#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i1m s ARG 2 N 0.00 1.99 0.04 0.00 0.52 -1.26 -4.92 118.95 115.33 3i1m s ARG 2 Ca 0.00 1.65 -0.15 0.00 -0.52 0.00 0.00 55.73 56.71 3i1m s ARG 2 Cb 0.00 -1.83 -0.07 0.00 0.52 0.00 0.00 34.95 33.58 3i1m s ARG 2 CO 0.00 -1.92 1.24 -0.92 0.02 0.00 0.00 175.30 173.72 3i1m h TYR 3 N -0.61 -0.67 0.00 -0.53 3.20 -1.98 -3.46 116.97 112.91 3i1m h TYR 3 Ca -0.46 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.42 3i1m h TYR 3 Cb 1.28 0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.84 3i1m h TYR 3 CO 0.49 -0.26 0.00 1.28 -1.64 0.00 0.00 178.16 178.02 3i1m n LEU 4 N -3.76 0.00 0.00 2.82 4.32 -1.26 -5.01 117.00 114.11 3i1m n LEU 4 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.95 3i1m n LEU 4 Cb 0.18 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.98 3i1m n LEU 4 CO 0.07 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.85 3i1m n GLY 5 N -2.00 -0.07 3.66 -0.72 0.00 -1.26 -5.00 105.19 99.79 3i1m n GLY 5 Ca 0.00 -1.74 -0.43 0.00 0.00 0.00 0.00 46.02 43.85 3i1m n GLY 5 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3i1m s PRO 6 N 0.40 4.15 0.03 1.61 0.02 -1.26 -4.96 135.00 134.99 3i1m s PRO 6 Ca 0.00 1.85 -0.25 0.00 0.02 0.00 0.00 61.00 62.62 3i1m s PRO 6 Cb 0.00 -3.89 -0.17 0.00 0.02 0.00 0.00 34.50 30.46 3i1m s PRO 6 CO 0.00 -0.84 1.46 1.57 -0.33 0.00 0.00 177.00 178.86 3i1m h LYS 7 N 9.05 -0.19 -0.33 5.54 2.10 -1.95 -3.32 116.57 127.47 3i1m h LYS 7 Ca -0.32 0.01 0.07 0.00 -2.00 0.00 0.00 60.65 58.41 3i1m h LYS 7 Cb 1.14 0.04 -0.07 0.00 -0.90 0.00 0.00 32.23 32.44 3i1m h LYS 7 CO 0.97 0.06 -0.11 -0.07 -2.00 0.00 0.00 179.45 178.30 3i1m h LEU 8 N -0.43 -0.40 -0.86 7.07 -0.00 -1.94 -1.66 115.31 117.09 3i1m h LEU 8 Ca -0.02 0.11 0.22 0.00 -0.00 0.00 0.00 57.88 58.20 3i1m h LEU 8 Cb 0.34 0.24 -0.14 0.00 -0.00 0.00 0.00 40.66 41.10 3i1m h LEU 8 CO 0.03 -0.15 0.22 0.50 -0.00 0.00 0.00 178.44 179.05 3i1m h LYS 9 N -0.04 0.21 0.23 1.13 3.64 -1.96 0.08 116.57 119.86 3i1m h LYS 9 Ca 0.16 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.54 3i1m h LYS 9 Cb 0.29 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 3i1m h LYS 9 CO -0.37 0.14 -0.47 -0.07 -2.27 0.00 0.00 179.45 176.41 3i1m h LEU 10 N 0.21 -1.36 -1.37 5.20 3.38 -1.41 -0.83 115.31 119.13 3i1m h LEU 10 Ca 0.53 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.64 3i1m h LEU 10 Cb 1.06 0.49 0.00 0.00 0.09 0.00 0.00 40.66 42.30 3i1m h LEU 10 CO -0.64 -0.56 0.07 -1.28 0.09 0.00 0.00 178.44 176.12 3i1m h SER 11 N -0.78 0.00 0.02 -0.43 0.87 -0.96 -1.81 113.55 110.46 3i1m h SER 11 Ca -0.01 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 3i1m h SER 11 Cb 0.75 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 3i1m h SER 11 CO -0.20 0.00 -0.01 0.03 -0.53 0.00 0.00 176.83 176.12 3i1m h ARG 12 N 0.00 -0.02 -0.99 2.24 3.08 -0.14 -3.20 114.38 115.35 3i1m h ARG 12 Ca 0.00 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.07 3i1m h ARG 12 Cb 0.14 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.15 3i1m h ARG 12 CO 0.00 0.73 0.65 -0.09 -1.07 0.00 0.00 179.97 180.20 3i1m h ARG 13 N -0.93 1.29 0.00 0.04 9.65 -0.95 -2.76 114.38 120.71 3i1m h ARG 13 Ca -0.00 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 58.80 3i1m h ARG 13 Cb 0.77 -0.29 0.00 0.00 -1.39 0.00 0.00 29.97 29.06 3i1m h ARG 13 CO 0.00 0.85 0.00 0.39 2.80 0.00 0.00 179.97 184.02 3i1m n GLU 14 N -4.40 0.14 -1.26 0.20 -0.58 -1.05 -4.89 120.64 108.79 3i1m n GLU 14 Ca 0.12 0.29 -0.03 0.00 -0.42 0.00 0.00 57.16 57.13 3i1m n GLU 14 Cb 0.02 -1.73 -0.01 0.00 -0.57 0.00 0.00 31.44 29.15 3i1m n GLU 14 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i1m n GLY 15 N 0.43 0.52 3.58 0.62 0.00 -1.04 -5.01 105.19 104.28 3i1m n GLY 15 Ca 0.04 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 3i1m n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i1m s THR 16 N -2.10 0.00 0.42 2.61 2.01 -1.21 -5.09 115.64 112.28 3i1m s THR 16 Ca 0.00 -1.44 -0.19 0.00 0.31 0.00 0.00 61.69 60.37 3i1m s THR 16 Cb 0.00 -2.69 -0.10 0.00 0.01 0.00 0.00 72.50 69.72 3i1m s THR 16 CO 0.00 0.00 0.91 -0.62 -0.69 0.00 0.00 174.62 174.22 3i1m s ASP 17 N -3.19 6.86 0.00 3.53 3.68 -1.26 -4.55 116.67 121.74 3i1m s ASP 17 Ca 0.26 1.58 0.00 0.00 2.13 0.00 0.00 52.55 56.52 3i1m s ASP 17 Cb -0.02 -2.50 0.00 0.00 -1.45 0.00 0.00 42.92 38.96 3i1m s ASP 17 CO 0.18 -0.35 0.47 0.18 0.13 0.00 0.00 175.17 175.78 3i1m n LEU 18 N -0.70 0.72 -3.08 -1.34 4.77 -1.26 -5.03 117.00 111.08 3i1m n LEU 18 Ca 0.06 -0.72 -0.16 0.00 -0.03 0.00 0.00 56.01 55.16 3i1m n LEU 18 Cb 0.54 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.70 3i1m n LEU 18 CO 0.39 0.18 0.12 0.49 -1.33 0.00 0.00 177.39 177.24 3i1m n PHE 19 N -0.11 -1.99 -0.10 -1.77 3.01 -1.26 -4.85 117.46 110.40 3i1m n PHE 19 Ca 0.00 0.81 -0.13 0.00 1.01 0.00 0.00 57.45 59.15 3i1m n PHE 19 Cb 0.24 -4.59 -0.15 0.00 -0.01 0.00 0.00 39.48 34.97 3i1m n PHE 19 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 3i1m n LEU 20 N -3.80 1.04 -1.30 4.37 4.77 -1.26 -4.10 117.00 116.72 3i1m n LEU 20 Ca -0.19 0.01 0.09 0.00 -0.03 0.00 0.00 56.01 55.89 3i1m n LEU 20 Cb 0.62 -0.00 0.31 0.00 -2.33 0.00 0.00 43.42 42.02 3i1m n LEU 20 CO 0.53 0.63 0.77 1.17 -1.33 0.00 0.00 177.39 179.15 3i1m n LYS 21 N -2.96 3.41 -0.10 3.23 0.00 -1.26 -4.78 118.16 115.71 3i1m n LYS 21 Ca -0.35 -2.72 0.07 0.00 0.00 0.00 0.00 58.31 55.31 3i1m n LYS 21 Cb 1.10 -1.75 0.13 0.00 0.00 0.00 0.00 35.03 34.51 3i1m n LYS 21 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 3i1m n SER 22 N 0.82 0.04 0.00 3.14 7.64 -1.26 -4.32 113.62 119.68 3i1m n SER 22 Ca 0.23 0.49 0.00 0.00 1.01 0.00 0.00 58.87 60.59 3i1m n SER 22 Cb 0.79 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.78 3i1m n SER 22 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i1m n GLY 23 N -1.11 0.00 0.26 0.23 0.00 -1.26 -3.42 105.19 99.89 3i1m n GLY 23 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 3i1m n GLY 23 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3i1m h VAL 24 N 0.00 0.00 -2.78 1.61 2.07 -1.99 -3.47 116.25 111.69 3i1m h VAL 24 Ca 0.00 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 66.99 3i1m h VAL 24 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 3i1m h VAL 24 CO 0.00 0.00 0.00 -2.11 0.02 0.00 0.00 177.57 175.48 3i1m n ARG 25 N -5.09 1.29 0.00 1.57 -4.01 -1.22 -4.94 116.66 104.27 3i1m n ARG 25 Ca -0.08 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.73 3i1m n ARG 25 Cb 0.24 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.66 3i1m n ARG 25 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 3i1m n ALA 26 N -3.00 0.00 -3.90 2.89 0.00 -1.26 -4.25 120.51 110.99 3i1m n ALA 26 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 3i1m n ALA 26 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 3i1m n ALA 26 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3i1m n ILE 27 N 0.00 -2.75 0.00 0.00 5.41 -1.26 -4.62 119.36 116.14 3i1m n ILE 27 Ca 0.00 -0.27 0.00 0.00 1.00 