0.00 70.33 69.12 3i4n n THR 1325CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3i4n n ARG 1326N -0.99 0.56 -1.70 1.09 1.74 -1.21 -4.97 116.66 111.18 3i4n n ARG 1326Ca 0.00 -0.39 -0.42 0.00 -0.77 0.00 0.00 57.85 56.28 3i4n n ARG 1326Cb 0.11 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 3i4n n ARG 1326CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 3i4n n ILE 1327N -0.92 2.33 -3.66 0.55 3.06 -1.19 -4.61 119.36 114.92 3i4n n ILE 1327Ca 0.06 -0.50 -0.11 0.00 -2.50 0.00 0.00 62.75 59.70 3i4n n ILE 1327Cb 0.38 -1.57 -0.11 0.00 0.54 0.00 0.00 39.64 38.88 3i4n n ILE 1327CO 0.00 0.00 0.00 -0.47 -2.50 0.00 0.00 176.55 173.58 3i4n s TYR 1328N -1.16 -0.62 -0.02 9.51 5.04 0.56 -5.00 117.35 125.66 3i4n s TYR 1328Ca 0.59 1.26 0.01 0.00 -2.44 0.00 0.00 57.07 56.49 3i4n s TYR 1328Cb -0.53 0.14 -0.03 0.00 0.35 0.00 0.00 41.96 41.89 3i4n s TYR 1328CO 0.60 -0.42 -0.01 -0.08 -1.34 0.00 0.00 175.55 174.30 3i4n s THR 1329N 2.49 4.14 0.27 4.34 -1.32 -1.26 -0.45 115.64 123.85 3i4n s THR 1329Ca -0.01 -0.53 0.01 0.00 -1.21 0.00 0.00 61.69 59.95 3i4n s THR 1329Cb -0.12 -2.81 0.07 0.00 -1.51 0.00 0.00 72.50 68.12 3i4n s THR 1329CO -0.11 0.44 1.71 -0.55 -2.21 0.00 0.00 174.62 173.90 3i4n h ASN 1330N 4.56 0.57 -0.32 8.08 7.08 -1.83 -3.39 115.58 130.33 3i4n h ASN 1330Ca -0.49 -0.19 -0.00 0.00 -3.08 0.00 0.00 56.30 52.54 3i4n h ASN 1330Cb 1.18 -0.16 -0.00 0.00 -2.08 0.00 0.00 38.32 37.26 3i4n h ASN 1330CO 0.56 0.79 0.01 -0.55 -2.08 0.00 0.00 177.43 176.16 3i4n s SER 1331N -6.78 3.82 0.33 6.14 0.15 -1.26 -4.74 113.70 111.36 3i4n s SER 1331Ca -0.08 -0.02 0.07 0.00 0.70 0.00 0.00 55.95 56.63 3i4n s SER 1331Cb 0.14 -2.55 0.77 0.00 -1.71 0.00 0.00 66.02 62.66 3i4n s SER 1331CO 0.80 -3.98 1.82 2.19 1.20 0.00 0.00 173.24 175.27 3i4n h PHE 1332N 12.62 0.96 -0.34 3.44 -0.00 -1.92 -0.72 116.94 130.98 3i4n h PHE 1332Ca 0.00 0.03 0.07 0.00 -0.00 0.00 0.00 57.97 58.07 3i4n h PHE 1332Cb 1.00 -0.30 -0.08 0.00 -0.00 0.00 0.00 35.95 36.57 3i4n h PHE 1332CO 1.15 0.28 -0.30 0.82 -0.00 0.00 0.00 178.31 180.26 3i4n h ILE 1333N 0.74 0.27 -0.63 0.88 1.08 -1.94 1.01 117.51 118.93 3i4n h ILE 1333Ca 0.52 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 65.01 3i4n h ILE 1333Cb 0.83 0.27 -0.03 0.00 -3.07 0.00 0.00 36.82 34.82 3i4n h ILE 1333CO -0.29 0.00 0.42 0.44 -0.69 0.00 0.00 178.15 178.02 3i4n h ASP 1334N -0.26 0.70 0.24 1.72 3.32 -1.54 -0.18 116.42 120.43 3i4n h ASP 1334Ca 0.16 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 57.03 3i4n h ASP 1334Cb 0.52 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 3i4n h ASP 1334CO -0.49 0.50 -0.64 0.40 -1.72 0.00 0.00 179.24 177.29 3i4n h ILE 1335N 0.83 1.37 -0.16 0.35 2.04 -0.01 -1.56 117.51 120.37 3i4n h ILE 1335Ca 0.24 -2.00 -0.15 0.00 1.00 0.00 0.00 64.86 63.95 3i4n h ILE 1335Cb -0.05 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 3i4n h ILE 1335CO -0.06 0.60 -0.53 -0.03 0.00 0.00 0.00 178.15 178.14 3i4n h MET 1336N 0.28 0.45 0.04 2.37 4.05 0.19 -2.17 114.93 120.13 3i4n h MET 1336Ca -0.01 -0.27 -0.00 0.00 -0.28 0.00 0.00 59.70 59.13 3i4n h MET 1336Cb 1.18 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 32.01 3i4n h MET 1336CO 0.11 0.86 -0.02 0.93 0.23 0.00 0.00 176.91 179.02 3i4n h GLU 1337N 0.35 -0.05 0.50 0.39 5.08 -0.99 -2.87 114.58 117.00 3i4n h GLU 1337Ca 0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 3i4n h GLU 1337Cb 1.04 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3i4n h GLU 1337CO 0.09 0.59 -0.24 0.28 -1.00 0.00 0.00 179.01 178.73 3i4n h VAL 1338N -0.78 0.20 0.00 3.13 2.07 -1.38 -3.42 116.25 116.07 3i4n h VAL 1338Ca -0.01 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3i4n h VAL 1338Cb 0.67 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 3i4n h VAL 1338CO 0.01 0.04 0.00 0.18 0.02 0.00 0.00 177.57 177.82 3i4n n LEU 1339N -5.24 0.41 0.00 2.57 4.77 -0.83 -5.07 117.00 113.61 3i4n n LEU 1339Ca -0.10 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.41 3i4n n LEU 1339Cb 0.30 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3i4n n LEU 1339CO 0.25 -0.41 0.00 0.61 -1.33 0.00 0.00 177.39 176.51 3i4n n GLY 1340N 1.39 1.50 0.00 -0.72 0.00 -1.09 -4.96 105.19 101.31 3i4n n GLY 1340Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3i4n n GLY 1340CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3i4n n ILE 1341N 0.00 0.00 -0.31 -0.61 3.06 -1.15 0.41 119.36 120.76 3i4n n ILE 1341Ca 