#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i4n n GLU 21 N 0.00 0.06 -3.06 0.11 0.28 -1.26 -3.49 120.64 113.28 3i4n n GLU 21 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 57.03 3i4n n GLU 21 Cb 0.00 -1.47 -0.00 0.00 1.43 0.00 0.00 31.44 31.40 3i4n n GLU 21 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 3i4n s SER 22 N 1.57 -0.93 0.29 -1.84 0.01 -1.26 -3.93 113.70 107.61 3i4n s SER 22 Ca 0.00 -0.18 -0.05 0.00 1.31 0.00 0.00 55.95 57.04 3i4n s SER 22 Cb 0.00 1.38 -0.01 0.00 0.21 0.00 0.00 66.02 67.60 3i4n s SER 22 CO 0.00 -0.14 0.40 0.00 0.41 0.00 0.00 173.24 173.91 3i4n s ALA 23 N 2.40 0.62 1.00 1.44 0.00 -1.23 -4.92 121.76 121.08 3i4n s ALA 23 Ca 0.18 -1.40 0.00 0.00 0.00 0.00 0.00 51.96 50.73 3i4n s ALA 23 Cb -0.03 1.20 0.00 0.00 0.00 0.00 0.00 23.12 24.29 3i4n s ALA 23 CO -0.18 -0.76 0.00 -0.35 0.00 0.00 0.00 175.76 174.47 3i4n n PRO 24 N -0.46 -1.08 -3.51 0.00 -0.04 -1.26 -2.01 135.00 126.63 3i4n n PRO 24 Ca 0.01 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.18 3i4n n PRO 24 Cb 0.63 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.95 3i4n n PRO 24 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3i4n s ILE 25 N -0.71 0.07 1.01 0.52 1.01 -1.26 -2.31 121.20 119.53 3i4n s ILE 25 Ca 0.00 -1.22 -0.11 0.00 0.00 0.00 0.00 60.65 59.32 3i4n s ILE 25 Cb 0.00 -1.08 0.20 0.00 0.01 0.00 0.00 42.46 41.59 3i4n s ILE 25 CO 0.00 -0.84 1.09 0.42 0.00 0.00 0.00 174.94 175.61 3i4n s THR 26 N 1.61 2.12 0.04 2.92 -4.23 -1.26 -4.43 115.64 112.41 3i4n s THR 26 Ca 0.13 0.04 -0.15 0.00 -1.18 0.00 0.00 61.69 60.54 3i4n s THR 26 Cb -0.19 -2.12 -0.06 0.00 1.34 0.00 0.00 72.50 71.47 3i4n s THR 26 CO -0.19 -0.05 1.23 0.00 -0.54 0.00 0.00 174.62 175.06 3i4n h ALA 27 N -2.14 -0.76 -1.02 3.99 0.00 -2.00 -2.46 119.26 114.86 3i4n h ALA 27 Ca -0.51 -0.05 0.37 0.00 0.00 0.00 0.00 54.91 54.72 3i4n h ALA 27 Cb 1.29 0.62 -0.12 0.00 0.00 0.00 0.00 17.79 19.58 3i4n h ALA 27 CO 0.46 -0.81 0.63 -1.91 0.00 0.00 0.00 179.25 177.62 3i4n n GLU 28 N -3.71 -0.03 0.20 0.00 4.07 -1.26 -0.52 120.64 119.39 3i4n n GLU 28 Ca -0.04 1.04 -0.15 0.00 -0.06 0.00 0.00 57.16 57.95 3i4n n GLU 28 Cb 0.18 -1.99 -0.08 0.00 -0.06 0.00 0.00 31.44 29.49 3i4n n GLU 28 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 3i4n h ASP 29 N 0.00 -1.06 -0.90 4.31 3.32 -1.79 -3.05 116.42 117.24 3i4n h ASP 29 Ca 0.70 0.10 0.37 0.00 0.02 0.00 0.00 57.03 58.23 3i4n h ASP 29 Cb 2.15 0.37 -0.16 0.00 0.22 0.00 0.00 39.33 41.92 3i4n h ASP 29 CO -0.45 -0.50 0.50 -1.54 -1.72 0.00 0.00 179.24 175.53 3i4n n SER 30 N -5.47 0.30 -0.25 6.45 3.41 0.32 -0.49 113.62 117.89 3i4n n SER 30 Ca -0.09 1.44 0.05 0.00 -0.26 0.00 0.00 58.87 60.01 3i4n n SER 30 Cb 0.38 -0.70 0.17 0.00 -0.26 0.00 0.00 64.21 63.79 3i4n n SER 30 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 3i4n h TRP 31 N 0.00 0.12 -0.96 7.33 -0.00 -1.67 0.26 115.95 121.02 3i4n h TRP 31 Ca 0.75 0.05 0.06 0.00 -0.00 0.00 0.00 58.89 59.75 3i4n h TRP 31 Cb 2.02 0.06 -0.07 0.00 -0.00 0.00 0.00 29.16 31.17 3i4n h TRP 31 CO -0.01 -0.16 0.62 0.00 -0.00 0.00 0.00 178.44 178.89 3i4n h ALA 32 N 1.65 1.33 -0.24 1.49 0.00 -0.98 -1.29 119.26 121.22 3i4n h ALA 32 Ca 0.41 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.34 3i4n h ALA 32 Cb 0.72 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3i4n h ALA 32 CO -0.58 0.40 -0.01 0.28 0.00 0.00 0.00 179.25 179.35 3i4n h VAL 33 N 1.13 0.82 -0.70 0.00 2.07 -0.59 -0.02 116.25 118.96 3i4n h VAL 33 Ca 0.42 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.99 3i4n h VAL 33 Cb 0.16 0.75 -0.07 0.00 -1.52 0.00 0.00 31.29 30.62 3i4n h VAL 33 CO -0.17 0.01 0.37 0.40 0.02 0.00 0.00 177.57 178.20 3i4n h ILE 34 N 0.06 0.89 -0.54 4.57 2.04 -0.84 -0.40 117.51 123.30 3i4n h ILE 34 Ca 0.11 -0.22 0.11 0.00 1.00 0.00 0.00 64.86 65.86 3i4n h ILE 34 Cb 0.15 0.20 -0.10 0.00 -0.74 0.00 0.00 36.82 36.32 3i4n h ILE 34 CO -0.20 0.12 -0.13 0.28 0.00 0.00 0.00 178.15 178.23 3i4n h SER 35 N 0.64 -0.48 -0.82 1.72 0.02 0.08 0.31 113.55 115.02 3i4n h SER 35 Ca 0.33 0.16 0.14 0.00 -0.84 0.00 0.00 61.79 61.59 3i4n h SER 35 Cb 0.30 0.33 -0.09 0.00 0.14 0.00 0.00 62.40 63.08 3i4n h SER 35 CO -0.24 -0.17 0.41 0.00 -1.14 0.00 0.00 176.83 175.69 3i4n h ALA 36 N 1.54 1.22 -2.27 3.77 0.00 -0.06 -0.73 119.26 122.73 3i4n h ALA 36 Ca 0.26 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3i4n h ALA 36 Cb 0.40 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3i4n h ALA 36 CO -0.55 -0.12 0.00 0.34 0.00 0.00 0.00 179.25 178.93 3i4n n PHE 37 N -4.90 0.00 0.26 0.00 7.35 0.11 -1.72 117.46 118.56 3i4n n PHE 37 Ca 0.16 0.00 0.17 0.00 -0.76 0.00 0.00 57.45 57.03 3i4n n PHE 37 Cb 0.43 -0.12 0.84 0.00 0.35 0.00 0.00 39.48 40.97 3i4n n PHE 37 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 3i4n h PHE 38 N 0.00 0.00 -0.47 -5.13 -1.00 -1.41 0.49 116.94 109.41 3i4n h PHE 38 Ca 0.00 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.77 3i4n h PHE 38 Cb 0.00 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.54 3i4n h PHE 38 CO -0.10 0.00 0.24 0.00 -1.61 0.00 0.00 178.31 176.84 3i4n h ARG 39 N 0.00 0.67 0.00 1.51 3.08 -0.31 -3.17 114.38 116.16 3i4n h ARG 39 Ca 0.06 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3i4n h ARG 39 Cb 0.68 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.61 3i4n h ARG 39 CO -0.00 0.54 -0.20 1.49 -1.07 0.00 0.00 179.97 180.73 3i4n h GLU 40 N 0.62 0.00 0.00 0.04 4.81 0.57 -3.44 114.58 117.18 3i4n h GLU 40 Ca 0.16 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 3i4n h GLU 40 