0.00 0.00 62.75 63.48 3i1m n ILE 27 Cb 0.00 -2.40 0.00 0.00 -0.71 0.00 0.00 39.64 36.53 3i1m n ILE 27 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 3i1m n ASP 28 N -2.22 0.00 -1.16 4.38 3.85 -1.26 -4.96 116.55 115.17 3i1m n ASP 28 Ca -0.21 0.00 0.11 0.00 -0.71 0.00 0.00 54.79 53.98 3i1m n ASP 28 Cb 0.60 0.00 -0.06 0.00 -1.35 0.00 0.00 41.12 40.30 3i1m n ASP 28 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 3i1m n THR 29 N 0.00 -0.72 -3.51 2.12 -1.04 -1.26 -4.85 114.28 105.02 3i1m n THR 29 Ca 0.00 0.67 -0.19 0.00 -2.04 0.00 0.00 64.05 62.49 3i1m n THR 29 Cb 0.00 -1.02 0.08 0.00 -1.82 0.00 0.00 70.33 67.57 3i1m n THR 29 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3i1m n LYS 30 N -3.87 -6.45 0.00 -2.82 4.01 -1.26 -4.78 118.16 102.99 3i1m n LYS 30 Ca -0.06 0.80 0.00 0.00 -0.51 0.00 0.00 58.31 58.54 3i1m n LYS 30 Cb 0.46 -5.74 0.00 0.00 -0.51 0.00 0.00 35.03 29.25 3i1m n LYS 30 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3i1m n LYS 32 N 0.00 0.00 -1.58 0.00 4.01 -1.26 -4.95 118.16 114.38 3i1m n LYS 32 Ca 0.00 0.12 -0.65 0.00 -0.51 0.00 0.00 58.31 57.27 3i1m n LYS 32 Cb 0.00 -3.07 -0.10 0.00 -0.51 0.00 0.00 35.03 31.35 3i1m n LYS 32 CO 0.00 0.00 0.00 1.51 -1.11 0.00 0.00 177.40 177.80 3i1m n ILE 33 N -3.34 0.00 0.00 -0.18 0.13 -1.26 -3.41 119.36 111.30 3i1m n ILE 33 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 3i1m n ILE 33 Cb 0.31 -0.49 0.00 0.00 -0.84 0.00 0.00 39.64 38.61 3i1m n ILE 33 CO 0.00 0.00 0.00 1.21 2.80 0.00 0.00 176.55 180.56 3i1m n GLU 34 N 4.90 0.00 0.00 9.51 4.07 -1.26 -4.85 120.64 133.01 3i1m n GLU 34 Ca 0.37 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.47 3i1m n GLU 34 Cb -0.05 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.33 3i1m n GLU 34 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 3i1m n GLN 35 N 0.00 0.07 0.00 5.31 6.02 -1.22 -3.45 117.38 124.11 3i1m n GLN 35 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3i1m n GLN 35 Cb 0.00 -1.10 0.00 0.00 1.02 0.00 0.00 30.24 30.16 3i1m n GLN 35 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3i1m n ALA 36 N 0.54 0.00 0.30 -1.58 0.00 -1.26 -3.72 120.51 114.80 3i1m n ALA 36 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.63 3i1m n ALA 36 Cb 0.02 0.00 0.96 0.00 0.00 0.00 0.00 19.45 20.43 3i1m n ALA 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3i1m h PRO 37 N 0.00 0.00 0.00 0.00 0.11 -1.81 -3.46 132.00 126.84 3i1m h PRO 37 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3i1m h PRO 37 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3i1m h PRO 37 CO 0.00 0.03 0.00 0.41 -0.21 0.00 0.00 178.00 178.23 3i1m n GLY 38 N -0.76 4.11 0.05 -0.55 0.00 -1.26 -4.92 105.19 101.86 3i1m n GLY 38 Ca -0.02 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.68 3i1m n GLY 38 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3i1m n GLN 39 N 0.00 0.66 -1.41 1.61 0.00 -1.26 -4.19 117.38 112.79 3i1m n GLN 39 Ca 0.00 -0.07 -0.21 0.00 -0.00 0.00 0.00 57.00 56.72 3i1m n GLN 39 Cb 0.00 -1.59 0.10 0.00 0.00 0.00 0.00 30.24 28.75 3i1m n GLN 39 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 3i1m n HIS 40 N -2.50 2.37 0.13 3.69 8.25 -1.26 -4.75 115.22 121.15 3i1m n HIS 40 Ca -0.11 -2.24 -0.00 0.00 -0.26 0.00 0.00 57.72 55.11 3i1m n HIS 40 Cb 0.74 -0.73 0.27 0.00 1.12 0.00 0.00 29.99 31.39 3i1m n HIS 40 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 3i1m h GLY 41 N 1.70 0.15 1.33 -1.41 0.00 -1.84 -2.83 103.07 100.18 3i1m h GLY 41 Ca 0.40 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.60 3i1m h GLY 41 CO 0.89 0.12 0.00 0.00 0.00 0.00 0.00 176.54 177.56 3i1m n ALA 42 N -2.47 2.05 -1.75 3.60 0.00 -1.24 -4.20 120.51 116.50 3i1m n ALA 42 Ca -0.02 -0.10 -0.38 0.00 0.00 0.00 0.00 53.44 52.94 3i1m n ALA 42 Cb 0.46 -1.29 0.03 0.00 0.00 0.00 0.00 19.45 18.65 3i1m n ALA 42 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3i1m s ARG 43 N -2.33 3.25 -0.93 0.00 1.81 -1.07 -4.95 118.95 114.72 3i1m s ARG 43 Ca 0.21 2.22 -0.19 0.00 -1.72 0.00 0.00 55.73 56.25 3i1m s ARG 43 Cb 0.12 -2.31 0.12 0.00 -0.45 0.00 0.00 34.95 32.43 3i1m s ARG 43 CO 0.25 -1.10 1.16 0.21 -0.68 0.00 0.00 175.30 175.13 3i1m s LYS 44 N -2.84 3.57 -1.30 3.54 2.20 -1.26 -4.96 119.74 118.69 3i1m s LYS 44 Ca 0.70 -1.64 -0.17 0.00 -0.36 0.00 0.00 55.97 54.49 3i1m s LYS 44 Cb -0.40 -4.93 0.08 0.00 -1.51 0.00 0.00 37.83 31.06 3i1m s LYS 44 CO 0.48 -1.82 1.75 -2.30 -0.36 0.00 0.00 175.35 173.09 3i1m n PRO 45 N 6.87 3.19 -1.56 4.03 -0.02 -1.26 -4.91 135.00 141.34 3i1m n PRO 45 Ca 0.24 -3.28 -0.43 0.00 -2.02 0.00 0.00 63.50 58.01 3i1m n PRO 45 Cb 0.49 -3.45 -0.04 0.00 -0.02 0.00 0.00 33.50 30.48 3i1m n PRO 45 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3i1m n ARG 46 N 8.06 1.59 -4.32 -0.52 1.74 -1.26 -4.91 116.66 117.05 3i1m n ARG 46 Ca 0.48 0.37 -0.28 0.00 -0.77 0.00 0.00 57.85 57.66 3i1m n ARG 46 Cb 0.45 -3.13 -0.11 0.00 -1.02 0.00 0.00 32.46 28.66 3i1m n ARG 46 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 3i1m s LEU 47 N 9.02 2.76 0.88 0.55 2.34 -1.26 -5.12 118.68 127.86 3i1m s LEU 47 Ca 1.02 -0.61 -0.11 0.00 0.06 0.00 0.00 54.13 54.49 3i1m s LEU 47 Cb -0.40 -1.53 0.12 0.00 -0.56 0.00 0.00 46.19 43.82 3i1m s LEU 47 CO 0.36 0.14 1.09 -0.94 -1.06 0.00 0.00 176.35 175.94 3i1m s SER 48 N -2.48 3.60 0.10 1.48 1.04 -1.26 -4.67 113.70 111.51 3i1m s SER 48 Ca 0.21 1.48 -0.32 0.00 0.48 0.00 0.00 55.95 57.79 3i1m s SER 48 Cb -0.09 -2.16 -0.13 0.00 0.10 0.00 0.00 66.02 63.74 3i1m s SER 48 CO 0.12 -2.56 1.58 -0.78 0.98 0.00 0.00 173.24 172.58 3i1m h ASP 49 N -1.49 -1.27 -0.61 7.02 -0.00 -1.99 -0.05 116.42 118.02 3i1m h ASP 49 Ca -0.49 0.13 0.12 0.00 -0.00 0.00 0.00 57.03 56.79 3i1m h ASP 49 Cb 1.28 0.46 -0.12 0.00 -0.00 0.00 0.00 39.33 40.95 3i1m h ASP 49 CO 0.55 -0.54 -0.14 0.22 -0.00 0.00 0.00 179.24 179.33 3i1m h TYR 50 N -0.75 -0.30 0.00 0.28 3.20 -1.96 0.11 116.97 117.55 3i1m h TYR 50 Ca -0.01 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3i1m h TYR 50 Cb 0.73 0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.23 3i1m h TYR 50 CO -0.33 -0.26 0.00 0.41 -1.64 0.00 0.00 178.16 176.34 3i1m n GLY 51 N -1.42 -3.54 0.35 1.82 0.00 -0.27 -0.35 105.19 101.78 3i1m n GLY 51 Ca 0.07 0.67 0.16 0.00 0.00 0.00 0.00 46.02 46.93 3i1m n GLY 51 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3i1m h VAL 52 N 0.00 0.59 -0.02 1.61 -1.51 -0.92 0.98 116.25 116.98 3i1m h VAL 52 Ca 0.00 -0.22 0.01 0.00 -1.23 0.00 0.00 66.70 65.26 3i1m h VAL 52 Cb 0.00 -0.10 -0.00 0.00 -2.13 0.00 0.00 31.29 29.06 3i1m h VAL 52 CO 0.00 0.12 0.11 -0.61 -1.23 0.00 0.00 177.57 175.96 3i1m h GLN 53 N 0.64 0.00 0.00 5.19 4.15 0.42 0.83 115.11 126.33 3i1m h GLN 53 Ca 0.62 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.04 3i1m h GLN 53 Cb 1.11 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.80 3i1m h GLN 53 CO -0.45 0.00 -0.11 -0.11 -1.93 0.00 0.00 178.83 176.23 3i1m n LEU 54 N -3.14 0.35 -0.25 -2.39 0.00 0.33 -4.01 117.00 107.88 3i1m n LEU 54 Ca -0.02 0.29 