0.00 0.00 0.12 0.00 -2.50 0.00 0.00 62.75 60.37 3i4n n ILE 1341Cb 0.00 0.00 0.29 0.00 0.54 0.00 0.00 39.64 40.47 3i4n n ILE 1341CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 3i4n h GLU 1342N 0.00 0.50 0.00 9.51 4.39 -1.95 2.74 114.58 129.77 3i4n h GLU 1342Ca 0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 3i4n h GLU 1342Cb 0.00 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.54 3i4n h GLU 1342CO 0.00 0.33 0.00 0.00 -1.16 0.00 0.00 179.01 178.18 3i4n h ALA 1343N 1.66 1.00 0.09 3.43 0.00 -0.39 -2.34 119.26 122.72 3i4n h ALA 1343Ca 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.45 3i4n h ALA 1343Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3i4n h ALA 1343CO -0.46 0.00 -0.04 0.78 0.00 0.00 0.00 179.25 179.52 3i4n h GLY 1344N 3.39 -0.13 -0.32 0.00 0.00 0.42 -2.88 103.07 103.54 3i4n h GLY 1344Ca 0.00 0.05 0.16 0.00 0.00 0.00 0.00 47.33 47.54 3i4n h GLY 1344CO 0.00 -0.05 -0.03 -0.09 0.00 0.00 0.00 176.54 176.37 3i4n h ARG 1345N -0.93 0.08 -0.24 4.80 2.43 0.14 0.21 114.38 120.87 3i4n h ARG 1345Ca -0.01 -0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3i4n h ARG 1345Cb 0.52 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 3i4n h ARG 1345CO 0.02 0.05 -0.14 0.00 -1.51 0.00 0.00 179.97 178.39 3i4n n ALA 1346N -2.96 -0.15 -0.32 2.80 0.00 -0.89 -0.21 120.51 118.78 3i4n n ALA 1346Ca 0.12 0.21 -0.04 0.00 0.00 0.00 0.00 53.44 53.73 3i4n n ALA 1346Cb 0.44 0.26 0.08 0.00 0.00 0.00 0.00 19.45 20.23 3i4n n ALA 1346CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n h ALA 1347N -0.47 1.08 0.20 0.00 0.00 -0.80 0.40 119.26 119.68 3i4n h ALA 1347Ca 0.04 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3i4n h ALA 1347Cb 0.10 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3i4n h ALA 1347CO -0.23 0.49 -0.27 1.25 0.00 0.00 0.00 179.25 180.49 3i4n h LEU 1348N 1.16 -0.75 0.55 0.00 5.85 0.53 0.70 115.31 123.36 3i4n h LEU 1348Ca 0.31 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 59.09 3i4n h LEU 1348Cb -0.13 0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 3i4n h LEU 1348CO -0.07 -0.38 -0.31 0.22 -0.34 0.00 0.00 178.44 177.56 3i4n h TYR 1349N -0.53 -0.81 -0.90 1.25 3.20 -0.31 -0.35 116.97 118.51 3i4n h TYR 1349Ca 0.01 -0.01 0.21 0.00 3.14 0.00 0.00 58.73 62.08 3i4n h TYR 1349Cb 0.52 0.28 -0.17 0.00 1.54 0.00 0.00 36.73 38.90 3i4n h TYR 1349CO -0.21 -0.48 -0.08 -0.22 -1.64 0.00 0.00 178.16 175.53 3i4n h LYS 1350N -0.81 0.03 0.50 1.82 3.11 0.27 0.89 116.57 122.38 3i4n h LYS 1350Ca -0.07 -0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.74 3i4n h LYS 1350Cb 0.64 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.87 3i4n h LYS 1350CO 0.09 0.02 -0.24 1.49 -2.81 0.00 0.00 179.45 178.00 3i4n h GLU 1351N 0.03 -0.64 -1.05 1.90 4.57 0.67 -3.01 114.58 117.05 3i4n h GLU 1351Ca 0.49 0.04 0.27 0.00 -1.18 0.00 0.00 59.36 58.98 3i4n h GLU 1351Cb 0.88 0.15 -0.10 0.00 -0.16 0.00 0.00 28.75 29.51 3i4n h GLU 1351CO -0.87 -0.39 0.67 0.28 -1.18 0.00 0.00 179.01 177.51 3i4n h VAL 1352N -1.14 0.51 -0.55 0.32 2.07 -0.48 0.48 116.25 117.46 3i4n h VAL 1352Ca -0.07 -0.14 0.01 0.00 0.82 0.00 0.00 66.70 67.33 3i4n h VAL 1352Cb 0.55 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 3i4n h VAL 1352CO 0.11 0.07 0.36 0.22 0.02 0.00 0.00 177.57 178.35 3i4n h TYR 1353N 0.40 0.67 0.00 1.57 3.20 -0.86 -1.21 116.97 120.74 3i4n h TYR 1353Ca 0.61 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.50 3i4n h TYR 1353Cb 1.53 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.57 3i4n h TYR 1353CO -0.00 0.42 0.00 0.09 -1.64 0.00 0.00 178.16 177.02 3i4n n ASN 1354N -4.72 0.00 -0.10 -2.11 3.02 0.17 0.13 115.26 111.64 3i4n n ASN 1354Ca 0.03 -0.87 -0.11 0.00 -0.03 0.00 0.00 54.58 53.60 3i4n n ASN 1354Cb 0.03 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.06 3i4n n ASN 1354CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3i4n n VAL 1355N -0.82 1.34 -0.00 2.41 0.31 -0.48 -3.37 118.33 117.70 3i4n n VAL 1355Ca 0.10 -0.76 0.01 0.00 -0.01 0.00 0.00 64.34 63.68 3i4n n VAL 1355Cb 0.05 -0.66 -0.12 0.00 -0.91 0.00 0.00 33.84 32.20 3i4n n VAL 1355CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3i4n n ILE 1356N -2.81 0.90 1.02 2.52 5.41 -0.85 -3.98 119.36 121.57 3i4n n ILE 1356Ca -0.34 -0.67 0.12 0.00 1.00 0.00 0.00 62.75 62.86 3i4n n ILE 1356Cb 1.09 -0.46 0.28 0.00 -0.71 0.00 0.00 39.64 39.85 3i4n n ILE 1356CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4n