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 3i4n h GLU 40 CO -0.02 0.00 0.00 1.63 -0.73 0.00 0.00 179.01 179.89 3i4n n LYS 41 N -3.32 0.00 0.00 1.92 4.76 0.13 -5.05 118.16 116.59 3i4n n LYS 41 Ca -0.03 0.30 0.00 0.00 -2.87 0.00 0.00 58.31 55.71 3i4n n LYS 41 Cb 0.11 -1.17 0.00 0.00 -1.84 0.00 0.00 35.03 32.12 3i4n n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3i4n n GLY 42 N -0.75 2.54 0.49 0.72 0.00 -1.20 -4.31 105.19 102.68 3i4n n GLY 42 Ca 0.00 -1.54 0.28 0.00 0.00 0.00 0.00 46.02 44.77 3i4n n GLY 42 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3i4n h LEU 43 N 0.00 0.00 -0.85 0.99 3.38 -1.93 0.74 115.31 117.65 3i4n h LEU 43 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3i4n h LEU 43 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3i4n h LEU 43 CO 0.00 0.00 -0.23 1.33 0.09 0.00 0.00 178.44 179.63 3i4n n VAL 44 N -3.67 0.00 0.00 1.22 0.24 -1.26 -4.72 118.33 110.13 3i4n n VAL 44 Ca 0.19 -0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 3i4n n VAL 44 Cb 1.14 0.71 0.00 0.00 -1.47 0.00 0.00 33.84 34.23 3i4n n VAL 44 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3i4n n SER 45 N -0.14 0.00 0.00 -1.34 3.41 0.26 -1.81 113.62 114.00 3i4n n SER 45 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 3i4n n SER 45 Cb 0.40 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 3i4n n SER 45 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i4n n GLN 46 N -1.65 0.00 -0.28 4.33 10.64 -1.26 -2.36 117.38 126.80 3i4n n GLN 46 Ca 0.00 0.28 0.18 0.00 -1.83 0.00 0.00 57.00 55.63 3i4n n GLN 46 Cb 0.00 -0.77 0.34 0.00 -0.86 0.00 0.00 30.24 28.94 3i4n n GLN 46 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 3i4n n GLN 47 N -0.56 -0.06 0.00 2.61 1.13 -0.75 -2.57 117.38 117.18 3i4n n GLN 47 Ca 0.00 1.20 0.00 0.00 -1.94 0.00 0.00 57.00 56.26 3i4n n GLN 47 Cb 0.00 -1.99 0.00 0.00 0.11 0.00 0.00 30.24 28.36 3i4n n GLN 47 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3i4n n LEU 48 N -5.06 0.07 -0.16 1.08 4.77 -1.03 -3.36 117.00 113.32 3i4n n LEU 48 Ca 0.24 0.10 0.10 0.00 -0.03 0.00 0.00 56.01 56.42 3i4n n LEU 48 Cb 0.80 0.00 0.19 0.00 -2.33 0.00 0.00 43.42 42.08 3i4n n LEU 48 CO -0.03 0.00 0.42 0.47 -1.33 0.00 0.00 177.39 176.91 3i4n n ASP 49 N -0.12 0.03 0.00 -1.43 8.00 -1.00 0.27 116.55 122.30 3i4n n ASP 49 Ca 0.00 0.79 0.04 0.00 0.71 0.00 0.00 54.79 56.33 3i4n n ASP 49 Cb 0.00 -0.32 0.18 0.00 -0.02 0.00 0.00 41.12 40.96 3i4n n ASP 49 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3i4n n SER 50 N -4.34 0.00 -0.13 -2.24 2.88 -1.06 -1.61 113.62 107.12 3i4n n SER 50 Ca 0.14 0.45 -0.26 0.00 -1.33 0.00 0.00 58.87 57.86 3i4n n SER 50 Cb 0.45 -0.47 -0.09 0.00 -0.75 0.00 0.00 64.21 63.35 3i4n n SER 50 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 3i4n n PHE 51 N -1.47 0.19 -0.04 0.66 7.35 0.75 -2.71 117.46 122.20 3i4n n PHE 51 Ca 0.02 0.08 -0.10 0.00 -0.76 0.00 0.00 57.45 56.69 3i4n n PHE 51 Cb 0.09 -0.97 -0.04 0.00 0.35 0.00 0.00 39.48 38.92 3i4n n PHE 51 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 3i4n h ASN 52 N -1.00 -1.13 -1.01 -2.13 2.35 -1.48 0.53 115.58 111.72 3i4n h ASN 52 Ca -0.57 0.17 0.27 0.00 -0.55 0.00 0.00 56.30 55.62 3i4n h ASN 52 Cb 1.49 0.49 -0.07 0.00 0.05 0.00 0.00 38.32 40.28 3i4n h ASN 52 CO -0.35 -0.37 0.69 -0.61 -1.65 0.00 0.00 177.43 175.14 3i4n h GLN 53 N -0.38 0.22 -0.08 0.81 5.75 -1.52 0.17 115.11 120.09 3i4n h GLN 53 Ca 0.11 -0.01 -0.06 0.00 -0.15 0.00 0.00 58.65 58.54 3i4n h GLN 53 Cb 0.57 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.07 3i4n h GLN 53 CO -0.43 0.15 -0.17 0.35 -2.65 0.00 0.00 178.83 176.08 3i4n h PHE 54 N 0.23 0.32 0.21 3.99 3.57 -0.16 -2.99 116.94 122.12 3i4n h PHE 54 Ca 0.52 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.90 3i4n h PHE 54 Cb 1.63 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 40.32 3i4n h PHE 54 CO -0.00 0.77 -0.10 0.28 -2.23 0.00 0.00 178.31 177.03 3i4n h VAL 55 N -0.22 0.00 0.00 1.41 2.07 0.12 0.42 116.25 120.05 3i4n h VAL 55 Ca 0.00 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.40 3i4n h VAL 55 Cb 0.76 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 3i4n h VAL 55 CO 0.04 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.10 3i4n n ASP 56 N -3.11 0.00 0.00 0.57 8.00 0.38 -3.16 116.55 119.23 3i4n n ASP 56 Ca -0.04 0.50 0.00 0.00 0.71 0.00 0.00 54.79 55.97 3i4n n ASP 56 Cb 0.11 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 3i4n n ASP 56 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3i4n n TYR 57 N -1.01 0.00 -0.14 1.24 4.02 -1.23 -4.43 117.16 115.61 3i4n n TYR 57 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.91 3i4n n TYR 57 Cb 0.00 -0.16 0.05 0.00 -0.02 0.00 0.00 39.34 39.21 3i4n n TYR 57 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 3i4n n THR 58 N -0.97 -0.16 0.33 -0.72 -1.04 -1.13 0.63 114.28 111.21 3i4n n THR 58 Ca 0.00 0.86 0.21 0.00 -2.04 0.00 0.00 64.05 63.08 3i4n n THR 58 Cb 0.00 -1.18 1.13 0.00 -1.82 0.00 0.00 70.33 68.46 3i4n n THR 58 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3i4n h LEU 59 N 0.00 0.00 0.15 -4.42 5.85 -0.11 -1.57 115.31 115.21 3i4n h LEU 59 Ca 0.17 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.59 3i4n h LEU 59 Cb 0.27 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.30 3i4n h LEU 59 CO -0.38 0.00 -1.49 -0.61 -0.34 0.00 0.00 178.44 175.62 3i4n h GLN 60 N 0.00 0.32 -0.39 1.25 5.75 -0.02 -3.18 115.11 118.84 3i4n h GLN 60 Ca 0.00 -0.54 -0.05 0.00 -0.15 0.00 0.00 58.65 57.91 3i4n h GLN 60 Cb 0.02 0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.75 