0.24 0.00 0.00 0.00 0.00 56.01 56.52 3i1m n LEU 54 Cb 0.18 -0.57 0.43 0.00 0.00 0.00 0.00 43.42 43.46 3i1m n LEU 54 CO 0.19 -0.49 0.77 -1.14 0.00 0.00 0.00 177.39 176.73 3i1m n ARG 55 N -2.72 -0.04 0.14 1.96 3.00 -0.37 0.88 116.66 119.51 3i1m n ARG 55 Ca -0.02 0.94 -0.14 0.00 -0.00 0.00 0.00 57.85 58.64 3i1m n ARG 55 Cb 0.06 -1.73 -0.08 0.00 0.00 0.00 0.00 32.46 30.70 3i1m n ARG 55 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 3i1m h GLU 56 N 0.00 -0.31 -0.36 -0.14 4.57 -1.03 -1.60 114.58 115.72 3i1m h GLU 56 Ca 0.60 0.02 -0.12 0.00 -1.18 0.00 0.00 59.36 58.68 3i1m h GLU 56 Cb 1.69 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 30.34 3i1m h GLU 56 CO -0.48 -0.10 -0.26 1.57 -1.18 0.00 0.00 179.01 178.55 3i1m h LYS 57 N -0.46 0.74 -0.67 1.92 5.09 0.36 -2.69 116.57 120.87 3i1m h LYS 57 Ca -0.03 -0.32 0.02 0.00 0.09 0.00 0.00 60.65 60.42 3i1m h LYS 57 Cb 0.35 -0.03 -0.04 0.00 0.10 0.00 0.00 32.23 32.61 3i1m h LYS 57 CO 0.05 0.93 0.42 0.37 -2.09 0.00 0.00 179.45 179.13 3i1m h GLN 58 N 0.64 0.81 -0.41 0.07 5.75 -0.97 -2.57 115.11 118.43 3i1m h GLN 58 Ca 0.08 -0.05 0.07 0.00 -0.15 0.00 0.00 58.65 58.60 3i1m h GLN 58 Cb 0.78 -0.18 -0.09 0.00 1.07 0.00 0.00 27.48 29.05 3i1m h GLN 58 CO 0.06 0.54 -0.46 -0.22 -2.65 0.00 0.00 178.83 176.10 3i1m h LYS 59 N 0.84 -0.33 -0.83 1.69 3.64 -0.94 -0.76 116.57 119.88 3i1m h LYS 59 Ca 0.27 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.71 3i1m h LYS 59 Cb -0.00 0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.84 3i1m h LYS 59 CO -0.10 -0.22 0.54 0.28 -2.27 0.00 0.00 179.45 177.69 3i1m h VAL 60 N -0.34 1.11 -0.73 2.00 2.07 -1.43 0.77 116.25 119.70 3i1m h VAL 60 Ca 0.12 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3i1m h VAL 60 Cb 0.59 0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 3i1m h VAL 60 CO -0.58 0.18 0.44 0.03 0.02 0.00 0.00 177.57 177.66 3i1m h ARG 61 N 0.99 0.99 -0.06 1.57 3.08 -0.98 -1.85 114.38 118.13 3i1m h ARG 61 Ca 0.34 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 60.18 3i1m h ARG 61 Cb 0.08 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 3i1m h ARG 61 CO -0.10 0.70 -0.51 0.00 -1.07 0.00 0.00 179.97 178.98 3i1m h ARG 62 N 1.00 0.15 0.00 0.04 2.47 0.47 0.54 114.38 119.06 3i1m h ARG 62 Ca 0.26 -0.09 0.00 0.00 -1.26 0.00 0.00 59.98 58.89 3i1m h ARG 62 Cb -0.04 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 3i1m h ARG 62 CO -0.05 0.63 0.00 0.97 0.56 0.00 0.00 179.97 182.08 3i1m h ILE 63 N 0.12 0.00 0.00 2.04 2.10 -0.67 -3.24 117.51 117.86 3i1m h ILE 63 Ca 0.00 -0.90 0.00 0.00 1.08 0.00 0.00 64.86 65.04 3i1m h ILE 63 Cb 0.95 1.90 0.00 0.00 -1.09 0.00 0.00 36.82 38.58 3i1m h ILE 63 CO 0.07 0.00 -1.30 -1.22 -1.08 0.00 0.00 178.15 174.63 3i1m n TYR 64 N -3.02 0.00 -1.93 2.19 4.02 -0.73 -5.01 117.16 112.68 3i1m n TYR 64 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 3i1m n TYR 64 Cb 0.50 -0.21 0.00 0.00 -0.02 0.00 0.00 39.34 39.61 3i1m n TYR 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3i1m n GLY 65 N 1.59 0.73 3.76 2.72 0.00 0.08 -4.96 105.19 109.10 3i1m n GLY 65 Ca -0.01 -0.71 -0.36 0.00 0.00 0.00 0.00 46.02 44.95 3i1m n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i1m s VAL 66 N -2.35 4.82 0.55 1.61 1.01 -0.59 -4.91 120.40 120.54 3i1m s VAL 66 Ca 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 61.98 61.94 3i1m s VAL 66 Cb 0.00 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.35 3i1m s VAL 66 CO 0.00 0.60 0.77 -0.76 0.00 0.00 0.00 175.10 175.71 3i1m s LEU 67 N -0.85 3.27 0.06 3.92 1.43 -1.26 -4.62 118.68 120.64 3i1m s LEU 67 Ca 0.13 -0.02 -0.26 0.00 -1.03 0.00 0.00 54.13 52.96 3i1m s LEU 67 Cb -0.12 -2.87 -0.12 0.00 0.03 0.00 0.00 46.19 43.12 3i1m s LEU 67 CO 0.03 -1.14 1.40 -0.33 0.23 0.00 0.00 176.35 176.54 3i1m h GLU 68 N 0.07 -0.67 -0.84 1.70 4.39 -1.99 -1.37 114.58 115.88 3i1m h GLU 68 Ca -0.42 0.05 0.20 0.00 0.34 0.00 0.00 59.36 59.53 3i1m h GLU 68 Cb 1.30 0.15 -0.15 0.00 -0.10 0.00 0.00 28.75 29.95 3i1m h GLU 68 CO 0.52 -0.45 0.01 -0.09 -1.16 0.00 0.00 179.01 177.85 3i1m h ARG 69 N -0.70 0.08 -0.15 2.33 9.65 -2.00 0.25 114.38 123.85 3i1m h ARG 69 Ca -0.04 -0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.68 3i1m h ARG 69 Cb 0.62 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.17 3i1m h ARG 69 CO -0.08 0.05 -0.55 0.37 2.80 0.00 0.00 179.97 182.56 3i1m h GLN 70 N 0.08 0.46 -0.23 0.20 4.15 -1.92 -1.76 115.11 116.10 3i1m h GLN 70 Ca 0.47 -0.29 -0.02 0.00 0.77 0.00 0.00 58.65 59.58 3i1m h GLN 70 Cb 0.88 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.60 3i1m h GLN 70 CO -0.75 0.90 0.06 0.35 -1.93 0.00 0.00 178.83 177.45 3i1m h PHE 71 N 0.36 0.38 0.16 3.99 3.04 0.57 -0.89 116.94 124.55 3i1m h PHE 71 Ca 0.01 -0.05 0.01 0.00 3.98 0.00 0.00 57.97 61.92 3i1m h PHE 71 Cb 1.08 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 39.45 3i1m h PHE 71 CO 0.04 0.47 -0.27 0.00 -2.02 0.00 0.00 178.31 176.53 3i1m h ARG 72 N 0.19 -0.48 -1.03 1.11 2.47 -1.00 0.15 114.38 115.78 3i1m h ARG 72 Ca 0.07 0.03 0.38 0.00 -1.26 0.00 0.00 59.98 59.21 3i1m h ARG 72 Cb 0.28 0.11 -0.16 0.00 -1.65 0.00 0.00 29.97 28.54 3i1m h ARG 72 CO 0.00 -0.32 0.58 -0.91 0.56 0.00 0.00 179.97 179.88 3i1m h ASN 73 N -0.50 0.39 0.22 7.04 -0.26 -1.07 0.28 115.58 121.68 3i1m h ASN 73 Ca 0.02 0.22 -0.01 0.00 -0.56 0.00 0.00 56.30 55.97 3i1m h ASN 73 Cb 0.51 0.20 0.00 0.00 -1.06 0.00 0.00 38.32 37.97 3i1m h ASN 73 CO -0.12 -0.29 -0.10 1.88 -1.06 0.00 0.00 177.43 177.73 3i1m h TYR 74 N 0.14 -0.27 -0.20 1.19 0.05 -0.16 -2.76 116.97 114.96 3i1m h TYR 74 Ca 0.80 -0.01 0.04 0.00 0.05 0.00 0.00 58.73 59.62 3i1m h TYR 74 Cb 2.05 0.09 -0.07 0.00 1.01 0.00 0.00 36.73 39.81 3i1m h TYR 74 CO -0.01 0.12 -0.50 -0.92 -1.05 0.00 0.00 178.16 175.80 3i1m h TYR 75 N -0.76 -1.47 -0.47 4.88 5.03 0.14 0.66 116.97 124.98 3i1m h TYR 75 Ca -0.03 0.06 0.14 0.00 2.58 0.00 0.00 58.73 61.48 3i1m h TYR 75 Cb 0.50 0.67 -0.02 0.00 1.55 0.00 0.00 36.73 39.43 3i1m h TYR 75 CO 0.05 -0.51 0.38 0.87 -1.32 0.00 0.00 178.16 177.63 3i1m h LYS 76 N -0.50 0.00 0.00 1.82 1.57 -0.78 0.33 116.57 119.01 3i1m h LYS 76 Ca 0.06 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3i1m h LYS 76 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.96 3i1m h LYS 76 CO -0.47 0.00 -0.00 1.49 -0.57 0.00 0.00 179.45 179.90 3i1m h GLU 77 N 0.00 -0.00 -0.79 3.15 4.57 -0.48 -2.80 114.58 118.22 3i1m h GLU 77 Ca 0.22 0.00 0.16 0.00 -1.18 0.00 0.00 59.36 58.56 3i1m h GLU 77 Cb 0.97 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.51 3i1m h GLU 77 CO -0.00 0.77 0.53 0.00 -1.18 0.00 0.00 179.01 179.12 3i1m h ALA 78 N 0.22 2.10 0.52 2.92 0.00 0.26 -2.40 119.26 122.88 3i1m h ALA 78 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3i1m h ALA 78 Cb 0.77 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.50 3i1m h ALA 78 CO 0.00 -0.31 -0.25 0.00 0.00 0.00 0.00 179.25 178.69 3i1m h ALA 79 N 1.63 -0.97 -0.96 0.00 0.00 -0.51 -3.27 119.26 115.18 3i1m h ALA 79 Ca 0.39 -0.15 0.14 0.00 0.00 0.00 