n ALA 1357N -2.43 3.44 -0.13 -1.39 0.00 0.12 -3.45 120.51 116.67 3i4n n ALA 1357Ca -0.13 -0.34 -0.12 0.00 0.00 0.00 0.00 53.44 52.85 3i4n n ALA 1357Cb 0.83 -1.14 -0.02 0.00 0.00 0.00 0.00 19.45 19.11 3i4n n ALA 1357CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3i4n h SER 1358N 0.07 0.87 0.00 0.00 4.64 -1.68 -1.94 113.55 115.51 3i4n h SER 1358Ca 0.00 -0.42 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3i4n h SER 1358Cb 0.50 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 3i4n h SER 1358CO 0.00 1.11 0.00 0.47 -0.87 0.00 0.00 176.83 177.54 3i4n n ASP 1359N -4.21 0.00 0.00 4.97 8.00 -1.25 -4.85 116.55 119.21 3i4n n ASP 1359Ca -0.02 -1.05 0.00 0.00 0.71 0.00 0.00 54.79 54.43 3i4n n ASP 1359Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.55 3i4n n ASP 1359CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3i4n n GLY 1360N 0.46 2.52 2.12 0.44 0.00 -0.73 -5.01 105.19 104.99 3i4n n GLY 1360Ca 0.12 -0.13 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 3i4n n GLY 1360CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3i4n n SER 1361N 0.83 -1.77 -3.78 1.61 7.64 -1.22 -4.87 113.62 112.05 3i4n n SER 1361Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.75 3i4n n SER 1361Cb 0.00 -0.37 -0.14 0.00 -1.01 0.00 0.00 64.21 62.69 3i4n n SER 1361CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 3i4n s TYR 1362N -1.49 -0.14 -0.04 1.43 5.04 -1.26 -4.56 117.35 116.33 3i4n s TYR 1362Ca 0.10 0.40 0.01 0.00 -2.44 0.00 0.00 57.07 55.14 3i4n s TYR 1362Cb 0.03 -0.04 0.02 0.00 0.35 0.00 0.00 41.96 42.32 3i4n s TYR 1362CO 0.18 -0.12 -0.06 0.08 -1.34 0.00 0.00 175.55 174.30 3i4n s VAL 1363N 0.72 0.60 -0.51 3.14 1.01 -1.26 -4.66 120.40 119.45 3i4n s VAL 1363Ca -0.05 -0.18 -0.28 0.00 0.00 0.00 0.00 61.98 61.47 3i4n s VAL 1363Cb -0.07 -0.61 -0.01 0.00 0.00 0.00 0.00 36.38 35.69 3i4n s VAL 1363CO -0.03 0.23 1.69 0.21 0.00 0.00 0.00 175.10 177.20 3i4n s ASN 1364N 0.78 5.76 0.00 3.32 3.04 -1.13 -4.87 114.94 121.83 3i4n s ASN 1364Ca -0.11 0.62 0.00 0.00 0.04 0.00 0.00 52.86 53.41 3i4n s ASN 1364Cb -0.14 -2.53 0.00 0.00 -1.54 0.00 0.00 41.25 37.04 3i4n s ASN 1364CO 0.01 -1.94 0.00 0.00 -3.04 0.00 0.00 177.10 172.13 3i4n n TYR 1365N 10.91 0.00 -0.12 0.43 9.36 -1.26 -0.81 117.16 135.67 3i4n n TYR 1365Ca 0.18 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.44 3i4n n TYR 1365Cb 0.50 0.00 0.07 0.00 -0.63 0.00 0.00 39.34 39.27 3i4n n TYR 1365CO 0.00 0.00 0.00 2.89 0.22 0.00 0.00 176.86 179.97 3i4n n ARG 1366N -0.20 -0.03 0.00 2.98 1.85 -1.26 0.28 116.66 120.28 3i4n n ARG 1366Ca 0.00 0.53 0.00 0.00 -1.00 0.00 0.00 57.85 57.38 3i4n n ARG 1366Cb 0.00 -0.81 0.00 0.00 -1.05 0.00 0.00 32.46 30.60 3i4n n ARG 1366CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3i4n n HIS 1367N -4.47 0.00 -0.21 2.89 8.25 0.01 0.09 115.22 121.78 3i4n n HIS 1367Ca 0.06 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.51 3i4n n HIS 1367Cb 0.20 -0.42 0.05 0.00 1.12 0.00 0.00 29.99 30.94 3i4n n HIS 1367CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 3i4n h MET 1368N 0.00 -0.06 -0.38 -0.41 2.86 -0.93 0.14 114.93 116.15 3i4n h MET 1368Ca 0.00 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 3i4n h MET 1368Cb 0.00 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.59 3i4n h MET 1368CO 0.00 -0.04 -0.21 0.00 1.06 0.00 0.00 176.91 177.72 3i4n h ALA 1369N 1.44 0.05 -0.15 6.32 0.00 -0.13 -0.22 119.26 126.56 3i4n h ALA 1369Ca 0.29 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.35 3i4n h ALA 1369Cb 0.51 0.49 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 3i4n h ALA 1369CO -0.67 -0.59 -0.24 1.25 0.00 0.00 0.00 179.25 179.00 3i4n h LEU 1370N -0.15 -0.79 -0.62 0.00 5.85 0.17 0.30 115.31 120.06 3i4n h LEU 1370Ca 0.19 0.10 0.11 0.00 0.84 0.00 0.00 57.88 59.12 3i4n h LEU 1370Cb 0.44 0.32 -0.12 0.00 0.37 0.00 0.00 40.66 41.67 3i4n h LEU 1370CO -0.47 -0.18 -0.32 0.25 -0.34 0.00 0.00 178.44 177.38 3i4n h LEU 1371N -0.19 -1.12 -1.24 2.25 5.85 -1.06 0.55 115.31 120.35 3i4n h LEU 1371Ca 0.03 0.23 0.18 0.00 0.84 0.00 0.00 57.88 59.15 3i4n h LEU 1371Cb 0.26 0.57 -0.08 0.00 0.37 0.00 0.00 40.66 41.78 3i4n h LEU 1371CO -0.24 -0.30 0.60 1.62 -0.34 0.00 0.00 178.44 179.78 3i4n h VAL 1372N -0.14 0.75 0.49 1.05 3.04 -0.18 -1.52 116.25 119.73 3i4n h VAL 1372Ca 0.25 -0.22 -0.02 0.00 -1.01 0.00 0.00 66.70 65.69 3i4n h VAL 1372Cb 0.55 0.04 0.00 0.00 -2.01 0.00 0.00 31.29 29.87 3i4n h VAL 1372CO -0.70 0.12 -0.23 0.44 -1.01 0.00 0.00 177.57 176.18 3i4n h ASP 1373N 0.65 -0.55 -1.26 3.17 3.32 0.37 -2.19 116.42 119.92 3i4n h ASP 1373Ca 0.50 -0.06 0.38 0.00 0.02 0.00 0.00 57.03 57.87 3i4n h ASP 1373Cb 0.91 0.14 -0.10 0.00 0.22 0.00 0.00 39.33 40.51 3i4n h ASP 1373CO -0.26 -0.15 0.84 0.58 -1.72 0.00 0.00 179.24 178.53 3i4n h VAL 1374N -1.07 0.29 -0.06 -1.35 2.07 0.27 0.62 116.25 117.02 3i4n h VAL 1374Ca -0.07 -0.06 -0.17 0.00 0.82 0.00 0.00 66.70 67.23 3i4n h VAL 1374Cb 0.58 0.11 0.01 0.00 -1.52 0.00 0.00 31.29 30.47 3i4n h VAL 1374CO 0.11 0.03 -0.62 0.24 0.02 0.00 0.00 177.57 177.35 3i4n h MET 1375N 0.16 0.52 0.07 1.57 2.86 -1.26 -3.39 114.93 115.46 3i4n h MET 1375Ca 0.71 -0.48 -0.00 0.00 -2.06 0.00 0.00 59.70 57.87 3i4n h MET 1375Cb 2.28 0.12 0.00 0.00 0.06 0.00 0.00 31.60 34.06 3i4n h MET 1375CO -0.28 1.12 -0.04 0.00 1.06 0.00 0.00 176.91 178.77 3i4n h THR 1376N 0.10 0.70 0.00 2.22 1.03 0.74 -1.86 112.91 115.83 3i4n h THR 1376Ca -0.06 -1.37 0.00 0.00 -0.01 0.00 0.00 66.41 64.97 3i4n h THR 1376Cb 1.29 1.28 0.00 0.00 -1.07 0.00 0.00 68.15 69.65 3i4n h THR 1376CO 0.12 0.22 0.00 0.35 -0.01 0.00 0.00 175.52 176.20 3i4n n THR 1377N -4.80 0.00 0.00 0.00 -2.24 0.51 -0.99 114.28 106.76 3i4n n THR 1377Ca -0.05 0.47 0.00 0.00 -2.27 0.00 0.00 64.05 62.20 3i4n n THR 1377Cb 0.21 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 3i4n n THR 1377CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 3i4n n GLN 1378N -1.66 0.00 0.00 -0.78 -0.06 -1.26 -4.51 117.38 109.11 3i4n n GLN 1378Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 3i4n n GLN 1378Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 3i4n n GLN 1378CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3i4n n GLY 1379N -0.98 1.50 0.00 1.69 0.00 -0.16 -5.10 105.19 102.13 3i4n n GLY 1379Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3i4n n GLY 1379CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4n n GLY 1380N 0.00 3.21 2.64 -0.02 0.00 -1.20 -5.03 105.19 104.79 3i4n n GLY 1380Ca 0.00 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.33 3i4n n GLY 1380CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i4n n LEU 1381N 0.00 3.22 -4.65 0.99 4.77 -1.26 -4.29 117.00 115.78 3i4n n LEU 1381Ca 0.00 -5.43 -0.45 0.00 -0.03 0.00 0.00 56.01 50.10 3i4n n LEU 1381Cb 0.00 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 40.87 3i4n n LEU 1381CO 0.00 2.29 1.61 0.41 -1.33 0.00 0.00 177.39 180.36 3i4n n THR 1382N 0.12 0.64 -2.67 -5.08 -1.04 -0.70 -4.94 114.28 100.61 3i4n n THR 1382Ca 0.29 -0.17 -0.36 0.00 -2.04 0.00 0.00 64.05 61.77 3i4n n THR 1382Cb 0.47 -2.17 -0.05 0.00 -1.82 0.00 0.00 70.33 66.76 3i4n n THR 1382CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3i4n s SER 1383N 4.92 6.91 -1.51 8.00 1.04 -1.26 -4.59 113.70 127.20 3i4n s SER 1383Ca 0.93 1.90 -0.10 0.00 0.48 0.00 0.00 55.95 59.15 3i4n s SER 1383Cb -0.53 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.01 3i4n s SER 1383CO 0.45 -0.38 2.62 0.52 0.98 0.00 0.00 173.24 177.43 3i4n n VAL 1384N -0.12 4.28 -3.62 5.02 0.31 -0.53 0.33 118.33 124.00 3i4n n VAL 1384Ca 0.05 -3.11 -0.13 0.00 -0.01 0.00 0.00 64.34 61.14 3i4n n VAL 1384Cb 0.51 -2.51 -0.06 0.00 -0.91 0.00 0.00 33.84 30.88 3i4n n VAL 1384CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3i4n s THR 1385N 1.72 0.04 0.27 2.52 -4.23 -1.26 -4.85 115.64 109.86 3i4n s THR 1385Ca 0.60 -0.37 0.17 0.00 -1.18 0.00 0.00 61.69 60.91 3i4n s THR 1385Cb 0.16 -0.98 0.27 0.00 1.34 0.00 0.00 72.50 73.29 3i4n s THR 1385CO -0.07 -0.20 1.12 -1.14 -0.54 0.00 0.00 174.62 173.79 3i4n n ARG 1386N 0.37 -0.04 -0.01 3.99 0.63 -1.26 0.68 116.66 121.01 3i4n n ARG 1386Ca -0.18 0.96 -0.13 0.00 -0.92 0.00 0.00 57.85 57.59 3i4n n ARG 1386Cb 0.61 -1.76 -0.09 0.00 0.45 0.00 0.00 32.46 31.66 3i4n n ARG 1386CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3i4n h HIS 1387N 0.00 0.07 0.00 -0.14 3.86 -1.92 -3.40 115.15 113.62 3i4n h HIS 1387Ca 0.61 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.80 3i4n h HIS 1387Cb 1.69 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 30.14 3i4n h HIS 1387CO -0.01 0.45 0.00 0.41 0.86 0.00 0.00 177.93 179.64 3i4n n GLY 1388N -0.01 1.15 0.21 2.45 0.00 0.21 -4.69 105.19 104.52 3i4n n GLY 1388Ca -0.08 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.97 3i4n n GLY 1388CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3i4n