3i4n h GLN 60 CO -0.00 1.26 0.01 -0.44 -2.65 0.00 0.00 178.83 177.01 3i4n h ASP 61 N -0.14 0.58 1.26 -0.69 5.19 -1.35 -1.16 116.42 120.11 3i4n h ASP 61 Ca -0.30 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 3i4n h ASP 61 Cb 1.89 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 41.25 3i4n h ASP 61 CO 0.12 0.64 0.00 -0.38 -3.12 0.00 0.00 179.24 176.50 3i4n n ILE 62 N -4.26 0.38 0.04 0.35 5.41 -0.66 -2.98 119.36 117.65 3i4n n ILE 62 Ca 0.02 -0.16 0.10 0.00 1.00 0.00 0.00 62.75 63.72 3i4n n ILE 62 Cb 0.26 -0.58 -0.09 0.00 -0.71 0.00 0.00 39.64 38.52 3i4n n ILE 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4n n ILE 63 N -1.96 0.34 -3.94 1.39 0.13 -0.72 -4.79 119.36 109.80 3i4n n ILE 63 Ca 0.06 -0.54 -0.30 0.00 -1.10 0.00 0.00 62.75 60.87 3i4n n ILE 63 Cb 0.39 -0.18 -0.16 0.00 -0.84 0.00 0.00 39.64 38.85 3i4n n ILE 63 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3i4n n GLU 65 N 4.70 0.00 -0.47 0.00 0.28 -1.26 -4.67 120.64 119.22 3i4n n GLU 65 Ca -0.12 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 56.91 3i4n n GLU 65 Cb 0.45 0.00 0.04 0.00 1.43 0.00 0.00 31.44 33.36 3i4n n GLU 65 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 3i4n n ASP 66 N -2.56 0.71 0.00 -1.84 5.75 -1.26 -4.92 116.55 112.43 3i4n n ASP 66 Ca 0.00 -2.33 0.00 0.00 -0.01 0.00 0.00 54.79 52.45 3i4n n ASP 66 Cb 0.00 -0.27 0.00 0.00 -1.03 0.00 0.00 41.12 39.82 3i4n n ASP 66 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3i4n n SER 67 N -0.36 0.00 -2.63 -1.12 3.41 -1.26 -4.81 113.62 106.85 3i4n n SER 67 Ca 0.05 0.60 -0.24 0.00 -0.26 0.00 0.00 58.87 59.02 3i4n n SER 67 Cb 0.72 -0.14 0.02 0.00 -0.26 0.00 0.00 64.21 64.54 3i4n n SER 67 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3i4n n THR 68 N -0.92 0.00 -1.27 6.66 -1.04 -1.26 -4.89 114.28 111.55 3i4n n THR 68 Ca 0.00 -0.32 0.00 0.00 -2.04 0.00 0.00 64.05 61.69 3i4n n THR 68 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3i4n n THR 68 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3i4n n LEU 69 N 1.91 0.00 -2.69 -4.42 4.77 -1.26 -4.96 117.00 110.35 3i4n n LEU 69 Ca 0.02 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.76 3i4n n LEU 69 Cb 0.33 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 3i4n n LEU 69 CO 0.34 0.00 0.11 -0.38 -1.33 0.00 0.00 177.39 176.13 3i4n n ILE 70 N 0.00 2.21 0.00 -0.08 5.41 -1.26 -4.86 119.36 120.78 3i4n n ILE 70 Ca 0.00 -4.86 0.00 0.00 1.00 0.00 0.00 62.75 58.89 3i4n n ILE 70 Cb 0.00 -0.98 0.00 0.00 -0.71 0.00 0.00 39.64 37.95 3i4n n ILE 70 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 3i4n n ILE 90 N -0.30 0.00 -3.69 1.39 5.41 -1.26 -4.42 119.36 116.49 3i4n n ILE 90 Ca 0.32 0.00 -0.25 0.00 1.00 0.00 0.00 62.75 63.82 3i4n n ILE 90 Cb 0.60 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.54 3i4n n ILE 90 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3i4n s SER 91 N 0.00 4.74 -0.07 4.38 1.04 -1.25 -4.60 113.70 117.95 3i4n s SER 91 Ca 0.00 -1.15 0.02 0.00 0.48 0.00 0.00 55.95 55.30 3i4n s SER 91 Cb 0.00 0.37 0.01 0.00 0.10 0.00 0.00 66.02 66.51 3i4n s SER 91 CO 0.00 -1.15 -0.11 -0.36 0.98 0.00 0.00 173.24 172.60 3i4n s PHE 92 N -2.74 1.38 0.00 5.02 0.40 -1.26 0.58 117.98 121.36 3i4n s PHE 92 Ca 0.40 -0.51 0.00 0.00 -0.60 0.00 0.00 56.93 56.22 3i4n s PHE 92 Cb -0.03 -1.03 0.00 0.00 0.51 0.00 0.00 43.02 42.47 3i4n s PHE 92 CO 0.25 -0.28 0.00 0.41 0.70 0.00 0.00 175.22 176.30 3i4n n GLY 93 N 3.91 0.50 3.69 4.36 0.00 0.44 -4.83 105.19 113.25 3i4n n GLY 93 Ca -0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 3i4n n GLY 93 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3i4n s LYS 94 N 3.01 1.14 -0.02 1.61 2.20 -1.26 -4.73 119.74 121.68 3i4n s LYS 94 Ca 0.00 1.16 0.00 0.00 -0.36 0.00 0.00 55.97 56.77 3i4n s LYS 94 Cb 0.00 -1.77 0.03 0.00 -1.51 0.00 0.00 37.83 34.58 3i4n s LYS 94 CO 0.00 -2.42 0.02 -1.50 -0.36 0.00 0.00 175.35 171.09 3i4n s ILE 95 N -2.77 -0.02 0.13 5.43 2.07 -1.26 -1.09 121.20 123.69 3i4n s ILE 95 Ca 0.65 0.18 0.05 0.00 -1.41 0.00 0.00 60.65 60.12 3i4n s ILE 95 Cb -0.20 -0.10 -0.04 0.00 0.13 0.00 0.00 42.46 42.25 3i4n s ILE 95 CO 0.58 0.09 0.04 -0.31 -1.91 0.00 0.00 174.94 173.43 3i4n s TYR 96 N 0.96 3.00 -0.21 3.50 1.51 0.71 -4.92 117.35 121.90 3i4n s TYR 96 Ca -0.08 -0.05 -0.03 0.00 -1.01 0.00 0.00 57.07 55.90 3i4n s TYR 96 Cb -0.12 -1.49 0.07 0.00 -0.11 0.00 0.00 41.96 40.31 3i4n s TYR 96 CO -0.03 0.50 0.04 0.08 -1.11 0.00 0.00 175.55 175.04 3i4n s VAL 97 N -1.55 0.56 1.06 0.71 1.01 -1.26 0.58 120.40 121.51 3i4n s VAL 97 Ca 0.28 -0.66 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 3i4n s VAL 97 Cb -0.11 -1.11 0.22 0.00 0.00 0.00 0.00 36.38 35.39 3i4n s VAL 97 CO 0.20 -0.27 1.09 0.42 0.00 0.00 0.00 175.10 176.54 3i4n s THR 98 N 1.84 1.92 0.37 3.92 -4.23 -0.89 -4.98 115.64 113.58 3i4n s THR 98 Ca 0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.50 3i4n s THR 98 Cb -0.17 -2.45 -0.04 0.00 1.34 0.00 0.00 72.50 71.18 3i4n s THR 98 CO -0.10 0.00 0.60 -0.54 -0.54 0.00 0.00 174.62 174.04 3i4n s LYS 99 N -5.00 3.52 0.05 3.99 1.02 -1.26 -4.39 119.74 117.67 3i4n s LYS 99 Ca 0.67 -0.16 -0.08 0.00 0.02 0.00 0.00 55.97 56.42 3i4n s LYS 99 Cb -0.18 -2.59 -0.05 0.00 -0.52 0.00 0.00 37.83 34.49 3i4n s LYS 99 CO 0.58 0.08 0.16 -2.30 -0.92 0.00 0.00 175.35 172.95 3i4n n PRO 100 N -1.76 0.00 -3.93 -1.68 -0.02 -1.26 -4.67 135.00 121.69 3i4n n PRO 100 Ca -0.03 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.35 3i4n n PRO 100 Cb 0.56 -0.29 -0.10 0.00 -0.02 0.00 0.00 33.50 33.64 3i4n n