0.00 54.91 55.29 3i1m h ALA 79 Cb 0.88 0.27 -0.15 0.00 0.00 0.00 0.00 17.79 18.79 3i1m h ALA 79 CO -0.14 -0.92 -0.40 -0.09 0.00 0.00 0.00 179.25 177.70 3i1m h ARG 80 N -0.84 -0.02 -6.76 0.00 2.43 -1.18 -3.40 114.38 104.61 3i1m h ARG 80 Ca -0.07 0.00 -0.56 0.00 -0.81 0.00 0.00 59.98 58.54 3i1m h ARG 80 Cb 0.54 0.00 0.10 0.00 -0.42 0.00 0.00 29.97 30.19 3i1m h ARG 80 CO 0.12 -0.01 0.69 1.28 -1.51 0.00 0.00 179.97 180.54 3i1m n LEU 81 N -5.45 3.93 -4.72 3.80 4.77 -0.94 -4.96 117.00 113.43 3i1m n LEU 81 Ca 0.09 1.18 -0.33 0.00 -0.03 0.00 0.00 56.01 56.92 3i1m n LEU 81 Cb 0.39 -1.53 0.11 0.00 -2.33 0.00 0.00 43.42 40.05 3i1m n LEU 81 CO -0.12 -0.17 0.77 -0.75 -1.33 0.00 0.00 177.39 175.78 3i1m s LYS 82 N -1.20 1.94 0.00 3.23 2.20 -1.26 -4.79 119.74 119.86 3i1m s LYS 82 Ca 0.60 1.67 0.00 0.00 -0.36 0.00 0.00 55.97 57.88 3i1m s LYS 82 Cb -0.55 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 33.95 3i1m s LYS 82 CO 0.56 -1.97 0.00 0.41 -0.36 0.00 0.00 175.35 173.99 3i1m n GLY 83 N 0.22 2.37 3.57 5.54 0.00 -1.26 -4.95 105.19 110.69 3i1m n GLY 83 Ca 0.13 -1.83 -0.54 0.00 0.00 0.00 0.00 46.02 43.78 3i1m n GLY 83 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3i1m n ASN 84 N 0.00 2.32 -0.30 1.61 5.15 -1.26 -4.82 115.26 117.96 3i1m n ASN 84 Ca 0.00 0.76 0.07 0.00 -0.60 0.00 0.00 54.58 54.81 3i1m n ASN 84 Cb 0.00 -1.20 0.17 0.00 -0.53 0.00 0.00 39.78 38.21 3i1m n ASN 84 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 3i1m h THR 85 N 6.15 0.18 -0.30 -0.44 2.02 -1.87 -1.36 112.91 117.28 3i1m h THR 85 Ca -0.37 -0.01 0.06 0.00 0.77 0.00 0.00 66.41 66.86 3i1m h THR 85 Cb 1.32 0.14 -0.08 0.00 -1.74 0.00 0.00 68.15 67.79 3i1m h THR 85 CO 0.99 0.01 -0.45 1.23 0.37 0.00 0.00 175.52 177.66 3i1m h GLY 86 N 0.04 -0.71 1.26 2.16 0.00 -1.90 -2.02 103.07 101.90 3i1m h GLY 86 Ca 0.46 0.58 -0.12 0.00 0.00 0.00 0.00 47.33 48.24 3i1m h GLY 86 CO -0.82 -0.19 -0.23 1.05 0.00 0.00 0.00 176.54 176.35 3i1m h GLU 87 N -0.41 0.85 0.00 4.80 4.11 -1.62 -2.53 114.58 119.77 3i1m h GLU 87 Ca 0.10 -0.35 0.00 0.00 0.07 0.00 0.00 59.36 59.18 3i1m h GLU 87 Cb 0.61 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3i1m h GLU 87 CO -0.51 0.99 0.00 0.27 0.07 0.00 0.00 179.01 179.83 3i1m n ASN 88 N -4.11 0.45 -0.00 3.06 0.23 -1.11 -0.81 115.26 112.97 3i1m n ASN 88 Ca 0.00 0.55 -0.10 0.00 -0.53 0.00 0.00 54.58 54.51 3i1m n ASN 88 Cb 0.45 -0.67 -0.04 0.00 -2.08 0.00 0.00 39.78 37.44 3i1m n ASN 88 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 3i1m h LEU 89 N 0.00 -0.20 -0.14 -4.53 5.85 -0.92 0.22 115.31 115.58 3i1m h LEU 89 Ca 0.00 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 3i1m h LEU 89 Cb 0.58 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3i1m h LEU 89 CO 0.00 -0.09 0.07 -0.07 -0.34 0.00 0.00 178.44 178.02 3i1m h LEU 90 N -0.06 0.19 -0.46 2.25 3.38 -1.32 -0.14 115.31 119.15 3i1m h LEU 90 Ca 0.07 -0.11 0.07 0.00 0.09 0.00 0.00 57.88 58.00 3i1m h LEU 90 Cb 0.16 -0.05 -0.09 0.00 0.09 0.00 0.00 40.66 40.77 3i1m h LEU 90 CO -0.15 0.24 -0.47 0.00 0.09 0.00 0.00 178.44 178.15 3i1m h ALA 91 N 0.95 -0.51 -0.26 1.53 0.00 -0.67 0.35 119.26 120.65 3i1m h ALA 91 Ca 0.05 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.06 3i1m h ALA 91 Cb 0.10 0.99 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 3i1m h ALA 91 CO -0.01 -0.91 -0.52 -0.07 0.00 0.00 0.00 179.25 177.74 3i1m h LEU 92 N -0.32 -1.71 -0.71 0.00 -0.00 -0.41 0.18 115.31 112.33 3i1m h LEU 92 Ca 0.13 0.21 0.14 0.00 -0.00 0.00 0.00 57.88 58.37 3i1m h LEU 92 Cb 0.58 0.68 -0.14 0.00 -0.00 0.00 0.00 40.66 41.79 3i1m h LEU 92 CO -0.62 -0.42 -0.19 -0.07 -0.00 0.00 0.00 178.44 177.14 3i1m h LEU 93 N -0.46 -0.70 -1.10 1.67 3.38 0.83 0.22 115.31 119.15 3i1m h LEU 93 Ca 0.05 0.22 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 3i1m h LEU 93 Cb 0.60 0.45 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 3i1m h LEU 93 CO -0.49 -0.24 -0.15 -0.08 0.09 0.00 0.00 178.44 177.56 3i1m h GLU 94 N -0.01 0.00 0.00 1.13 4.57 0.11 -2.79 114.58 117.58 3i1m h GLU 94 Ca 0.34 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.50 3i1m h GLU 94 Cb 0.53 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.11 3i1m h GLU 94 CO -0.74 0.15 -0.08 0.78 -1.18 0.00 0.00 179.01 177.95 3i1m h GLY 95 N 2.24 0.00 -4.43 1.92 0.00 0.15 -3.39 103.07 99.56 3i1m h GLY 95 Ca -0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 3i1m h GLY 95 CO 0.02 0.00 0.34 0.54 0.00 0.00 0.00 176.54 177.44 3i1m n ARG 96 N -3.34 1.71 -0.18 4.80 1.74 -1.06 -1.48 116.66 118.86 3i1m n ARG 96 Ca -0.01 0.60 -0.07 0.00 -0.77 0.00 0.00 57.85 57.60 3i1m n ARG 96 Cb 0.26 -2.09 0.09 0.00 -1.02 0.00 0.00 32.46 29.69 3i1m n ARG 96 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3i1m h LEU 97 N 2.58 0.94 -0.50 0.55 6.46 -1.73 -1.43 115.31 122.17 3i1m h LEU 97 Ca -0.43 -0.24 0.10 0.00 -0.12 0.00 0.00 57.88 57.20 3i1m h LEU 97 Cb 1.31 -0.25 -0.09 0.00 -0.73 0.00 0.00 40.66 40.90 3i1m h LEU 97 CO 0.64 0.97 -0.07 -2.24 -0.62 0.00 0.00 178.44 177.13 3i1m h ASP 98 N 0.90 -0.35 -0.74 1.25 2.03 -1.89 -0.72 116.42 116.90 3i1m h ASP 98 Ca 0.17 0.14 0.02 0.00 -0.73 0.00 0.00 57.03 56.63 3i1m h ASP 98 Cb 0.48 0.27 -0.04 0.00 -0.83 0.00 0.00 39.33 39.20 3i1m h ASP 98 CO 0.02 -0.13 0.48 -1.13 -1.03 0.00 0.00 179.24 177.46 3i1m h ASN 99 N 0.05 0.82 0.00 4.15 -1.24 -1.74 -2.63 115.58 114.98 3i1m h ASN 99 Ca 0.25 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.25 3i1m h ASN 99 Cb 0.38 -0.19 0.00 0.00 0.73 0.00 0.00 38.32 39.24 3i1m h ASN 99 CO -0.47 0.58 0.00 0.52 -1.29 0.00 0.00 177.43 176.76 3i1m n VAL 100 N -4.60 0.00 0.00 2.57 0.31 -0.32 -0.10 118.33 116.20 3i1m n VAL 100 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 3i1m n VAL 100 Cb 0.05 -0.39 0.00 0.00 -0.91 0.00 0.00 33.84 32.59 3i1m n VAL 100 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3i1m n VAL 101 N -0.11 0.00 -0.12 2.52 0.31 -0.97 -4.39 118.33 115.57 3i1m n VAL 101 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 3i1m n VAL 101 Cb 0.19 -0.91 0.17 0.00 -0.91 0.00 0.00 33.84 32.38 3i1m n VAL 101 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 3i1m h TYR 102 N 0.00 0.86 0.00 3.52 3.20 -1.36 -0.21 116.97 122.97 3i1m h TYR 102 Ca 0.00 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 61.76 3i1m h TYR 102 Cb 0.90 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.93 3i1m h TYR 102 CO 0.00 0.77 0.00 -2.13 -1.64 0.00 0.00 178.16 175.16 3i1m n ARG 103 N -4.23 0.64 0.00 1.82 3.00 0.86 -1.76 116.66 116.98 3i1m n ARG 103 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 3i1m n ARG 103 Cb 0.28 -1.31 0.00 0.00 0.00 0.00 0.00 32.46 31.43 3i1m n ARG 103 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 3i1m n MET 104 N -0.81 3.83 -0.66 -0.14 2.81 -0.76 -4.70 117.12 116.68 3i1m n MET 104 Ca 0.09 -0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 3i1m n MET 104 Cb 0.04 -0.39 0.00 0.00 -0.71 0.00 0.00 33.22 32.16 3i1m n MET 104 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3i1m