n PHE 1389N 0.00 0.16 0.18 1.61 1.16 0.15 -0.93 117.46 119.79 3i4n n PHE 1389Ca 0.00 0.69 0.00 0.00 -1.87 0.00 0.00 57.45 56.27 3i4n n PHE 1389Cb 0.00 -0.80 0.00 0.00 -1.61 0.00 0.00 39.48 37.07 3i4n n PHE 1389CO 0.00 0.00 0.00 -1.71 -1.87 0.00 0.00 176.76 173.18 3i4n n ASN 1390N -4.90 2.53 0.00 5.98 5.15 -1.25 -2.53 115.26 120.23 3i4n n ASN 1390Ca 0.08 -1.53 0.00 0.00 -0.60 0.00 0.00 54.58 52.53 3i4n n ASN 1390Cb 0.27 -0.49 0.00 0.00 -0.53 0.00 0.00 39.78 39.03 3i4n n ASN 1390CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 3i4n n ARG 1391N 1.16 1.83 -0.67 1.20 -4.01 -0.11 -4.95 116.66 111.11 3i4n n ARG 1391Ca 0.00 0.00 -0.32 0.00 -1.04 0.00 0.00 57.85 56.49 3i4n n ARG 1391Cb 0.31 -0.90 0.17 0.00 -3.04 0.00 0.00 32.46 29.00 3i4n n ARG 1391CO 0.00 0.00 0.00 -1.13 -3.04 0.00 0.00 177.63 173.46 3i4n n SER 1392N -1.35 -1.94 -0.34 2.89 3.41 -1.05 -4.75 113.62 110.48 3i4n n SER 1392Ca 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 3i4n n SER 1392Cb 0.12 -1.13 0.00 0.00 -0.26 0.00 0.00 64.21 62.94 3i4n n SER 1392CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3i4n n ASN 1393N -2.37 0.00 -4.63 4.04 3.02 -1.26 -4.80 115.26 109.25 3i4n n ASN 1393Ca 0.04 -0.01 -0.33 0.00 -0.03 0.00 0.00 54.58 54.26 3i4n n ASN 1393Cb 0.57 -0.00 0.14 0.00 -0.61 0.00 0.00 39.78 39.88 3i4n n ASN 1393CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3i4n n THR 1394N 0.18 1.01 -0.72 3.41 -1.04 -1.26 -4.89 114.28 110.97 3i4n n THR 1394Ca 0.00 -0.14 -0.32 0.00 -2.04 0.00 0.00 64.05 61.55 3i4n n THR 1394Cb 0.00 -1.02 0.15 0.00 -1.82 0.00 0.00 70.33 67.64 3i4n n THR 1394CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3i4n n GLY 1395N 0.64 -1.32 0.19 3.41 0.00 -1.26 -4.83 105.19 102.02 3i4n n GLY 1395Ca 0.12 -0.76 -0.16 0.00 0.00 0.00 0.00 46.02 45.21 3i4n n GLY 1395CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4n h ALA 1396N -1.79 0.25 -0.98 4.61 0.00 -1.90 -3.02 119.26 116.43 3i4n h ALA 1396Ca -0.45 -0.54 0.23 0.00 0.00 0.00 0.00 54.91 54.15 3i4n h ALA 1396Cb 1.28 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.97 3i4n h ALA 1396CO 0.38 0.50 0.63 -0.07 0.00 0.00 0.00 179.25 180.69 3i4n h LEU 1397N 0.30 0.50 0.00 0.00 3.38 -1.97 0.12 115.31 117.63 3i4n h LEU 1397Ca -0.04 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3i4n h LEU 1397Cb 1.24 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3i4n h LEU 1397CO 0.12 0.16 0.00 0.80 0.09 0.00 0.00 178.44 179.61 3i4n n MET 1398N -4.60 0.00 -0.60 1.13 1.56 -1.15 -3.47 117.12 109.98 3i4n n MET 1398Ca 0.23 0.03 0.47 0.00 -0.27 0.00 0.00 57.70 58.15 3i4n n MET 1398Cb 0.75 -0.80 0.71 0.00 2.15 0.00 0.00 33.22 36.04 3i4n n MET 1398CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 3i4n n ARG 1399N -0.60 0.00 -0.02 2.12 1.74 -1.15 0.15 116.66 118.91 3i4n n ARG 1399Ca 0.00 0.99 0.15 0.00 -0.77 0.00 0.00 57.85 58.23 3i4n n ARG 1399Cb 0.00 -2.32 0.60 0.00 -1.02 0.00 0.00 32.46 29.72 3i4n n ARG 1399CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3i4n n SER 1401N -4.44 6.43 -2.68 0.00 3.41 0.41 -3.10 113.62 113.65 3i4n n SER 1401Ca 0.09 -3.16 -0.03 0.00 -0.26 0.00 0.00 58.87 55.50 3i4n n SER 1401Cb 0.46 -1.22 0.04 0.00 -0.26 0.00 0.00 64.21 63.23 3i4n n SER 1401CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3i4n n PHE 1402N 0.88 -0.90 0.00 7.33 7.35 -1.09 -4.98 117.46 126.05 3i4n n PHE 1402Ca 0.47 -0.71 0.00 0.00 -0.76 0.00 0.00 57.45 56.45 3i4n n PHE 1402Cb 0.57 1.12 0.00 0.00 0.35 0.00 0.00 39.48 41.52 3i4n n PHE 1402CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 3i4n n GLU 1403N 2.52 0.00 0.22 -4.13 1.02 -1.26 -4.62 120.64 114.39 3i4n n GLU 1403Ca 0.11 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.35 3i4n n GLU 1403Cb 0.65 0.00 0.46 0.00 -0.02 0.00 0.00 31.44 32.53 3i4n n GLU 1403CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3i4n h GLU 1404N 0.00 0.00 0.00 3.49 4.39 -1.83 -3.46 114.58 117.17 3i4n h GLU 1404Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3i4n h GLU 1404Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3i4n h GLU 1404CO 0.00 0.23 0.00 2.41 -1.16 0.00 0.00 179.01 180.49 3i4n n THR 1405N -3.42 0.00 0.29 1.13 -1.04 -1.18 -1.30 114.28 108.76 3i4n n THR 1405Ca -0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 3i4n n THR 1405Cb 0.43 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.87 3i4n n THR 