PRO 100 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 3i4n s MET 101 N -0.24 0.39 -0.93 -0.52 -1.94 -1.01 -2.79 119.30 112.26 3i4n s MET 101 Ca 0.19 -0.50 -0.05 0.00 -1.71 0.00 0.00 55.69 53.61 3i4n s MET 101 Cb -0.27 0.15 0.23 0.00 2.01 0.00 0.00 34.83 36.96 3i4n s MET 101 CO 0.16 -0.08 0.84 0.08 -0.01 0.00 0.00 175.02 176.01 3i4n s VAL 102 N -1.41 4.93 -0.77 -6.03 1.01 0.65 -4.55 120.40 114.22 3i4n s VAL 102 Ca -0.15 -3.49 -0.23 0.00 0.00 0.00 0.00 61.98 58.11 3i4n s VAL 102 Cb -0.09 -4.03 0.07 0.00 0.00 0.00 0.00 36.38 32.33 3i4n s VAL 102 CO 0.00 -1.09 1.13 0.20 0.00 0.00 0.00 175.10 175.35 3i4n s ASN 103 N 0.64 6.29 0.09 3.32 -0.87 -1.26 -2.96 114.94 120.20 3i4n s ASN 103 Ca 0.26 -1.11 0.04 0.00 -1.57 0.00 0.00 52.86 50.48 3i4n s ASN 103 Cb -0.10 -2.47 -0.03 0.00 -0.02 0.00 0.00 41.25 38.63 3i4n s ASN 103 CO -0.10 -1.48 -0.11 -1.83 -2.57 0.00 0.00 177.10 171.01 3i4n s GLU 104 N 4.34 0.83 0.96 -0.60 -1.05 -1.26 -4.96 118.70 116.96 3i4n s GLU 104 Ca 0.30 -1.07 -0.12 0.00 -0.15 0.00 0.00 54.97 53.93 3i4n s GLU 104 Cb -0.10 -0.63 0.17 0.00 -0.44 0.00 0.00 34.13 33.12 3i4n s GLU 104 CO 0.05 0.12 1.12 -1.54 0.95 0.00 0.00 175.26 175.96 3i4n s SER 105 N -2.16 3.04 -1.51 0.83 1.04 -1.22 -3.45 113.70 110.27 3i4n s SER 105 Ca 0.02 1.03 -0.01 0.00 0.48 0.00 0.00 55.95 57.48 3i4n s SER 105 Cb -0.06 -1.64 0.00 0.00 0.10 0.00 0.00 66.02 64.43 3i4n s SER 105 CO 0.01 -2.85 0.05 0.47 0.98 0.00 0.00 173.24 171.90 3i4n n ASP 106 N -3.97 -5.19 -3.65 7.02 8.00 -1.26 -4.90 116.55 112.59 3i4n n ASP 106 Ca 0.06 0.03 -0.03 0.00 0.71 0.00 0.00 54.79 55.56 3i4n n ASP 106 Cb 0.58 -4.34 -0.06 0.00 -0.02 0.00 0.00 41.12 37.28 3i4n n ASP 106 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3i4n s GLY 107 N -2.11 0.31 0.00 0.44 0.00 -1.22 -5.12 107.32 99.62 3i4n s GLY 107 Ca 0.03 3.41 0.00 0.00 0.00 0.00 0.00 44.72 48.16 3i4n s GLY 107 CO 0.04 1.79 0.00 -0.62 0.00 0.00 0.00 173.10 174.31 3i4n n VAL 108 N 1.39 0.00 -3.48 1.40 0.31 -1.26 -4.45 118.33 112.23 3i4n n VAL 108 Ca -0.08 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.25 3i4n n VAL 108 Cb 0.57 -0.78 -0.03 0.00 -0.91 0.00 0.00 33.84 32.69 3i4n n VAL 108 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3i4n s THR 109 N 0.00 -0.86 0.07 2.52 2.01 -1.26 -4.34 115.64 113.78 3i4n s THR 109 Ca 0.00 0.00 -0.10 0.00 0.31 0.00 0.00 61.69 61.90 3i4n s THR 109 Cb 0.00 -1.00 -0.06 0.00 0.01 0.00 0.00 72.50 71.45 3i4n s THR 109 CO 0.00 0.00 0.39 -2.28 -0.69 0.00 0.00 174.62 172.04 3i4n s HIS 110 N 2.80 3.59 -0.54 4.92 5.04 -1.15 -4.76 115.29 125.18 3i4n s HIS 110 Ca -0.00 0.78 -0.28 0.00 -1.54 0.00 0.00 55.06 54.02 3i4n s HIS 110 Cb -0.11 -2.15 -0.00 0.00 0.04 0.00 0.00 32.58 30.36 3i4n s HIS 110 CO -0.19 0.54 1.60 0.00 -2.34 0.00 0.00 174.74 174.35 3i4n s ALA 111 N -1.37 2.65 0.66 1.58 0.00 -1.26 0.24 121.76 124.25 3i4n s ALA 111 Ca 0.32 -0.52 -0.15 0.00 0.00 0.00 0.00 51.96 51.61 3i4n s ALA 111 Cb -0.14 -4.14 -0.00 0.00 0.00 0.00 0.00 23.12 18.84 3i4n s ALA 111 CO 0.18 -3.15 1.12 -1.17 0.00 0.00 0.00 175.76 172.74 3i4n s LEU 112 N 7.01 3.40 0.16 0.00 2.96 -1.12 -4.88 118.68 126.22 3i4n s LEU 112 Ca 0.61 2.03 0.05 0.00 -0.22 0.00 0.00 54.13 56.60 3i4n s LEU 112 Cb -0.13 -4.55 -0.04 0.00 0.50 0.00 0.00 46.19 41.96 3i4n s LEU 112 CO 0.25 -1.65 -0.11 -0.31 -1.32 0.00 0.00 176.35 173.20 3i4n s TYR 113 N -2.29 1.39 0.03 5.38 1.51 -1.26 -4.68 117.35 117.43 3i4n s TYR 113 Ca 0.68 -0.71 -0.13 0.00 -1.01 0.00 0.00 57.07 55.90 3i4n s TYR 113 Cb -0.21 -0.68 -0.07 0.00 -0.11 0.00 0.00 41.96 40.89 3i4n s TYR 113 CO 0.41 0.16 1.21 -1.00 -1.11 0.00 0.00 175.55 175.22 3i4n h PRO 114 N 2.72 -0.40 -1.30 -1.71 0.13 -1.98 -2.47 132.00 127.00 3i4n h PRO 114 Ca -0.37 0.03 0.38 0.00 -0.87 0.00 0.00 66.00 65.16 3i4n h PRO 114 Cb 1.20 0.09 -0.05 0.00 0.13 0.00 0.00 31.00 32.37 3i4n h PRO 114 CO 0.63 -0.26 1.28 0.37 -0.23 0.00 0.00 178.00 179.79 3i4n h GLN 115 N -0.41 0.00 0.00 0.86 5.75 -1.99 -2.04 115.11 117.29 3i4n h GLN 115 Ca -0.03 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 3i4n h GLN 115 Cb 0.34 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.89 3i4n h GLN 115 CO 0.01 0.00 -0.08 1.49 -2.65 0.00 0.00 178.83 177.60 3i4n h GLU 116 N 0.00 0.00 0.00 1.69 4.81 -1.80 -3.23 114.58 116.04 3i4n h GLU 116 Ca 0.62 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.85 3i4n h GLU 116 Cb 3.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 32.56 3i4n h GLU 116 CO -0.01 0.00 0.24 0.00 -0.73 0.00 0.00 179.01 178.51 3i4n n ALA 117 N -2.71 0.67 -0.05 2.92 0.00 -0.84 0.35 120.51 120.85 3i4n n ALA 117 Ca -0.01 0.10 -0.14 0.00 0.00 0.00 0.00 53.44 53.39 3i4n n ALA 117 Cb 0.04 -0.81 -0.12 0.00 0.00 0.00 0.00 19.45 18.56 3i4n n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n h ARG 118 N 0.00 0.04 0.17 0.00 2.47 -1.48 -0.58 114.38 114.99 3i4n h ARG 118 Ca 0.00 -0.05 -0.25 0.00 -1.26 0.00 0.00 59.98 58.42 3i4n h ARG 118 Cb 0.48 0.01 0.02 0.00 -1.65 0.00 0.00 29.97 28.84 3i4n h ARG 118 CO 0.00 0.87 -1.16 -0.07 0.56 0.00 0.00 179.97 180.18 3i4n h LEU 119 N -0.77 0.55 0.00 3.04 3.38 -0.72 -3.30 115.31 117.49 3i4n h LEU 119 Ca -0.01 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.04 3i4n h LEU 119 Cb 0.90 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3i4n h LEU 119 CO 0.01 1.54 0.00 0.54 0.09 0.00 0.00 178.44 180.63 3i4n n ARG 120 N -3.96 0.88 -4.00 1.13 1.74 0.15 -4.92 116.66 107.69 3i4n n ARG 120 Ca -0.18 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.47 3i4n n ARG 120 Cb 0.92 -1.18 0.02 0.00 -1.02 0.00 0.00 