n GLY 105 N 0.56 0.71 0.00 3.03 0.00 -0.17 -4.89 105.19 104.43 3i1m n GLY 105 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3i1m n GLY 105 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i1m n PHE 106 N -2.49 0.00 -3.74 1.61 3.72 -0.73 -1.67 117.46 114.16 3i1m n PHE 106 Ca 0.00 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.27 3i1m n PHE 106 Cb 0.00 -0.10 -0.10 0.00 -0.94 0.00 0.00 39.48 38.34 3i1m n PHE 106 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3i1m s GLY 107 N -2.20 -0.30 0.00 1.37 0.00 -1.25 -4.71 107.32 100.23 3i1m s GLY 107 Ca 0.25 1.14 0.00 0.00 0.00 0.00 0.00 44.72 46.11 3i1m s GLY 107 CO 0.24 1.01 0.43 0.00 0.00 0.00 0.00 173.10 174.78 3i1m n ALA 108 N 2.97 -0.15 -1.90 3.20 0.00 -1.26 -4.59 120.51 118.77 3i1m n ALA 108 Ca -0.14 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.94 3i1m n ALA 108 Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.96 3i1m n ALA 108 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3i1m s THR 109 N -1.39 4.36 0.54 0.00 -1.32 -1.26 -4.71 115.64 111.86 3i1m s THR 109 Ca 0.00 1.59 0.35 0.00 -1.21 0.00 0.00 61.69 62.42 3i1m s THR 109 Cb 0.00 -3.92 0.53 0.00 -1.51 0.00 0.00 72.50 67.60 3i1m s THR 109 CO 0.00 0.12 1.84 -0.09 -2.21 0.00 0.00 174.62 174.28 3i1m h ARG 110 N 3.14 0.00 -0.09 7.08 2.43 -1.86 0.51 114.38 125.58 3i1m h ARG 110 Ca -0.47 -0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 58.52 3i1m h ARG 110 Cb 1.19 -0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.75 3i1m h ARG 110 CO 0.65 0.00 -0.63 0.00 -1.51 0.00 0.00 179.97 178.48 3i1m h ALA 111 N 1.47 0.20 -0.85 2.80 0.00 -1.92 -2.46 119.26 118.49 3i1m h ALA 111 Ca 0.51 -0.55 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3i1m h ALA 111 Cb 2.04 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.78 3i1m h ALA 111 CO -0.01 0.47 0.55 1.49 0.00 0.00 0.00 179.25 181.76 3i1m h GLU 112 N 0.21 1.06 -0.48 0.00 4.81 -0.56 0.85 114.58 120.48 3i1m h GLU 112 Ca -0.05 -0.06 0.10 0.00 -0.13 0.00 0.00 59.36 59.21 3i1m h GLU 112 Cb 1.28 -0.24 -0.09 0.00 0.63 0.00 0.00 28.75 30.33 3i1m h GLU 112 CO 0.13 0.70 -0.08 0.00 -0.73 0.00 0.00 179.01 179.04 3i1m h ALA 113 N 1.34 0.37 -0.28 2.92 0.00 -0.35 -2.04 119.26 121.21 3i1m h ALA 113 Ca 0.33 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.38 3i1m h ALA 113 Cb -0.04 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3i1m h ALA 113 CO -0.10 -0.43 0.03 0.00 0.00 0.00 0.00 179.25 178.76 3i1m h ARG 114 N 0.04 0.47 -0.89 0.00 3.08 -0.81 -2.86 114.38 113.41 3i1m h ARG 114 Ca 0.24 -0.13 0.23 0.00 0.07 0.00 0.00 59.98 60.38 3i1m h ARG 114 Cb 0.36 -0.05 -0.16 0.00 0.08 0.00 0.00 29.97 30.20 3i1m h ARG 114 CO -0.46 0.60 0.07 0.37 -1.07 0.00 0.00 179.97 179.47 3i1m h GLN 115 N 0.28 0.08 0.16 0.04 5.75 -0.16 0.58 115.11 121.85 3i1m h GLN 115 Ca 0.08 -0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.59 3i1m h GLN 115 Cb 0.36 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.86 3i1m h GLN 115 CO 0.01 0.06 -0.44 -0.07 -2.65 0.00 0.00 178.83 175.73 3i1m h LEU 116 N 0.09 -1.30 -0.70 -2.39 3.38 -1.25 -1.34 115.31 111.81 3i1m h LEU 116 Ca 0.53 0.13 0.14 0.00 0.09 0.00 0.00 57.88 58.77 3i1m h LEU 116 Cb 1.03 0.47 -0.10 0.00 0.09 0.00 0.00 40.66 42.16 3i1m h LEU 116 CO -0.78 -0.48 0.19 0.58 0.09 0.00 0.00 178.44 178.04 3i1m h VAL 117 N -0.67 0.59 -0.97 1.22 2.07 0.18 0.83 116.25 119.50 3i1m h VAL 117 Ca -0.01 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.42 3i1m h VAL 117 Cb 0.65 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 3i1m h VAL 117 CO -0.20 0.06 0.64 -1.28 0.02 0.00 0.00 177.57 176.80 3i1m h SER 118 N 0.31 1.10 -0.61 0.57 0.87 -0.60 -2.53 113.55 112.65 3i1m h SER 118 Ca 0.38 -0.02 -0.38 0.00 -1.23 0.00 0.00 61.79 60.54 3i1m h SER 118 Cb 0.60 -0.27 -0.16 0.00 -0.44 0.00 0.00 62.40 62.14 3i1m h SER 118 CO -0.45 0.78 0.45 1.41 -0.53 0.00 0.00 176.83 178.50 3i1m n HIS 119 N -4.40 1.69 -3.92 2.24 8.25 0.24 -4.86 115.22 114.45 3i1m n HIS 119 Ca 0.12 -2.05 -0.28 0.00 -0.26 0.00 0.00 57.72 55.25 3i1m n HIS 119 Cb 0.04 -1.07 0.01 0.00 1.12 0.00 0.00 29.99 30.09 3i1m n HIS 119 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3i1m n LYS 120 N 0.33 -0.56 -0.08 -0.41 5.02 -0.95 -4.78 118.16 116.73 3i1m n LYS 120 Ca 0.36 -0.16 0.03 0.00 -2.02 0.00 0.00 58.31 56.52 3i1m n LYS 120 Cb 0.58 -1.07 0.07 0.00 -0.02 0.00 0.00 35.03 34.59 3i1m n LYS 120 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i1m n ALA 121 N -3.35 2.17 -3.20 7.82 0.00 -0.93 -4.93 120.51 118.09 3i1m n ALA 121 Ca -0.07 -0.97 -0.13 0.00 0.00 0.00 0.00 53.44 52.27 3i1m n ALA 121 Cb 0.34 -0.23 -0.09 0.00 0.00 0.00 0.00 19.45 19.47 3i1m n ALA 121 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3i1m s ILE 122 N -0.90 0.05 0.32 0.00 -0.00 -1.26 -1.44 121.20 117.97 3i1m s ILE 122 Ca 0.11 -0.43 0.07 0.00 -0.00 0.00 0.00 60.65 60.40 3i1m s ILE 122 Cb 0.06 -0.53 -0.06 0.00 -0.00 0.00 0.00 42.46 41.93 3i1m s ILE 122 CO 0.08 -0.24 -0.04 -0.04 -0.00 0.00 0.00 174.94 174.71 3i1m s MET 123 N -1.04 1.67 0.00 0.37 -1.94 -0.88 -1.97 119.30 115.52 3i1m s MET 123 Ca -0.11 -1.88 0.00 0.00 -1.71 0.00 0.00 55.69 51.99 3i1m s MET 123 Cb -0.05 -1.27 0.00 0.00 2.01 0.00 0.00 34.83 35.52 3i1m s MET 123 CO 0.03 0.01 0.00 1.33 -0.01 0.00 0.00 175.02 176.37 3i1m n VAL 124 N -0.69 0.00 -0.55 -6.03 0.24 0.98 -1.84 118.33 110.43 3i1m n VAL 124 Ca -0.05 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.10 3i1m n VAL 124 Cb 0.64 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.99 3i1m n VAL 124 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3i1m n ASN 125 N 0.00 3.56 0.00 -1.34 3.02 -1.25 -4.36 115.26 114.89 3i1m n ASN 125 Ca 0.00 -2.19 0.00 0.00 -0.03 0.00 0.00 54.58 52.36 3i1m n ASN 125 Cb 0.00 -0.90 0.00 0.00 -0.61 0.00 0.00 39.78 38.27 3i1m n ASN 125 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3i1m n GLY 126 N 3.62 2.90 3.82 7.41 0.00 -1.26 -5.05 105.19 116.63 3i1m n GLY 126 Ca 0.32 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 45.24 3i1m n GLY 126 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i1m s ARG 127 N 0.00 4.20 0.10 1.61 3.00 -1.26 -4.92 118.95 121.68 3i1m s ARG 127 Ca 0.00 1.10 -0.30 0.00 0.00 0.00 0.00 55.73 56.53 3i1m s ARG 127 Cb 0.00 -2.18 -0.06 0.00 0.00 0.00 0.00 34.95 32.71 3i1m s ARG 127 CO 0.00 -0.05 1.04 0.54 0.00 0.00 0.00 175.30 176.83 3i1m s VAL 128 N -2.22 4.34 -0.16 3.52 0.11 -1.26 -0.02 120.40 124.72 3i1m s VAL 128 Ca 0.62 1.86 -0.00 0.00 -2.93 0.00 0.00 61.98 61.52 3i1m s VAL 128 Cb -0.09 -4.19 -0.01 0.00 -1.53 0.00 0.00 36.38 30.56 3i1m s VAL 128 CO 0.15 0.25 -0.13 -0.69 -3.33 0.00 0.00 175.10 171.34 3i1m s VAL 129 N 0.29 2.85 -0.05 2.04 1.01 -0.83 -4.87 120.40 120.84 3i1m s VAL 129 Ca 0.50 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.73 3i1m s VAL 129 Cb -0.25 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 3i1m s VAL 129 CO 0.31 0.50 -0.09 -3.20 0.00 0.00 0.00 175.10 172.62 3i1m n ASN 130 N 4.05 0.51 -2.60 