1405CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3i4n h VAL 1406N 0.00 0.00 -0.73 12.58 2.07 -1.87 -2.53 116.25 125.77 3i4n h VAL 1406Ca 0.00 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.82 3i4n h VAL 1406Cb 0.00 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.64 3i4n h VAL 1406CO 0.00 0.00 0.40 -0.62 0.02 0.00 0.00 177.57 177.37 3i4n n GLU 1407N -4.44 -0.04 -0.01 1.57 1.02 -0.42 0.51 120.64 118.82 3i4n n GLU 1407Ca -0.10 0.99 -0.13 0.00 -0.02 0.00 0.00 57.16 57.90 3i4n n GLU 1407Cb 0.34 -1.79 -0.10 0.00 -0.02 0.00 0.00 31.44 29.87 3i4n n GLU 1407CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3i4n h ILE 1408N 0.00 1.39 -0.58 -3.67 2.04 -1.34 -3.04 117.51 112.31 3i4n h ILE 1408Ca 0.61 -1.16 0.02 0.00 1.00 0.00 0.00 64.86 65.34 3i4n h ILE 1408Cb 1.63 2.18 -0.03 0.00 -0.74 0.00 0.00 36.82 39.86 3i4n h ILE 1408CO -0.55 0.30 0.38 -0.07 0.00 0.00 0.00 178.15 178.22 3i4n h LEU 1409N -0.49 0.61 0.18 1.44 3.38 0.46 -1.95 115.31 118.94 3i4n h LEU 1409Ca 0.00 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.97 3i4n h LEU 1409Cb 0.49 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3i4n h LEU 1409CO 0.00 0.43 -0.25 -0.26 0.09 0.00 0.00 178.44 178.45 3i4n h PHE 1410N 0.71 -0.65 0.00 1.13 0.05 -1.21 0.36 116.94 117.33 3i4n h PHE 1410Ca 0.23 0.01 0.00 0.00 3.82 0.00 0.00 57.97 62.02 3i4n h PHE 1410Cb 0.03 0.26 0.00 0.00 2.00 0.00 0.00 35.95 38.24 3i4n h PHE 1410CO -0.00 -0.35 0.00 0.39 -0.18 0.00 0.00 178.31 178.17 3i4n n GLU 1411N -5.37 0.12 -0.07 1.51 -0.58 -0.79 -1.56 120.64 113.90 3i4n n GLU 1411Ca -0.07 0.17 -0.21 0.00 -0.42 0.00 0.00 57.16 56.63 3i4n n GLU 1411Cb 0.28 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.52 3i4n n GLU 1411CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3i4n h ALA 1412N 2.33 0.23 -0.18 0.62 0.00 -0.28 -2.90 119.26 119.08 3i4n h ALA 1412Ca 0.00 -1.11 -0.13 0.00 0.00 0.00 0.00 54.91 53.67 3i4n h ALA 1412Cb 0.05 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3i4n h ALA 1412CO 0.00 0.67 -0.44 0.78 0.00 0.00 0.00 179.25 180.26 3i4n h GLY 1413N -0.68 0.47 0.45 0.00 0.00 -0.93 0.24 103.07 102.62 3i4n h GLY 1413Ca -0.30 -0.48 -0.02 0.00 0.00 0.00 0.00 47.33 46.53 3i4n h GLY 1413CO -0.12 0.43 -0.22 0.00 0.00 0.00 0.00 176.54 176.63 3i4n h ALA 1414N 1.18 -1.13 0.00 3.60 0.00 -1.44 -2.89 119.26 118.58 3i4n h ALA 1414Ca 0.03 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3i4n h ALA 1414Cb 0.91 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3i4n h ALA 1414CO 0.08 -1.08 0.00 0.43 0.00 0.00 0.00 179.25 178.67 3i4n n SER 1415N -3.69 0.00 -4.09 0.00 7.64 -1.09 -4.72 113.62 107.68 3i4n n SER 1415Ca -0.08 -1.80 -0.43 0.00 1.01 0.00 0.00 58.87 57.58 3i4n n SER 1415Cb 0.24 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.45 3i4n n SER 1415CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i4n n ALA 1416N -0.53 -2.44 -1.10 -0.43 0.00 0.66 -4.86 120.51 111.81 3i4n n ALA 1416Ca 0.01 -0.55 -0.29 0.00 0.00 0.00 0.00 53.44 52.61 3i4n n ALA 1416Cb 0.01 -2.20 0.21 0.00 0.00 0.00 0.00 19.45 17.46 3i4n n ALA 1416CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3i4n s GLU 1417N -7.32 -0.37 -0.01 0.00 2.02 -0.11 -4.73 118.70 108.18 3i4n s GLU 1417Ca 0.42 0.28 0.02 0.00 0.02 0.00 0.00 54.97 55.71 3i4n s GLU 1417Cb -0.23 -1.66 -0.00 0.00 0.10 0.00 0.00 34.13 32.33 3i4n s GLU 1417CO 0.91 -3.22 -0.07 -1.17 0.02 0.00 0.00 175.26 171.73 3i4n s LEU 1418N -6.71 1.97 -0.15 1.80 2.96 -1.26 -1.91 118.68 115.37 3i4n s LEU 1418Ca 0.68 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 54.47 3i4n s LEU 1418Cb -0.15 -0.40 0.01 0.00 0.50 0.00 0.00 46.19 46.15 3i4n s LEU 1418CO 0.57 0.08 -0.20 -0.62 -1.32 0.00 0.00 176.35 174.87 3i4n s ASP 1419N -0.11 3.21 0.23 3.68 -1.08 -0.01 -4.75 116.67 117.85 3i4n s ASP 1419Ca 0.02 -0.60 -0.06 0.00 -0.52 0.00 0.00 52.55 51.39 3i4n s ASP 1419Cb -0.04 -1.48 0.37 0.00 -1.46 0.00 0.00 42.92 40.32 3i4n s ASP 1419CO -0.00 0.06 1.76 0.44 0.52 0.00 0.00 175.17 177.94 3i4n h ASP 1420N 7.51 0.36 -2.05 -0.34 3.32 -1.89 -2.56 116.42 120.76 3i4n h ASP 1420Ca -0.36 0.08 -0.11 0.00 0.02 0.00 0.00 57.03 56.66 3i4n h ASP 1420Cb 1.18 0.03 0.03 0.00 0.22 0.00 0.00 39.33 40.79 3i4n h ASP 1420CO 0.58 0.19 -0.18 0.00 -1.72 0.00 0.00 179.24 178.11 3i4n n ARG 1422N -1.70 1.33 -3.01 0.00 1.74 -1.26 -4.80 116.66 108.96 3i4n n ARG 1422Ca -0.01 -0.38 -0.39 0.00 -0.77 0.00 0.00 57.85 56.29 3i4n n ARG 1422Cb 0.52 -1.34 -0.06 0.00 -1.02 0.00 0.00 32.46 30.56 3i4n n ARG 1422CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3i4n s GLY 1423N -2.43 2.89 0.04 -0.13 0.00 -1.26 -4.56 107.32 101.87 3i4n s GLY 1423Ca 0.10 0.32 -0.09 0.00 0.00 0.00 0.00 44.72 45.05 3i4n s GLY 1423CO 0.61 0.84 1.16 -2.08 0.00 0.00 0.00 173.10 173.63 3i4n h VAL 1424N 3.40 0.00 -0.62 1.40 2.07 -1.93 -1.61 116.25 118.96 3i4n h VAL 1424Ca -0.47 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.17 3i4n h VAL 1424Cb 1.21 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.86 3i4n h VAL 1424CO 0.66 0.00 -0.24 0.28 0.02 0.00 0.00 177.57 178.29 3i4n h SER 1425N -0.07 -0.86 -0.24 0.57 0.02 -1.98 -2.95 113.55 108.04 3i4n h SER 1425Ca 0.03 0.21 0.02 0.00 -0.84 0.00 0.00 61.79 61.21 3i4n h SER 1425Cb 0.15 0.48 -0.03 0.00 0.14 0.00 0.00 62.40 63.15 3i4n h SER 1425CO -0.21 -0.26 -0.14 -0.62 -1.14 0.00 0.00 176.83 174.46 3i4n n GLU 1426N -5.45 -0.10 -0.28 3.45 -0.58 -0.62 -0.77 120.64 116.29 3i4n n GLU 1426Ca 0.06 1.04 0.05 0.00 -0.42 0.00 0.00 57.16 57.89 3i4n n GLU 1426Cb 0.35 -1.55 0.19 0.00 -0.57 0.00 0.00 31.44 29.86 3i4n n GLU 1426CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 3i4n h ASN 1427N 0.00 0.52 -0.63 1.62 2.35 -1.37 0.21 115.58 118.28 3i4n h ASN 1427Ca 0.04 0.08 0.11 0.00 -0.55 0.00 0.00 56.30 55.97 3i4n h ASN 1427Cb 0.10 -0.01 -0.08 0.00 0.05 0.00 0.00 38.32 38.38 3i4n h ASN 1427CO -0.22 0.26 0.21 0.58 -1.65 0.00 0.00 177.43 176.60 3i4n h VAL 1428N 0.64 0.71 -0.21 2.81 2.07 -0.81 1.01 116.25 122.48 3i4n h VAL 1428Ca 0.42 -0.13 -0.14 0.00 0.82 0.00 0.00 66.70 67.67 3i4n h VAL 1428Cb 0.52 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 3i4n h VAL 1428CO -0.32 0.07 -0.47 0.40 0.02 0.00 0.00 177.57 177.27 3i4n h ILE 1429N 0.37 1.31 -0.00 4.57 2.04 -0.03 -2.94 117.51 122.83 3i4n h ILE 1429Ca 0.33 -1.67 0.00 0.00 1.00 0.00 0.00 64.86 64.52 3i4n h ILE 1429Cb 0.45 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 3i4n h ILE 1429CO -0.35 0.52 -0.05 0.18 0.00 0.00 0.00 178.15 178.45 3i4n n LEU 1430N -4.00 0.23 -2.12 1.44 4.77 0.21 -4.92 117.00 112.61 3i4n n LEU 1430Ca -0.02 0.12 -0.17 0.00 -0.03 0.00 0.00 56.01 55.91 3i4n n LEU 1430Cb 0.55 -0.21 0.01 0.00 -2.33 0.00 0.00 43.42 41.45 3i4n n LEU 1430CO 0.46 0.04 -0.11 0.61 -1.33 0.00 0.00 177.39 177.06 3i4n n GLY 1431N 1.25 -0.28 3.58 -0.72 0.00 0.33 -5.00 105.19 104.35 3i4n n GLY 1431Ca 0.15 -0.14 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 3i4n n GLY 1431CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i4n s GLN 1432N -5.11 2.09 0.09 1.61 -0.21 -0.24 -5.02 119.66 112.85 3i4n s GLN 1432Ca 0.11 -1.36 -0.31 0.00 0.02 0.00 0.00 55.36 53.82 3i4n s GLN 1432Cb -0.05 -2.12 -0.07 0.00 1.00 0.00 0.00 33.01 31.77 3i4n s GLN 1432CO 0.14 0.40 1.36 1.41 -2.12 0.00 0.00 175.29 176.48 3i4n s MET 1433N -3.14 4.33 0.25 2.91 -2.45 -1.26 -4.32 119.30 115.62 3i4n s MET 1433Ca 0.27 2.01 -0.10 0.00 -1.25 0.00 0.00 55.69 56.62 3i4n s MET 1433Cb -0.08 -3.31 -0.07 0.00 1.25 0.00 0.00 34.83 32.62 3i4n s MET 1433CO 0.16 -0.42 0.58 0.00 1.05 0.00 0.00 175.02 176.39 3i4n s ALA 1434N 1.27 3.54 -0.23 4.11 0.00 -1.26 -4.92 121.76 124.26 3i4n s ALA 1434Ca 0.63 -0.25 -0.24 0.00 0.00 0.00 0.00 51.96 52.11 3i4n s ALA 1434Cb -0.35 -2.47 -0.26 0.00 0.00 0.00 0.00 23.12 20.04 3i4n s ALA 1434CO 0.30 0.46 1.62 -2.30 0.00 0.00 0.00 175.76 175.83 3i4n n PRO 1435N -0.25 0.46 -3.75 0.00 -0.02 -1.21 -4.11 135.00 126.12 3i4n n PRO 1435Ca 0.01 -1.16 -0.20 0.00 -2.02 0.00 0.00 63.50 60.13 3i4n n PRO 1435Cb 0.53 -2.53 -0.17 0.00 -0.02 0.00 0.00 33.50 31.30 3i4n n PRO 1435CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3i4n s ILE 1436N 6.09 0.06 0.00 4.25 1.01 0.88 -4.81 121.20 128.69 3i4n s ILE 1436Ca 0.56 0.27 0.00 0.00 0.00 0.00 0.00 60.65 61.48 3i4n s ILE 1436Cb 0.13 -0.25 0.00 0.00 0.01 0.00 0.00 42.46 42.34 3i4n s ILE 1436CO 0.23 0.18 0.00 0.61 0.00 0.00 0.00 174.94 175.96 3i4n n GLY 1437N 4.93 0.72 0.39 6.18 0.00 -0.51 0.68 105.19 117.58 3i4n n GLY 1437Ca -0.11 0.77 0.25 0.00 0.00 0.00 0.00 46.02 46.93 3i4n n GLY 1437CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3i4n h THR 1438N 0.00 0.41 -2.76 2.61 2.02 -1.91 -2.12 112.91 111.16 3i4n h THR 1438Ca 0.00 -0.12 -0.76 0.00 0.77 0.00 0.00 66.41 66.29 3i4n h THR 1438Cb 0.00 0.02 -0.31 0.00 -1.74 0.00 0.00 68.15 66.12 3i4n h THR 1438CO 0.00 0.07 0.47 0.61 0.37 0.00 0.00 175.52 177.03 3i4n n GLY 1439N -1.42 