32.46 31.21 3i4n n ARG 120 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3i4n n ASN 121 N -0.68 -4.37 0.00 0.55 5.03 -0.78 -4.87 115.26 110.13 3i4n n ASN 121 Ca 0.07 -1.23 0.00 0.00 0.87 0.00 0.00 54.58 54.29 3i4n n ASN 121 Cb 0.03 -1.87 0.00 0.00 -1.02 0.00 0.00 39.78 36.92 3i4n n ASN 121 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3i4n n LEU 122 N -4.72 0.00 -3.07 3.41 4.77 -0.29 -3.68 117.00 113.41 3i4n n LEU 122 Ca -0.13 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.68 3i4n n LEU 122 Cb 0.58 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.63 3i4n n LEU 122 CO 0.73 0.00 -0.12 0.41 -1.33 0.00 0.00 177.39 177.07 3i4n n THR 123 N 0.00 -0.57 -0.47 -5.08 -1.04 -1.26 0.16 114.28 106.01 3i4n n THR 123 Ca 0.00 -2.75 0.00 0.00 -2.04 0.00 0.00 64.05 59.26 3i4n n THR 123 Cb 0.00 -0.59 0.00 0.00 -1.82 0.00 0.00 70.33 67.92 3i4n n THR 123 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i4n n TYR 124 N 2.15 0.00 -4.43 -1.42 9.36 -0.86 -4.78 117.16 117.18 3i4n n TYR 124 Ca 0.20 0.00 -0.21 0.00 3.32 0.00 0.00 57.90 61.21 3i4n n TYR 124 Cb 0.54 -0.19 -0.10 0.00 -0.63 0.00 0.00 39.34 38.96 3i4n n TYR 124 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3i4n s SER 125 N 1.28 2.17 0.20 2.98 1.04 -1.26 -2.71 113.70 117.40 3i4n s SER 125 Ca 0.00 -1.43 0.01 0.00 0.48 0.00 0.00 55.95 55.01 3i4n s SER 125 Cb 0.00 0.07 -0.05 0.00 0.10 0.00 0.00 66.02 66.14 3i4n s SER 125 CO 0.00 -0.69 0.06 -0.94 0.98 0.00 0.00 173.24 172.65 3i4n s SER 126 N -3.47 0.89 0.72 7.02 1.04 -1.09 -2.40 113.70 116.41 3i4n s SER 126 Ca 0.35 -1.28 -0.11 0.00 0.48 0.00 0.00 55.95 55.39 3i4n s SER 126 Cb 0.08 0.20 0.02 0.00 0.10 0.00 0.00 66.02 66.42 3i4n s SER 126 CO 0.15 -0.69 1.07 -0.83 0.98 0.00 0.00 173.24 173.92 3i4n s GLY 127 N -3.19 1.65 -0.20 7.32 0.00 -1.26 0.44 107.32 112.07 3i4n s GLY 127 Ca 0.31 -0.11 -0.00 0.00 0.00 0.00 0.00 44.72 44.91 3i4n s GLY 127 CO 0.08 0.24 -0.03 1.08 0.00 0.00 0.00 173.10 174.47 3i4n s LEU 128 N -5.53 1.95 -0.08 0.66 1.02 -0.63 -2.10 118.68 113.97 3i4n s LEU 128 Ca 0.58 -0.93 -0.03 0.00 0.02 0.00 0.00 54.13 53.78 3i4n s LEU 128 Cb -0.13 -0.97 -0.04 0.00 0.02 0.00 0.00 46.19 45.08 3i4n s LEU 128 CO 0.54 -0.23 0.04 -0.36 0.02 0.00 0.00 176.35 176.35 3i4n s PHE 129 N 1.57 3.26 -0.11 0.29 2.99 0.20 0.26 117.98 126.44 3i4n s PHE 129 Ca -0.03 0.26 -0.03 0.00 0.00 0.00 0.00 56.93 57.14 3i4n s PHE 129 Cb -0.17 -1.81 0.04 0.00 0.00 0.00 0.00 43.02 41.08 3i4n s PHE 129 CO -0.07 0.53 0.05 0.08 -0.00 0.00 0.00 175.22 175.81 3i4n s VAL 130 N -0.95 0.15 -0.60 -0.44 1.01 0.26 0.25 120.40 120.09 3i4n s VAL 130 Ca 0.15 0.03 -0.26 0.00 0.00 0.00 0.00 61.98 61.90 3i4n s VAL 130 Cb -0.12 -0.51 -0.10 0.00 0.00 0.00 0.00 36.38 35.65 3i4n s VAL 130 CO 0.04 0.03 2.45 0.47 0.00 0.00 0.00 175.10 178.09 3i4n n ASP 131 N 5.21 1.93 -4.79 3.32 8.00 -0.25 -2.41 116.55 127.56 3i4n n ASP 131 Ca -0.06 -0.55 -0.36 0.00 0.71 0.00 0.00 54.79 54.54 3i4n n ASP 131 Cb 0.49 -1.49 -0.06 0.00 -0.02 0.00 0.00 41.12 40.04 3i4n n ASP 131 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3i4n s VAL 132 N 11.95 4.15 -0.02 2.53 1.01 -1.26 -0.42 120.40 138.33 3i4n s VAL 132 Ca 1.03 1.61 -0.10 0.00 0.00 0.00 0.00 61.98 64.51 3i4n s VAL 132 Cb -0.32 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 3i4n s VAL 132 CO 0.27 -0.03 0.30 -0.75 0.00 0.00 0.00 175.10 174.90 3i4n s LYS 133 N -2.50 3.69 0.00 2.72 2.47 0.20 -3.61 119.74 122.70 3i4n s LYS 133 Ca 0.56 0.12 0.00 0.00 -1.56 0.00 0.00 55.97 55.08 3i4n s LYS 133 Cb -0.17 -3.15 0.00 0.00 -1.46 0.00 0.00 37.83 33.06 3i4n s LYS 133 CO 0.21 0.69 0.00 1.63 0.16 0.00 0.00 175.35 178.04 3i4n n LYS 134 N 1.57 0.00 -2.06 4.03 5.02 -1.26 -3.81 118.16 121.65 3i4n n LYS 134 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 3i4n n LYS 134 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.54 3i4n n LYS 134 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3i4n n ARG 135 N 0.00 -5.69 -3.40 1.97 5.12 -1.26 -4.58 116.66 108.81 3i4n n ARG 135 Ca 0.00 4.05 -0.44 0.00 -1.93 0.00 0.00 57.85 59.53 3i4n n ARG 135 Cb 0.00 -4.40 -0.07 0.00 -1.16 0.00 0.00 32.46 26.83 3i4n n ARG 135 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3i4n s THR 136 N -1.14 4.92 -0.20 0.55 2.01 -1.26 -4.69 115.64 115.84 3i4n s THR 136 Ca 0.00 -1.47 -0.10 0.00 0.31 0.00 0.00 61.69 60.44 3i4n s THR 136 Cb 0.00 -4.12 -0.05 0.00 0.01 0.00 0.00 72.50 68.35 3i4n s THR 136 CO 0.00 -0.76 0.12 -0.31 -0.69 0.00 0.00 174.62 172.97 3i4n s TYR 137 N 1.54 3.38 0.00 4.92 1.51 -1.26 -5.17 117.35 122.27 3i4n s TYR 137 Ca 0.04 0.28 0.00 0.00 -1.01 0.00 0.00 57.07 56.38 3i4n s TYR 137 Cb -0.28 -2.15 0.00 0.00 -0.11 0.00 0.00 41.96 39.43 3i4n s TYR 137 CO 0.03 0.26 1.74 0.39 -1.11 0.00 0.00 175.55 176.86 3i4n n GLU 138 N 3.53 1.00 -0.14 -0.62 1.02 -1.26 -5.05 120.64 119.12 3i4n n GLU 138 Ca -0.16 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 3i4n n GLU 138 Cb 0.52 -1.00 0.00 0.00 -0.02 0.00 0.00 31.44 30.94 3i4n n GLU 138 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3i4n n LYS 164 N 1.24 0.00 -4.20 3.49 0.00 -1.24 -5.12 118.16 112.34 3i4n n LYS 164 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 58.06 3i4n n LYS 164 Cb 0.50 -0.27 -0.07 0.00 -0.00 0.00 0.00 35.03 35.20 3i4n n LYS 164 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3i4n s VAL 165 N 0.29 3.86 -0.09 0.58 1.01 -1.01 -4.89 120.40 120.15 3i4n s VAL 165 Ca 0.00 -1.50 -0.09 0.00 0.00 0.00 0.00 61.98 60.38 3i4n s VAL 165 Cb 0.00 -3.00 -0.05 0.00 0.00 0.00 0.00 36.38 33.33 3i4n s VAL 165 