3.32 2.85 -1.26 -4.62 115.26 117.51 3i1m n ASN 130 Ca -0.19 0.12 -0.37 0.00 -0.11 0.00 0.00 54.58 54.03 3i1m n ASN 130 Cb 0.52 -0.57 -0.06 0.00 1.24 0.00 0.00 39.78 40.91 3i1m n ASN 130 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 3i1m n ILE 131 N -3.00 0.00 0.64 -1.44 -6.64 -1.26 -4.09 119.36 103.57 3i1m n ILE 131 Ca -0.03 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.95 3i1m n ILE 131 Cb 0.13 -0.29 0.00 0.00 -1.44 0.00 0.00 39.64 38.04 3i1m n ILE 131 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3i1m n ALA 132 N 3.42 1.99 -0.89 -1.28 0.00 -1.26 -2.41 120.51 120.08 3i1m n ALA 132 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.69 3i1m n ALA 132 Cb -0.03 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.42 3i1m n ALA 132 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3i1m n SER 133 N 0.28 0.13 -4.35 0.00 2.88 -1.26 -3.88 113.62 107.40 3i1m n SER 133 Ca 0.00 -1.02 -0.52 0.00 -1.33 0.00 0.00 58.87 56.00 3i1m n SER 133 Cb 0.19 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.52 3i1m n SER 133 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3i1m n TYR 134 N -0.01 0.99 -1.69 0.66 9.36 -1.01 -4.43 117.16 121.03 3i1m n TYR 134 Ca 0.00 0.59 -0.42 0.00 3.32 0.00 0.00 57.90 61.39 3i1m n TYR 134 Cb 0.26 -2.34 -0.03 0.00 -0.63 0.00 0.00 39.34 36.59 3i1m n TYR 134 CO 0.00 0.00 0.00 -1.14 0.22 0.00 0.00 176.86 175.94 3i1m s GLN 135 N 7.07 3.98 -0.04 2.98 2.00 -1.26 -2.78 119.66 131.61 3i1m s GLN 135 Ca 1.24 2.48 -0.22 0.00 -2.00 0.00 0.00 55.36 56.86 3i1m s GLN 135 Cb -1.35 -4.19 -0.04 0.00 0.80 0.00 0.00 33.01 28.23 3i1m s GLN 135 CO 0.58 -1.14 0.65 0.08 -0.50 0.00 0.00 175.29 174.97 3i1m s VAL 136 N 5.07 4.97 0.45 1.34 1.01 -0.55 -4.98 120.40 127.72 3i1m s VAL 136 Ca 0.89 1.36 0.00 0.00 0.00 0.00 0.00 61.98 64.23 3i1m s VAL 136 Cb -0.40 -3.99 -0.00 0.00 0.00 0.00 0.00 36.38 31.98 3i1m s VAL 136 CO 0.40 0.33 0.67 -0.44 0.00 0.00 0.00 175.10 176.05 3i1m s SER 137 N 0.35 5.85 0.92 3.32 0.01 -1.26 -4.91 113.70 117.98 3i1m s SER 137 Ca 0.34 0.29 -0.10 0.00 1.31 0.00 0.00 55.95 57.79 3i1m s SER 137 Cb -0.18 -1.55 0.15 0.00 0.21 0.00 0.00 66.02 64.65 3i1m s SER 137 CO 0.18 -0.69 1.13 -2.16 0.41 0.00 0.00 173.24 172.11 3i1m s PRO 138 N -4.55 0.96 0.00 12.44 0.04 -1.26 -2.67 135.00 139.96 3i1m s PRO 138 Ca 0.48 1.44 0.00 0.00 0.04 0.00 0.00 61.00 62.96 3i1m s PRO 138 Cb -0.10 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.71 3i1m s PRO 138 CO 0.38 -2.63 0.00 0.09 0.04 0.00 0.00 177.00 174.87 3i1m n ASN 139 N -4.23 0.00 -4.55 6.66 4.13 0.98 -4.94 115.26 113.31 3i1m n ASN 139 Ca 0.11 0.00 -0.28 0.00 1.68 0.00 0.00 54.58 56.08 3i1m n ASN 139 Cb 0.52 -1.99 0.23 0.00 -1.54 0.00 0.00 39.78 37.00 3i1m n ASN 139 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 3i1m s ASP 140 N -2.06 1.49 -0.39 6.41 1.11 -1.09 -4.83 116.67 117.31 3i1m s ASP 140 Ca 0.00 1.46 0.03 0.00 0.18 0.00 0.00 52.55 54.22 3i1m s ASP 140 Cb 0.00 -2.20 0.16 0.00 1.07 0.00 0.00 42.92 41.95 3i1m s ASP 140 CO 0.00 -3.88 0.33 0.68 1.18 0.00 0.00 175.17 173.49 3i1m s VAL 141 N -2.60 0.08 0.02 -1.27 -7.23 -1.26 -2.50 120.40 105.65 3i1m s VAL 141 Ca 0.67 -2.02 -0.30 0.00 -1.81 0.00 0.00 61.98 58.52 3i1m s VAL 141 Cb -0.23 -1.04 -0.05 0.00 0.56 0.00 0.00 36.38 35.63 3i1m s VAL 141 CO 0.62 -0.99 1.15 0.54 -0.31 0.00 0.00 175.10 176.12 3i1m s VAL 142 N 0.61 4.27 0.16 1.32 0.11 -0.22 -3.88 120.40 122.78 3i1m s VAL 142 Ca 0.26 1.62 0.06 0.00 -2.93 0.00 0.00 61.98 61.00 3i1m s VAL 142 Cb -0.07 -4.04 -0.04 0.00 -1.53 0.00 0.00 36.38 30.69 3i1m s VAL 142 CO -0.10 0.10 -0.13 -0.94 -3.33 0.00 0.00 175.10 170.70 3i1m s SER 143 N 1.12 2.16 0.23 3.54 1.04 -0.77 -0.79 113.70 120.24 3i1m s SER 143 Ca 0.57 -0.96 -0.30 0.00 0.48 0.00 0.00 55.95 55.74 3i1m s SER 143 Cb -0.27 -0.08 -0.09 0.00 0.10 0.00 0.00 66.02 65.69 3i1m s SER 143 CO 0.27 -0.22 1.01 -0.63 0.98 0.00 0.00 173.24 174.65 3i1m s ILE 144 N -2.87 3.91 -0.42 -1.02 -1.09 -0.72 -2.06 121.20 116.92 3i1m s ILE 144 Ca 0.17 1.86 -0.39 0.00 -2.23 0.00 0.00 60.65 60.06 3i1m s ILE 144 Cb -0.01 -4.18 -0.17 0.00 -1.58 0.00 0.00 42.46 36.52 3i1m s ILE 144 CO 0.04 0.42 1.56 0.54 -1.23 0.00 0.00 174.94 176.26 3i1m n ARG 145 N 1.61 0.00 0.27 2.79 5.12 -0.52 -4.69 116.66 121.23 3i1m n ARG 145 Ca -0.01 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 56.04 3i1m n ARG 145 Cb 0.46 -1.27 0.56 0.00 -1.16 0.00 0.00 32.46 31.05 3i1m n ARG 145 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 3i1m h GLU 146 N 5.71 0.00 0.00 5.56 4.81 -1.91 -3.31 114.58 125.44 3i1m h GLU 146 Ca -0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 3i1m h GLU 146 Cb 1.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.56 3i1m h GLU 146 CO 0.87 0.00 0.00 1.63 -0.73 0.00 0.00 179.01 180.78 3i1m n LYS 147 N -2.91 0.00 -1.52 1.92 4.01 -1.26 -4.62 118.16 113.78 3i1m n LYS 147 Ca 0.01 0.00 -0.30 0.00 -0.51 0.00 0.00 58.31 57.51 3i1m n LYS 147 Cb 0.66 0.00 -0.14 0.00 -0.51 0.00 0.00 35.03 35.04 3i1m n LYS 147 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3i1m n ALA 148 N -3.00 0.63 -2.66 7.82 0.00 -1.24 -4.83 120.51 117.23 3i1m n ALA 148 Ca 0.00 -0.74 -0.20 0.00 0.00 0.00 0.00 53.44 52.51 3i1m n ALA 148 Cb 0.00 -2.65 -0.15 0.00 0.00 0.00 0.00 19.45 16.65 3i1m n ALA 148 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3i1m s LYS 149 N 8.29 0.85 -0.25 0.00 2.20 -1.25 -4.32 119.74 125.27 3i1m s LYS 149 Ca 1.21 -0.37 -0.21 0.00 -0.36 0.00 0.00 55.97 56.23 3i1m s LYS 149 Cb -0.76 -0.83 0.03 0.00 -1.51 0.00 0.00 37.83 34.77 3i1m s LYS 149 CO 0.40 0.22 0.37 0.36 -0.36 0.00 0.00 175.35 176.34 3i1m n LYS 150 N 2.84 -1.25 -4.32 4.03 2.85 -1.26 -5.03 118.16 116.02 3i1m n LYS 150 Ca -0.14 1.18 -0.24 0.00 -1.05 0.00 0.00 58.31 58.06 3i1m n LYS 150 Cb 0.56 -1.72 -0.12 0.00 -0.65 0.00 0.00 35.03 33.10 3i1m n LYS 150 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 3i1m s GLN 151 N -1.81 1.22 0.00 -1.58 1.11 -1.26 -4.88 119.66 112.46 3i1m s GLN 151 Ca 0.21 -1.27 -0.01 0.00 0.01 0.00 0.00 55.36 54.30 3i1m s GLN 151 Cb -0.02 -1.47 -0.00 0.00 -1.01 0.00 0.00 33.01 30.51 3i1m s GLN 151 CO 0.50 0.33 0.08 0.45 0.01 0.00 0.00 175.29 176.66 3i1m n SER 152 N 0.81 -0.02 -0.20 5.90 2.88 -1.26 0.50 113.62 122.24 3i1m n SER 152 Ca -0.17 0.09 0.01 0.00 -1.33 0.00 0.00 58.87 57.46 3i1m n SER 152 Cb 0.54 -0.03 0.11 0.00 -0.75 0.00 0.00 64.21 64.08 3i1m n SER 152 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 3i1m h ARG 153 N 0.00 0.23 0.19 -1.46 1.12 -2.00 -1.21 114.38 111.26 3i1m h ARG 153 Ca 0.00 -0.01 -0.34 0.00 -1.11 0.00 0.00 59.98 58.52 3i1m h ARG 153 Cb 0.01 -0.05 0.01 0.00 -0.01 0.00 0.00 29.97 29.93 3i1m h ARG 153 CO -0.02 0.16 -1.64 -0.24 -3.11 0.00 0.00 179.97 175.12 3i1m h VAL 154 N 0.24 1.07 0.04 0.20 3.04 -0.23 -2.96 116.25 117.65 3i1m h VAL 154 Ca 0.31 -2.62 0.03 0.00 -1.01 0.00 0.00 66.70 63.41 3i1m h VAL 154 Cb 0.47 2.84 -0.04 0.00 -2.01 0.00 0.00 31.29 32.55 3i1m h VAL 154 CO -0.41 0.84 -0.26 0.50 -1.01 0.00 0.00 177.57 177.23 3i1m