5.09 0.01 2.16 0.00 0.21 -4.48 105.19 106.76 3i4n n GLY 1439Ca 0.29 -2.69 0.00 0.00 0.00 0.00 0.00 46.02 43.62 3i4n n GLY 1439CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4n n ALA 1440N 1.23 1.53 -3.81 4.61 0.00 -0.80 -0.08 120.51 123.19 3i4n n ALA 1440Ca 0.27 -0.78 -0.05 0.00 0.00 0.00 0.00 53.44 52.87 3i4n n ALA 1440Cb 0.35 -0.01 -0.01 0.00 0.00 0.00 0.00 19.45 19.78 3i4n n ALA 1440CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3i4n s PHE 1441N -0.54 -0.11 0.05 0.00 -0.12 -1.26 -5.03 117.98 110.97 3i4n s PHE 1441Ca 0.00 -0.29 0.06 0.00 -0.05 0.00 0.00 56.93 56.65 3i4n s PHE 1441Cb 0.00 0.69 -0.04 0.00 -0.63 0.00 0.00 43.02 43.05 3i4n s PHE 1441CO 0.00 -1.05 -0.13 -0.51 -0.05 0.00 0.00 175.22 173.48 3i4n s ASP 1442N -2.99 4.18 -0.08 1.98 1.01 -1.26 -5.11 116.67 114.40 3i4n s ASP 1442Ca 0.13 -0.35 -0.01 0.00 0.71 0.00 0.00 52.55 53.03 3i4n s ASP 1442Cb -0.03 -0.79 -0.03 0.00 1.01 0.00 0.00 42.92 43.08 3i4n s ASP 1442CO 0.05 0.24 -0.02 -0.69 0.21 0.00 0.00 175.17 174.96 3i4n s VAL 1443N -1.03 4.10 0.04 -1.27 1.01 -1.26 -5.11 120.40 116.87 3i4n s VAL 1443Ca 0.17 -0.34 -0.08 0.00 0.00 0.00 0.00 61.98 61.74 3i4n s VAL 1443Cb -0.11 -2.71 -0.00 0.00 0.00 0.00 0.00 36.38 33.56 3i4n s VAL 1443CO 0.08 0.60 0.15 -0.04 0.00 0.00 0.00 175.10 175.89 3i4n s MET 1444N -0.88 0.64 -0.26 2.72 1.00 -1.26 -5.14 119.30 116.13 3i4n s MET 1444Ca 0.13 -0.67 -0.17 0.00 0.00 0.00 0.00 55.69 54.98 3i4n s MET 1444Cb -0.11 0.26 -0.03 0.00 0.00 0.00 0.00 34.83 34.95 3i4n s MET 1444CO 0.02 -0.18 0.48 0.96 0.00 0.00 0.00 175.02 176.31 3i4n s ILE 1445N -2.54 5.10 -0.74 2.53 -5.25 -1.26 -5.02 121.20 114.02 3i4n s ILE 1445Ca -0.05 0.82 -0.15 0.00 -0.99 0.00 0.00 60.65 60.27 3i4n s ILE 1445Cb -0.01 -3.80 0.18 0.00 2.95 0.00 0.00 42.46 41.78 3i4n s ILE 1445CO -0.04 0.11 0.71 -0.62 -1.79 0.00 0.00 174.94 173.31 3i4n s ASP 1446N 1.53 6.55 0.34 4.36 3.68 -1.26 -4.93 116.67 126.95 3i4n s ASP 1446Ca 0.20 -2.31 0.16 0.00 2.13 0.00 0.00 52.55 52.74 3i4n s ASP 1446Cb -0.16 -2.23 1.18 0.00 -1.45 0.00 0.00 42.92 40.26 3i4n s ASP 1446CO 0.09 -0.73 1.52 1.21 0.13 0.00 0.00 175.17 177.40 3i4n n GLU 1447N 4.68 -0.06 -0.03 4.34 2.13 -1.26 -1.09 120.64 129.35 3i4n n GLU 1447Ca 0.05 1.36 -0.01 0.00 0.66 0.00 0.00 57.16 59.22 3i4n n GLU 1447Cb 0.45 -2.37 -0.01 0.00 0.27 0.00 0.00 31.44 29.78 3i4n n GLU 1447CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 3i4n h GLU 1448N 0.00 -0.01 -0.65 5.31 5.08 -2.01 -0.40 114.58 121.90 3i4n h GLU 1448Ca 0.77 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 59.19 3i4n h GLU 1448Cb 1.95 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 31.15 3i4n h GLU 1448CO -0.78 -0.01 0.35 0.66 -1.00 0.00 0.00 179.01 178.23 3i4n h SER 1449N -0.01 0.52 0.00 1.42 4.64 -1.53 -1.83 113.55 116.76 3i4n h SER 1449Ca 0.01 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3i4n h SER 1449Cb 0.04 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 3i4n h SER 1449CO -0.07 0.33 0.01 -0.11 -0.87 0.00 0.00 176.83 176.12 3i4n n LEU 1450N -4.81 0.00 -0.00 5.97 7.94 -0.22 -0.93 117.00 124.95 3i4n n LEU 1450Ca 0.08 0.02 -0.00 0.00 -1.11 0.00 0.00 56.01 55.00 3i4n n LEU 1450Cb 0.17 -0.02 -0.00 0.00 0.53 0.00 0.00 43.42 44.10 3i4n n LEU 1450CO 0.29 -0.02 -0.51 0.52 -1.11 0.00 0.00 177.39 176.55 3i4n n VAL 1451N -0.88 0.02 0.92 1.96 0.31 -0.71 -4.53 118.33 115.42 3i4n n VAL 1451Ca 0.00 -0.01 0.01 0.00 -0.01 0.00 0.00 64.34 64.34 3i4n n VAL 1451Cb 0.01 -0.59 0.09 0.00 -0.91 0.00 0.00 33.84 32.44 3i4n n VAL 1451CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3i4n n LYS 1452N -2.43 0.46 -3.89 5.55 5.02 -0.11 -3.82 118.16 118.94 3i4n n LYS 1452Ca -0.01 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.99 3i4n n LYS 1452Cb 0.51 -1.10 -0.12 0.00 -0.02 0.00 0.00 35.03 34.30 3i4n n LYS 1452CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3i4n s TYR 1453N -2.00 3.44 0.00 2.13 4.12 -0.96 -5.00 117.35 119.08 3i4n s TYR 1453Ca 0.04 -3.23 0.00 0.00 0.02 0.00 0.00 57.07 53.91 3i4n s TYR 1453Cb 0.02 -2.82 0.00 0.00 -1.52 0.00 0.00 41.96 37.64 3i4n s TYR 1453CO 0.03 -0.65 0.00 0.00 0.02 0.00 0.00 175.55 174.96 3i4n n MET 1454N 2.50 0.00 0.00 -0.62 0.00 -1.25 -4.97 117.12 112.78 3i4n n MET 1454Ca 0.14 0.00 0.15 0.00 0.00 0.00 0.00 57.70 57.99 3i4n n MET 1454Cb 0.34 0.00 0.81 0.00 0.00 0.00 0.00 33.22 34.38 3i4n n MET 1454CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62