CO 0.00 -0.22 0.22 0.12 0.00 0.00 0.00 175.10 175.22 3i4n s PHE 166 N -1.95 3.62 -0.29 5.22 5.36 -1.26 0.93 117.98 129.60 3i4n s PHE 166 Ca 0.30 0.65 -0.03 0.00 -0.96 0.00 0.00 56.93 56.88 3i4n s PHE 166 Cb -0.08 -2.06 0.10 0.00 -0.34 0.00 0.00 43.02 40.64 3i4n s PHE 166 CO 0.20 0.68 0.13 0.42 -1.46 0.00 0.00 175.22 175.19 3i4n s ILE 167 N -0.93 0.08 0.35 3.12 1.09 0.73 -4.78 121.20 120.87 3i4n s ILE 167 Ca 0.17 -0.88 0.00 0.00 -1.10 0.00 0.00 60.65 58.84 3i4n s ILE 167 Cb -0.13 -1.09 0.00 0.00 -1.06 0.00 0.00 42.46 40.18 3i4n s ILE 167 CO 0.06 -0.73 0.00 0.61 -0.10 0.00 0.00 174.94 174.78 3i4n n GLY 168 N 5.16 -2.09 3.22 6.18 0.00 -1.20 -3.97 105.19 112.48 3i4n n GLY 168 Ca -0.05 -1.17 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 3i4n n GLY 168 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i4n s ARG 169 N -2.46 2.78 -0.43 1.61 0.52 -1.26 -1.60 118.95 118.11 3i4n s ARG 169 Ca 0.00 -0.84 -0.16 0.00 -0.52 0.00 0.00 55.73 54.21 3i4n s ARG 169 Cb 0.00 -2.17 0.03 0.00 0.52 0.00 0.00 34.95 33.33 3i4n s ARG 169 CO 0.00 0.23 0.36 -1.17 0.02 0.00 0.00 175.30 174.74 3i4n s LEU 170 N 0.22 5.15 -0.89 2.53 2.96 0.17 -4.37 118.68 124.44 3i4n s LEU 170 Ca -0.14 -0.93 -0.23 0.00 -0.22 0.00 0.00 54.13 52.61 3i4n s LEU 170 Cb -0.16 -2.23 -0.19 0.00 0.50 0.00 0.00 46.19 44.11 3i4n s LEU 170 CO 0.07 -0.53 2.12 -0.81 -1.32 0.00 0.00 176.35 175.88 3i4n n PRO 171 N 5.31 0.23 -1.11 0.98 -0.04 -1.26 -2.69 135.00 136.42 3i4n n PRO 171 Ca -0.10 -1.18 -0.35 0.00 -0.04 0.00 0.00 63.50 61.82 3i4n n PRO 171 Cb 0.46 -3.46 0.08 0.00 -0.04 0.00 0.00 33.50 30.55 3i4n n PRO 171 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 3i4n n ILE 172 N 8.43 1.19 -3.00 0.52 5.41 -1.10 -4.93 119.36 125.88 3i4n n ILE 172 Ca 0.41 -0.34 -0.28 0.00 1.00 0.00 0.00 62.75 63.54 3i4n n ILE 172 Cb 0.44 -0.69 -0.02 0.00 -0.71 0.00 0.00 39.64 38.66 3i4n n ILE 172 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 176.55 176.23 3i4n s MET 173 N -3.01 3.63 0.18 0.38 -2.45 -1.26 -4.62 119.30 112.15 3i4n s MET 173 Ca 0.62 0.16 -0.13 0.00 -1.25 0.00 0.00 55.69 55.09 3i4n s MET 173 Cb -0.30 -2.50 -0.07 0.00 1.25 0.00 0.00 34.83 33.21 3i4n s MET 173 CO 0.61 0.01 0.56 -0.51 1.05 0.00 0.00 175.02 176.75 3i4n s LEU 174 N -4.06 4.27 0.00 4.11 1.02 -0.60 -4.00 118.68 119.42 3i4n s LEU 174 Ca 0.47 1.05 0.00 0.00 0.02 0.00 0.00 54.13 55.66 3i4n s LEU 174 Cb -0.10 -3.44 0.00 0.00 0.02 0.00 0.00 46.19 42.67 3i4n s LEU 174 CO 0.35 0.03 0.00 -1.14 0.02 0.00 0.00 176.35 175.62 3i4n n ARG 175 N 0.47 -0.73 -2.30 1.70 3.00 -1.26 -1.91 116.66 115.63 3i4n n ARG 175 Ca -0.03 0.18 -0.26 0.00 -0.00 0.00 0.00 57.85 57.74 3i4n n ARG 175 Cb 0.52 -4.03 0.13 0.00 0.00 0.00 0.00 32.46 29.09 3i4n n ARG 175 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 3i4n s SER 176 N -2.16 3.91 0.21 6.15 1.04 -1.26 -4.60 113.70 117.00 3i4n s SER 176 Ca 0.00 -0.05 -0.09 0.00 0.48 0.00 0.00 55.95 56.29 3i4n s SER 176 Cb 0.00 -0.23 0.27 0.00 0.10 0.00 0.00 66.02 66.17 3i4n s SER 176 CO 0.00 -2.18 1.75 0.11 0.98 0.00 0.00 173.24 173.91 3i4n h LYS 177 N -0.96 0.42 -0.50 4.02 1.57 -1.94 -1.50 116.57 117.69 3i4n h LYS 177 Ca -0.40 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 3i4n h LYS 177 Cb 1.26 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.47 3i4n h LYS 177 CO 0.41 0.28 0.00 -1.71 -0.57 0.00 0.00 179.45 177.86 3i4n n ASN 178 N -4.97 0.50 -4.65 0.86 5.15 -1.26 -4.76 115.26 106.12 3i4n n ASN 178 Ca 0.09 -1.90 -0.35 0.00 -0.60 0.00 0.00 54.58 51.82 3i4n n ASN 178 Cb 0.26 -0.25 -0.10 0.00 -0.53 0.00 0.00 39.78 39.17 3i4n n ASN 178 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3i4n h TYR 180 N 5.74 0.09 0.00 0.00 -1.99 -1.86 -0.83 116.97 118.13 3i4n h TYR 180 Ca -0.45 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.23 3i4n h TYR 180 Cb 1.19 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 39.88 3i4n h TYR 180 CO 0.61 0.04 -0.28 -0.07 -0.00 0.00 0.00 178.16 178.45 3i4n h LEU 181 N 0.08 0.00 -0.89 3.88 3.38 -1.92 -2.89 115.31 116.95 3i4n h LEU 181 Ca 0.23 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.39 3i4n h LEU 181 Cb 0.81 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.44 3i4n h LEU 181 CO -0.02 0.28 0.44 0.77 0.09 0.00 0.00 178.44 180.00 3i4n h SER 182 N 0.00 0.46 0.00 -0.43 4.64 -1.31 -2.90 113.55 114.02 3i4n h SER 182 Ca -0.00 0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.41 3i4n h SER 182 Cb 0.57 0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3i4n h SER 182 CO 0.04 0.11 -0.39 -0.33 -0.87 0.00 0.00 176.83 175.39 3i4n h GLU 183 N 0.52 0.00 -4.46 4.77 5.08 -1.71 -3.48 114.58 115.30 3i4n h GLU 183 Ca 0.53 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 58.43 3i4n h GLU 183 Cb 0.91 0.00 0.12 0.00 0.50 0.00 0.00 28.75 30.28 3i4n h GLU 183 CO -0.45 0.24 -0.74 0.00 -1.00 0.00 0.00 179.01 177.06 3i4n n ALA 184 N -3.21 -2.60 -2.31 3.43 0.00 -1.09 -5.01 120.51 109.72 3i4n n ALA 184 Ca -0.08 0.06 -0.10 0.00 0.00 0.00 0.00 53.44 53.31 3i4n n ALA 184 Cb 0.26 -1.08 -0.09 0.00 0.00 0.00 0.00 19.45 18.53 3i4n n ALA 184 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3i4n s THR 185 N -1.31 0.06 0.00 0.00 -4.23 -1.26 -4.89 115.64 104.01 3i4n s THR 185 Ca 0.44 -1.82 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 3i4n s THR 185 Cb -0.45 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.25 3i4n s THR 185 CO 0.47 -0.29 0.00 1.21 -0.54 0.00 0.00 174.62 175.48 3i4n n GLU 186 N -0.18 0.00 -0.15 3.99 4.07 -1.26 0.28 120.64 127.39 3i4n n GLU 186 Ca -0.04 