h LYS 155 N 0.11 -0.40 -0.93 4.17 3.11 -0.22 -1.47 116.57 120.94 3i1m h LYS 155 Ca -0.30 0.03 0.17 0.00 -2.81 0.00 0.00 60.65 57.73 3i1m h LYS 155 Cb 2.10 0.09 -0.10 0.00 -1.00 0.00 0.00 32.23 33.32 3i1m h LYS 155 CO 0.20 -0.27 0.53 0.00 -2.81 0.00 0.00 179.45 177.10 3i1m h ALA 156 N 0.38 1.48 -0.38 5.00 0.00 -1.32 -0.75 119.26 123.66 3i1m h ALA 156 Ca 0.05 0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.11 3i1m h ALA 156 Cb 0.48 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 3i1m h ALA 156 CO -0.20 -0.07 0.06 0.00 0.00 0.00 0.00 179.25 179.04 3i1m h ALA 157 N 1.61 0.39 0.00 0.00 0.00 -1.11 0.35 119.26 120.50 3i1m h ALA 157 Ca 0.53 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.52 3i1m h ALA 157 Cb 0.78 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3i1m h ALA 157 CO -0.38 -0.34 0.00 -0.07 0.00 0.00 0.00 179.25 178.46 3i1m h LEU 158 N 0.18 0.00 0.00 0.00 3.38 -0.21 -2.23 115.31 116.43 3i1m h LEU 158 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3i1m h LEU 158 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3i1m h LEU 158 CO -0.25 0.00 0.00 1.21 0.09 0.00 0.00 178.44 179.49 3i1m n GLU 159 N -2.96 0.00 -0.11 1.13 2.13 0.11 -2.94 120.64 117.99 3i1m n GLU 159 Ca -0.02 0.00 0.27 0.00 0.66 0.00 0.00 57.16 58.07 3i1m n GLU 159 Cb 0.13 -0.69 0.69 0.00 0.27 0.00 0.00 31.44 31.84 3i1m n GLU 159 CO 0.00 0.00 0.00 1.37 -0.41 0.00 0.00 177.13 178.09 3i1m h LEU 160 N 0.00 0.00 -0.62 4.31 -0.00 -1.62 0.65 115.31 118.03 3i1m h LEU 160 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.88 57.98 3i1m h LEU 160 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 40.66 40.55 3i1m h LEU 160 CO 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 178.44 178.06 3i1m h ALA 161 N 1.30 -0.15 -0.88 0.17 0.00 -1.40 0.70 119.26 118.98 3i1m h ALA 161 Ca 0.38 0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.50 3i1m h ALA 161 Cb 1.84 0.88 -0.06 0.00 0.00 0.00 0.00 17.79 20.45 3i1m h ALA 161 CO -0.00 -0.74 0.55 1.49 0.00 0.00 0.00 179.25 180.55 3i1m h GLU 162 N -0.18 0.98 -1.56 0.00 4.22 -0.74 -2.82 114.58 114.48 3i1m h GLU 162 Ca 0.22 -0.06 -0.00 0.00 0.08 0.00 0.00 59.36 59.60 3i1m h GLU 162 Cb 0.56 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 3i1m h GLU 162 CO -0.71 0.65 0.00 0.94 -2.18 0.00 0.00 179.01 177.71 3i1m n GLN 163 N -4.60 1.01 -4.27 1.92 7.27 0.24 -4.77 117.38 114.18 3i1m n GLN 163 Ca 0.13 -0.01 -0.15 0.00 0.07 0.00 0.00 57.00 57.04 3i1m n GLN 163 Cb 0.18 -1.01 -0.10 0.00 2.41 0.00 0.00 30.24 31.72 3i1m n GLN 163 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 3i1m s ARG 164 N -0.02 1.28 0.25 3.69 3.52 -1.00 -4.97 118.95 121.71 3i1m s ARG 164 Ca 0.00 -1.67 0.05 0.00 -0.13 0.00 0.00 55.73 53.98 3i1m s ARG 164 Cb 0.00 -0.11 0.71 0.00 -1.56 0.00 0.00 34.95 33.99 3i1m s ARG 164 CO 0.00 -0.29 1.20 0.39 -0.81 0.00 0.00 175.30 175.79 3i1m n GLU 165 N -0.36 -0.06 -2.06 5.12 1.02 -1.26 -4.88 120.64 118.17 3i1m n GLU 165 Ca -0.01 1.12 -0.03 0.00 -0.02 0.00 0.00 57.16 58.22 3i1m n GLU 165 Cb 0.66 -1.84 -0.02 0.00 -0.02 0.00 0.00 31.44 30.21 3i1m n GLU 165 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3i1m n LYS 166 N -4.98 -2.54 0.00 3.49 0.00 -1.26 -5.04 118.16 107.83 3i1m n LYS 166 Ca 0.21 2.13 0.00 0.00 0.00 0.00 0.00 58.31 60.65 3i1m n LYS 166 Cb 0.70 -3.18 0.00 0.00 0.00 0.00 0.00 35.03 32.55 3i1m n LYS 166 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 3i1m n PRO 167 N 0.93 -0.90 0.00 1.64 -0.02 -1.26 -5.04 135.00 130.35 3i1m n PRO 167 Ca -0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.27 3i1m n PRO 167 Cb 0.33 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.81 3i1m n PRO 167 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3i1m n THR 168 N -2.64 0.00 1.91 3.45 -1.04 -1.26 -4.83 114.28 109.87 3i1m n THR 168 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.05 3i1m n THR 168 Cb 0.00 -0.11 0.21 0.00 -1.82 0.00 0.00 70.33 68.61 3i1m n THR 168 CO 0.00 0.00 0.00 -2.67 -0.64 0.00 0.00 175.07 171.76 3i1m n TRP 169 N -1.07 0.00 -3.73 -1.42 2.14 -1.26 -4.77 117.44 107.33 3i1m n TRP 169 Ca 0.00 0.00 -0.12 0.00 2.07 0.00 0.00 57.50 59.45 3i1m n TRP 169 Cb 0.07 0.00 -0.11 0.00 -0.81 0.00 0.00 31.31 30.46 3i1m n TRP 169 CO 0.00 0.00 0.00 -0.48 2.07 0.00 0.00 177.69 179.28 3i1m s LEU 170 N -1.23 0.41 -0.61 5.67 0.05 -1.26 0.17 118.68 121.87 3i1m s LEU 170 Ca 0.11 0.75 -0.18 0.00 0.05 0.00 0.00 54.13 54.86 3i1m s LEU 170 Cb 0.05 1.22 0.12 0.00 -2.05 0.00 0.00 46.19 45.53 3i1m s LEU 170 CO 0.08 -0.15 0.69 -1.61 -0.55 0.00 0.00 176.35 174.82 3i1m s GLU 171 N 0.61 3.09 0.00 1.48 2.02 -1.03 -4.90 118.70 119.97 3i1m s GLU 171 Ca -0.03 -1.48 0.00 0.00 0.02 0.00 0.00 54.97 53.47 3i1m s GLU 171 Cb -0.05 -4.31 0.00 0.00 0.10 0.00 0.00 34.13 29.87 3i1m s GLU 171 CO -0.04 -1.50 0.00 1.55 0.02 0.00 0.00 175.26 175.29 3i1m n VAL 172 N 5.39 0.00 0.00 2.63 3.14 -1.26 -2.04 118.33 126.19 3i1m n VAL 172 Ca -0.07 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.31 3i1m n VAL 172 Cb 0.43 -0.69 0.00 0.00 -1.06 0.00 0.00 33.84 32.51 3i1m n VAL 172 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 3i1m n ASP 173 N -0.57 0.00 0.00 6.55 -0.08 -1.11 -4.73 116.55 116.62 3i1m n ASP 173 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 3i1m n ASP 173 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 3i1m n ASP 173 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3i1m n ALA 174 N -3.00 0.00 0.25 -1.67 0.00 -1.26 -4.81 120.51 110.02 3i1m n ALA 174 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3i1m n ALA 174 Cb 0.00 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.17 3i1m n ALA 174 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3i1m h GLY 175 N 0.00 0.00 0.00 0.00 0.00 -1.97 -1.13 103.07 99.97 3i1m h GLY 175 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3i1m h GLY 175 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 3i1m n LYS 176 N -2.55 0.00 -4.15 4.80 4.01 -1.26 -5.01 118.16 114.01 3i1m n LYS 176 Ca -0.02 -0.04 -0.31 0.00 -0.51 0.00 0.00 58.31 57.43 3i1m n LYS 176 Cb 0.22 -0.49 -0.04 0.00 -0.51 0.00 0.00 35.03 34.21 3i1m n LYS 176 CO 0.00 0.00 0.00 -1.33 -1.11 0.00 0.00 177.40 174.96 3i1m n MET 177 N -0.01 -2.57 -4.30 1.97 2.81 -0.43 -4.65 117.12 109.94 3i1m n MET 177 Ca 0.00 0.31 -0.28 0.00 -1.81 0.00 0.00 57.70 55.92 3i1m n MET 177 Cb 0.20 -4.48 -0.10 0.00 -0.71 0.00 0.00 33.22 28.12 3i1m n MET 177 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 3i1m s GLU 178 N -6.89 1.93 -0.11 0.03 2.12 -1.26 -1.76 118.70 112.76 3i1m s GLU 178 Ca 0.26 -1.26 -0.07 0.00 0.36 0.00 0.00 54.97 54.26 3i1m s GLU 178 Cb -0.14 -2.12 0.04 0.00 0.26 0.00 0.00 34.13 32.17 3i1m s GLU 178 CO 0.93 0.45 0.27 0.20 -0.54 0.00 0.00 175.26 176.57 3i1m s GLY 179 N -2.60 -0.18 -0.44 -1.50 0.00 0.03 -2.73 107.32 99.91 3i1m s GLY 179 Ca 0.22 1.01 -0.06 0.00 0.00 0.00 0.00 44.72 45.89 3i1m s GLY 179 CO 0.13 1.17 0.28 -1.59 0.00 0.00 0.00 173.10 173.09 3i1m s THR 180 N 1.03 3.76 -0.66 0.90 