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.03 3i4n n GLU 186 Cb 0.64 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.98 3i4n n GLU 186 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 3i4n n SER 187 N 0.00 -0.38 -0.24 4.31 3.41 -1.26 -2.30 113.62 117.16 3i4n n SER 187 Ca 0.00 1.24 -0.06 0.00 -0.26 0.00 0.00 58.87 59.79 3i4n n SER 187 Cb 0.00 -0.38 -0.06 0.00 -0.26 0.00 0.00 64.21 63.51 3i4n n SER 187 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3i4n n ASP 188 N -3.80 -0.61 0.04 4.04 8.00 0.14 -1.53 116.55 122.83 3i4n n ASP 188 Ca 0.01 1.20 -0.06 0.00 0.71 0.00 0.00 54.79 56.65 3i4n n ASP 188 Cb 0.09 -0.22 -0.03 0.00 -0.02 0.00 0.00 41.12 40.94 3i4n n ASP 188 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3i4n h LEU 189 N 0.00 -0.55 -1.97 0.64 3.38 -1.41 0.43 115.31 115.83 3i4n h LEU 189 Ca 0.09 0.06 0.52 0.00 0.09 0.00 0.00 57.88 58.64 3i4n h LEU 189 Cb 0.23 0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.11 3i4n h LEU 189 CO -0.54 -0.19 1.27 1.88 0.09 0.00 0.00 178.44 180.95 3i4n h TYR 190 N -0.26 0.03 0.00 1.13 -1.99 -1.04 1.45 116.97 116.29 3i4n h TYR 190 Ca -0.00 0.00 -0.25 0.00 2.00 0.00 0.00 58.73 60.48 3i4n h TYR 190 Cb 0.26 -0.01 -0.04 0.00 2.00 0.00 0.00 36.73 38.94 3i4n h TYR 190 CO -0.35 -0.01 -1.36 0.87 -0.00 0.00 0.00 178.16 177.31 3i4n h LYS 191 N 0.00 0.00 -0.01 4.88 1.57 -0.38 -3.16 116.57 119.48 3i4n h LYS 191 Ca 0.85 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.63 3i4n h LYS 191 Cb 3.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 35.71 3i4n h LYS 191 CO -0.03 0.72 0.00 1.28 -0.57 0.00 0.00 179.45 180.85 3i4n n LEU 192 N -3.19 0.19 0.00 2.94 4.77 0.48 -4.87 117.00 117.33 3i4n n LEU 192 Ca -0.09 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 3i4n n LEU 192 Cb 0.99 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.08 3i4n n LEU 192 CO 0.46 0.04 0.00 0.29 -1.33 0.00 0.00 177.39 176.84 3i4n n LYS 193 N -0.74 0.00 -1.37 3.23 5.02 -0.19 -4.65 118.16 119.46 3i4n n LYS 193 Ca 0.18 0.00 -0.54 0.00 -2.02 0.00 0.00 58.31 55.93 3i4n n LYS 193 Cb 0.11 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.05 3i4n n LYS 193 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3i4n n GLU 194 N 0.00 0.00 -2.11 1.97 -0.58 -1.21 -4.72 120.64 113.99 3i4n n GLU 194 Ca 0.00 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.32 3i4n n GLU 194 Cb 0.00 -1.28 -0.03 0.00 -0.57 0.00 0.00 31.44 29.56 3i4n n GLU 194 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3i4n h PRO 196 N 6.76 0.08 0.00 0.00 0.13 -1.92 -2.12 132.00 134.93 3i4n h PRO 196 Ca -0.42 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3i4n h PRO 196 Cb 1.21 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3i4n h PRO 196 CO 0.87 0.05 0.00 1.19 -0.23 0.00 0.00 178.00 179.89 3i4n n PHE 197 N -5.11 0.00 -2.30 1.56 3.01 -1.26 -4.68 117.46 108.69 3i4n n PHE 197 Ca -0.03 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.01 3i4n n PHE 197 Cb 0.09 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.53 3i4n n PHE 197 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3i4n s ASP 198 N -2.01 6.94 0.00 4.37 2.15 -0.80 -4.89 116.67 122.43 3i4n s ASP 198 Ca 0.08 2.11 0.25 0.00 0.43 0.00 0.00 52.55 55.41 3i4n s ASP 198 Cb 0.04 -2.57 0.52 0.00 -0.30 0.00 0.00 42.92 40.60 3i4n s ASP 198 CO 0.06 -0.61 1.42 1.15 -0.17 0.00 0.00 175.17 177.02 3i4n n MET 199 N 4.53 0.51 0.00 4.34 0.00 -1.26 -5.05 117.12 120.18 3i4n n MET 199 Ca 0.11 -0.32 0.00 0.00 0.00 0.00 0.00 57.70 57.49 3i4n n MET 199 Cb 0.44 -1.49 0.00 0.00 0.00 0.00 0.00 33.22 32.17 3i4n n MET 199 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3i4n n GLY 200 N 1.42 0.78 0.00 3.17 0.00 -1.26 -4.84 105.19 104.46 3i4n n GLY 200 Ca 0.09 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.27 3i4n n GLY 200 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4n n GLY 201 N 0.00 1.03 3.45 -0.02 0.00 -0.80 -4.94 105.19 103.91 3i4n n GLY 201 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3i4n n GLY 201 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3i4n s TYR 202 N -2.00 1.79 0.18 1.61 -0.85 -1.26 -4.86 117.35 111.96 3i4n s TYR 202 Ca 0.00 -1.18 0.09 0.00 -0.52 0.00 0.00 57.07 55.45 3i4n s TYR 202 Cb 0.00 -1.14 -0.04 0.00 0.38 0.00 0.00 41.96 41.16 3i4n s TYR 202 CO 0.00 -0.23 -0.09 -0.06 -1.52 0.00 0.00 175.55 173.64 3i4n s PHE 203 N -3.34 2.64 -0.49 -3.49 0.40 -0.43 -1.56 117.98 111.71 3i4n s PHE 203 Ca 0.30 -0.22 0.01 0.00 -0.60 0.00 0.00 56.93 56.42 3i4n s PHE 203 Cb 0.05 -1.29 0.13 0.00 0.51 0.00 0.00 43.02 42.42 3i4n s PHE 203 CO 0.15 0.51 0.26 0.42 0.70 0.00 0.00 175.22 177.26 3i4n s ILE 204 N -1.71 3.00 -0.14 0.64 1.01 -1.26 0.11 121.20 122.84 3i4n s ILE 204 Ca 0.25 -2.76 -0.03 0.00 0.00 0.00 0.00 60.65 58.10 3i4n s ILE 204 Cb -0.09 -3.05 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 3i4n s ILE 204 CO 0.15 -0.76 -0.03 -0.63 0.00 0.00 0.00 174.94 173.68 3i4n s ILE 205 N 0.31 4.00 -0.91 2.92 1.09 -1.10 -2.02 121.20 125.49 3i4n s ILE 205 Ca 0.14 -0.33 -0.24 0.00 -1.10 0.00 0.00 60.65 59.12 3i4n s ILE 205 Cb -0.22 -2.74 0.03 0.00 -1.06 0.00 0.00 42.46 38.47 3i4n s ILE 205 CO -0.03 0.51 0.46 0.59 -0.10 0.00 0.00 174.94 176.36 3i4n n ASN 206 N 3.29 -2.69 0.00 3.58 3.02 0.41 -3.32 115.26 119.56 3i4n n ASN 206 Ca -0.17 -0.96 0.00 0.00 -0.03 0.00 0.00 54.58 53.42 3i4n n ASN 206 Cb 0.53 -1.15 0.00 0.00 -0.61 0.00 0.00 39.78 38.55 3i4n n ASN 206 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3i4n n GLY 207 N -1.82 1.54 3.43 7.41 0.00 -0.51 -4.74 105.19 110.50 