2.01 -0.87 -1.05 115.64 120.76 3i1m s THR 180 Ca -0.07 -1.93 -0.26 0.00 0.31 0.00 0.00 61.69 59.74 3i1m s THR 180 Cb -0.08 -3.53 -0.11 0.00 0.01 0.00 0.00 72.50 68.79 3i1m s THR 180 CO -0.07 -0.74 2.41 0.12 -0.69 0.00 0.00 174.62 175.65 3i1m s PHE 181 N 1.24 1.11 0.08 4.92 5.36 -1.04 -2.47 117.98 127.18 3i1m s PHE 181 Ca 0.07 1.82 -0.11 0.00 -0.96 0.00 0.00 56.93 57.74 3i1m s PHE 181 Cb -0.24 -3.50 -0.22 0.00 -0.34 0.00 0.00 43.02 38.72 3i1m s PHE 181 CO -0.02 -1.98 1.19 -0.22 -1.46 0.00 0.00 175.22 172.73 3i1m h LYS 182 N 15.68 0.60 -2.69 10.12 3.64 -0.58 0.28 116.57 143.61 3i1m h LYS 182 Ca -0.10 -0.69 -0.04 0.00 -1.27 0.00 0.00 60.65 58.54 3i1m h LYS 182 Cb 1.12 0.21 -0.15 0.00 -0.41 0.00 0.00 32.23 33.00 3i1m h LYS 182 CO 1.07 1.29 0.17 -0.98 -2.27 0.00 0.00 179.45 178.73 3i1m s ARG 183 N -3.19 1.17 -0.08 1.90 1.04 -1.13 -3.94 118.95 114.73 3i1m s ARG 183 Ca -0.08 -0.23 -0.29 0.00 -1.04 0.00 0.00 55.73 54.08 3i1m s ARG 183 Cb 0.07 0.54 -0.07 0.00 -2.04 0.00 0.00 34.95 33.45 3i1m s ARG 183 CO 0.91 -0.46 2.00 0.15 -0.04 0.00 0.00 175.30 177.86 3i1m s LYS 184 N -2.82 3.78 0.51 3.89 1.02 -1.26 -4.79 119.74 120.08 3i1m s LYS 184 Ca -0.03 2.30 -0.20 0.00 0.02 0.00 0.00 55.97 58.06 3i1m s LYS 184 Cb -0.01 -4.21 -0.09 0.00 -0.52 0.00 0.00 37.83 33.01 3i1m s LYS 184 CO -0.05 -1.36 0.74 -0.35 -0.92 0.00 0.00 175.35 173.41 3i1m n PRO 185 N 7.93 0.80 -2.84 -1.68 -0.04 -1.26 -4.97 135.00 132.94 3i1m n PRO 185 Ca 0.23 0.30 -0.26 0.00 -0.04 0.00 0.00 63.50 63.72 3i1m n PRO 185 Cb 0.43 -1.85 -0.00 0.00 -0.04 0.00 0.00 33.50 32.04 3i1m n PRO 185 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3i1m s GLU 186 N -2.12 3.52 0.12 0.54 0.41 -1.26 -4.89 118.70 115.02 3i1m s GLU 186 Ca 0.68 0.05 -0.25 0.00 -0.41 0.00 0.00 54.97 55.04 3i1m s GLU 186 Cb -0.49 -2.45 -0.05 0.00 -1.78 0.00 0.00 34.13 29.35 3i1m s GLU 186 CO 0.54 -0.11 1.65 -0.09 -0.49 0.00 0.00 175.26 176.76 3i1m h ARG 187 N 0.37 -0.33 -1.07 1.61 9.65 -1.92 -2.57 114.38 120.12 3i1m h ARG 187 Ca -0.48 0.02 0.29 0.00 -1.10 0.00 0.00 59.98 58.72 3i1m h ARG 187 Cb 1.21 0.08 -0.11 0.00 -1.39 0.00 0.00 29.97 29.76 3i1m h ARG 187 CO 0.62 -0.22 0.67 0.66 2.80 0.00 0.00 179.97 184.50 3i1m h SER 188 N -0.35 0.46 -1.91 -3.80 4.64 -2.02 -1.88 113.55 108.69 3i1m h SER 188 Ca 0.06 0.11 -0.73 0.00 -0.47 0.00 0.00 61.79 60.77 3i1m h SER 188 Cb 0.43 0.04 -0.31 0.00 -0.31 0.00 0.00 62.40 62.25 3i1m h SER 188 CO -0.21 0.03 0.62 -0.90 -0.87 0.00 0.00 176.83 175.50 3i1m n ASP 189 N -4.72 6.81 0.00 4.97 5.68 -0.97 -4.89 116.55 123.44 3i1m n ASP 189 Ca 0.28 -3.80 0.00 0.00 -0.50 0.00 0.00 54.79 50.77 3i1m n ASP 189 Cb 0.95 -0.93 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 3i1m n ASP 189 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3i1m n LEU 190 N -0.49 0.00 0.00 -2.12 -0.00 -0.71 -4.71 117.00 108.97 3i1m n LEU 190 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.51 3i1m n LEU 190 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.75 3i1m n LEU 190 CO 0.47 0.00 0.00 -0.24 -0.00 0.00 0.00 177.39 177.62 3i1m n SER 191 N 0.00 0.00 0.00 1.45 2.88 -1.26 -4.83 113.62 111.86 3i1m n SER 191 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3i1m n SER 191 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 3i1m n SER 191 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3i1m n ALA 192 N 0.00 0.00 -0.99 -1.46 0.00 -1.26 -4.87 120.51 111.93 3i1m n ALA 192 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 3i1m n ALA 192 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 3i1m n ALA 192 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3i1m n ASP 193 N 0.00 6.22 -4.37 0.00 9.92 -1.26 -4.89 116.55 122.17 3i1m n ASP 193 Ca 0.00 -3.36 -0.37 0.00 -0.53 0.00 0.00 54.79 50.53 3i1m n ASP 193 Cb 0.00 -0.95 -0.13 0.00 -0.64 0.00 0.00 41.12 39.40 3i1m n ASP 193 CO 0.00 0.00 0.00 0.27 0.13 0.00 0.00 177.20 177.60 3i1m s ILE 194 N -3.26 3.96 0.00 0.53 -4.36 -1.26 -5.10 121.20 111.71 3i1m s ILE 194 Ca 0.46 -0.51 0.00 0.00 -0.26 0.00 0.00 60.65 60.35 3i1m s ILE 194 Cb 0.37 -2.94 0.00 0.00 1.25 0.00 0.00 42.46 41.13 3i1m s ILE 194 CO 0.01 0.22 0.00 0.59 0.24 0.00 0.00 174.94 176.00 3i1m n ASN 195 N 4.87 0.00 0.04 4.36 5.03 -1.26 -5.03 115.26 123.27 3i1m n ASN 195 Ca -0.16 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.29 3i1m n ASN 195 Cb 0.49 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.25 3i1m n ASN 195 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3i1m n GLU 196 N 0.00 0.00 0.00 3.52 1.02 -1.26 -4.87 120.64 119.05 3i1m n GLU 196 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3i1m n GLU 196 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3i1m n GLU 196 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 3i1m n HIS 197 N -2.59 0.00 0.00 -0.32 1.44 -1.26 0.13 115.22 112.62 3i1m n HIS 197 Ca 0.00 -0.09 0.00 0.00 -2.01 0.00 0.00 57.72 55.62 3i1m n HIS 197 Cb 0.00 -0.10 0.00 0.00 0.12 0.00 0.00 29.99 30.01 3i1m n HIS 197 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3i1m n LEU 198 N 0.37 0.00 -0.08 2.39 4.77 -1.26 -4.14 117.00 119.04 3i1m n LEU 198 Ca 0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 3i1m n LEU 198 Cb 0.19 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.15 3i1m n LEU 198 CO 0.00 0.00 -1.09 0.00 -1.33 0.00 0.00 177.39 174.97 3i1m n ILE 199 N -1.38 1.60 -0.16 -0.08 3.06 0.42 -2.28 119.36 120.54 3i1m n ILE 199 Ca 0.00 -0.51 -0.09 0.00 -2.50 0.00 0.00 62.75 59.65 3i1m n ILE 199 Cb 0.20 -1.66 0.00 0.00 0.54 0.00 0.00 39.64 38.72 3i1m n ILE 199 CO 0.00 0.00 0.00 0.58 -2.50 0.00 0.00 176.55 174.63 3i1m h VAL 200 N -0.23 1.23 -0.82 9.51 2.07 0.71 -1.98 116.25 126.75 3i1m h VAL 200 Ca -0.52 -0.77 0.15 0.00 0.82 0.00 0.00 66.70 66.39 3i1m h VAL 200 Cb 1.84 0.84 -0.06 0.00 -1.52 0.00 0.00 31.29 32.39 3i1m h VAL 200 CO -0.09 0.28 0.54 -0.08 0.02 0.00 0.00 177.57 178.23 3i1m h GLU 201 N 0.63 0.48 0.79 1.57 4.81 -1.68 -2.81 114.58 118.37 3i1m h GLU 201 Ca 0.15 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.31 3i1m h GLU 201 Cb 0.28 -0.11 0.01 0.00 0.63 0.00 0.00 28.75 29.56 3i1m h GLU 201 CO -0.00 0.32 -0.38 1.25 -0.73 0.00 0.00 179.01 179.47 3i1m h LEU 202 N 0.50 -0.90 -6.06 1.64 5.85 -0.92 -3.32 115.31 112.10 3i1m h LEU 202 Ca 0.41 0.02 -0.71 0.00 0.84 0.00 0.00 57.88 58.43 3i1m h LEU 202 Cb 0.85 0.23 -0.05 0.00 0.37 0.00 0.00 40.66 42.06 3i1m h LEU 202 CO -0.15 -0.55 3.03 -1.22 -0.34 0.00 0.00 178.44 179.21 3i1m n TYR 203 N -5.49 3.50 0.00 1.25 0.53 -1.06 -4.03 117.16 111.86 3i1m n TYR 203 Ca -0.14 -2.96 0.00 0.00 -1.02 0.00 0.00 57.90 53.78 3i1m n TYR 203 Cb 0.42 -2.51 0.00 0.00 -1.03 0.00 0.00 39.34 36.23 3i1m n TYR 203 CO 0.00 0.00 0.00 0.43 -1.02 0.00 0.00 176.86 176.27 3i1m n SER 204 N 5.93 0.00 0.00 7.72 7.64 -1.25 -4.96 113.62 128.69 3i1m n SER 204 Ca 0.51 0.00 0.08 0.00 1.01 0.00 0.00 58.87 60.47 3i1m n SER 204 Cb 0.39 0.00 0.47 0.00 -1.01 0.00 0.00 64.21 64.05 3i1m n SER 204 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32