3i4n n GLY 207 Ca -0.09 -0.39 -0.44 0.00 0.00 0.00 0.00 46.02 45.09 3i4n n GLY 207 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i4n n SER 208 N 4.00 -0.97 -4.60 1.61 3.41 -1.21 -4.64 113.62 111.21 3i4n n SER 208 Ca 0.00 1.02 -0.43 0.00 -0.26 0.00 0.00 58.87 59.20 3i4n n SER 208 Cb 0.00 -1.05 -0.02 0.00 -0.26 0.00 0.00 64.21 62.88 3i4n n SER 208 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3i4n s GLU 209 N -1.27 3.64 0.02 4.33 2.02 -1.26 -2.72 118.70 123.45 3i4n s GLU 209 Ca 0.62 0.76 -0.15 0.00 0.02 0.00 0.00 54.97 56.22 3i4n s GLU 209 Cb -0.74 -3.97 -0.06 0.00 0.10 0.00 0.00 34.13 29.46 3i4n s GLU 209 CO 0.59 -1.49 0.43 0.15 0.02 0.00 0.00 175.26 174.96 3i4n s LYS 210 N 4.73 3.94 -0.50 1.61 -0.14 0.12 -1.81 119.74 127.69 3i4n s LYS 210 Ca 0.55 0.44 0.03 0.00 -1.36 0.00 0.00 55.97 55.63 3i4n s LYS 210 Cb -0.10 -3.20 0.13 0.00 -1.68 0.00 0.00 37.83 32.98 3i4n s LYS 210 CO 0.32 0.67 0.25 0.08 -0.76 0.00 0.00 175.35 175.91 3i4n s VAL 211 N -1.12 2.74 0.08 3.17 1.01 -0.77 -1.31 120.40 124.21 3i4n s VAL 211 Ca 0.25 -3.04 -0.35 0.00 0.00 0.00 0.00 61.98 58.84 3i4n s VAL 211 Cb -0.17 -2.90 -0.14 0.00 0.00 0.00 0.00 36.38 33.17 3i4n s VAL 211 CO 0.15 -0.77 1.56 0.18 0.00 0.00 0.00 175.10 176.22 3i4n n LEU 212 N 3.43 2.72 -4.35 3.92 4.77 -1.26 -2.63 117.00 123.60 3i4n n LEU 212 Ca 0.05 1.08 -0.32 0.00 -0.03 0.00 0.00 56.01 56.79 3i4n n LEU 212 Cb 0.35 -1.34 -0.15 0.00 -2.33 0.00 0.00 43.42 39.95 3i4n n LEU 212 CO 0.32 -0.46 -0.51 -0.51 -1.33 0.00 0.00 177.39 174.89 3i4n s ILE 213 N 1.35 2.51 0.01 -0.08 1.10 -1.26 -4.76 121.20 120.08 3i4n s ILE 213 Ca 0.83 -0.91 -0.25 0.00 -0.51 0.00 0.00 60.65 59.82 3i4n s ILE 213 Cb -0.77 -1.96 -0.13 0.00 0.15 0.00 0.00 42.46 39.75 3i4n s ILE 213 CO 0.43 0.57 0.64 0.00 -2.11 0.00 0.00 174.94 174.48 3i4n n ALA 214 N 2.81 -2.48 -3.51 1.50 0.00 -1.23 -4.69 120.51 112.91 3i4n n ALA 214 Ca -0.17 0.37 -0.36 0.00 0.00 0.00 0.00 53.44 53.28 3i4n n ALA 214 Cb 0.52 -1.11 -0.14 0.00 0.00 0.00 0.00 19.45 18.73 3i4n n ALA 214 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3i4n s GLN 215 N -0.07 2.81 0.41 0.00 -1.52 -0.33 -0.93 119.66 120.03 3i4n s GLN 215 Ca 0.56 -1.02 -0.10 0.00 -1.95 0.00 0.00 55.36 52.85 3i4n s GLN 215 Cb -0.78 -3.17 -0.06 0.00 -0.22 0.00 0.00 33.01 28.77 3i4n s GLN 215 CO 0.36 -0.48 0.77 -2.00 -0.25 0.00 0.00 175.29 173.70 3i4n s GLU 216 N 1.37 3.78 0.03 2.91 2.12 -0.68 -0.28 118.70 127.94 3i4n s GLU 216 Ca -0.00 0.47 -0.29 0.00 0.36 0.00 0.00 54.97 55.51 3i4n s GLU 216 Cb -0.18 -2.39 0.10 0.00 0.26 0.00 0.00 34.13 31.93 3i4n s GLU 216 CO -0.01 -0.04 1.20 -0.98 -0.54 0.00 0.00 175.26 174.89 3i4n s ARG 217 N -3.86 0.62 -0.04 4.30 1.04 -0.94 -4.66 118.95 115.42 3i4n s ARG 217 Ca 0.51 -0.35 -0.27 0.00 -1.04 0.00 0.00 55.73 54.58 3i4n s ARG 217 Cb -0.10 0.21 -0.03 0.00 -2.04 0.00 0.00 34.95 32.98 3i4n s ARG 217 CO 0.31 -0.29 0.88 0.45 -0.04 0.00 0.00 175.30 176.62 3i4n s SER 218 N -3.03 7.21 1.08 -2.89 0.15 -1.26 -0.49 113.70 114.47 3i4n s SER 218 Ca 0.15 1.47 -0.19 0.00 0.70 0.00 0.00 55.95 58.08 3i4n s SER 218 Cb 0.03 -2.51 0.05 0.00 -1.71 0.00 0.00 66.02 61.88 3i4n s SER 218 CO -0.02 -0.23 -0.16 0.00 1.20 0.00 0.00 173.24 174.03 3i4n n ALA 219 N 3.98 -4.21 -3.98 5.45 0.00 0.76 -4.74 120.51 117.78 3i4n n ALA 219 Ca 0.04 -1.20 -0.18 0.00 0.00 0.00 0.00 53.44 52.10 3i4n n ALA 219 Cb 0.51 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.49 3i4n n ALA 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i4n n GLY 220 N 2.18 3.21 4.34 0.00 0.00 -1.26 -4.77 105.19 108.90 3i4n n GLY 220 Ca 0.01 -2.27 -0.35 0.00 0.00 0.00 0.00 46.02 43.42 3i4n n GLY 220 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3i4n n ASN 221 N -1.65 -0.10 -3.97 1.61 3.02 0.77 -4.92 115.26 110.02 3i4n n ASN 221 Ca -0.05 -1.23 -0.18 0.00 -0.03 0.00 0.00 54.58 53.09 3i4n n ASN 221 Cb 0.37 -1.55 -0.15 0.00 -0.61 0.00 0.00 39.78 37.84 3i4n n ASN 221 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3i4n s ILE 222 N -3.91 0.56 0.01 2.41 1.01 -1.24 -4.35 121.20 115.69 3i4n s ILE 222 Ca 0.31 -0.26 -0.24 0.00 0.00 0.00 0.00 60.65 60.45 3i4n s ILE 222 Cb -0.18 -0.50 -0.05 0.00 0.01 0.00 0.00 42.46 41.74 3i4n s ILE 222 CO 0.98 0.18 0.74 -0.69 0.00 0.00 0.00 174.94 176.15 3i4n s VAL 223 N 0.09 4.82 -0.03 2.92 1.01 -1.26 -4.01 120.40 123.94 3i4n s VAL 223 Ca -0.01 1.57 -0.19 0.00 0.00 0.00 0.00 61.98 63.36 3i4n s VAL 223 Cb -0.06 -4.09 0.03 0.00 0.00 0.00 0.00 36.38 32.27 3i4n s VAL 223 CO -0.00 0.34 0.40 -1.10 0.00 0.00 0.00 175.10 174.74 3i4n s GLN 224 N 0.16 0.75 -0.08 2.72 -0.21 -0.35 -5.00 119.66 117.63 3i4n s GLN 224 Ca 0.38 -0.04 0.02 0.00 0.02 0.00 0.00 55.36 55.74 3i4n s GLN 224 Cb -0.20 0.34 -0.02 0.00 1.00 0.00 0.00 33.01 34.13 3i4n s GLN 224 CO 0.22 -0.21 -0.15 0.14 -2.12 0.00 0.00 175.29 173.16 3i4n s VAL 225 N -1.21 2.92 -0.01 1.09 -7.23 -1.26 -0.14 120.40 114.57 3i4n s VAL 225 Ca -0.12 -0.74 0.03 0.00 -1.81 0.00 0.00 61.98 59.34 3i4n s VAL 225 Cb -0.04 -2.17 -0.01 0.00 0.56 0.00 0.00 36.38 34.72 3i4n s VAL 225 CO 0.05 0.56 -0.11 -0.36 -0.31 0.00 0.00 175.10 174.94 3i4n s PHE 226 N -0.20 0.95 -0.04 2.82 2.99 0.11 -1.65 117.98 122.97 3i4n s PHE 226 Ca -0.00 -0.19 -0.28 0.00 0.00 0.00 0.00 56.93 56.47 3i4n s PHE 226 Cb -0.13 -0.61 -0.03 0.00 0.00 0.00 0.00 43.02 42.24 3i4n s PHE 226 CO 0.03 -0.02 0.89 0.15 -0.00 0.00 0.00 175.22 176.28 3i4n s LYS 227 N -0.28 4.50 0.15 0.44 1.02 -1.26 -1.82 119.74 122.49 3i4n s LYS 227 Ca 0.04 1.24 -0.11 0.00 0.02 0.00 0.00 55.97 57.16 3i4n s LYS 227 Cb -0.04 -3.47 -0.07 0.00 -0.52 0.00 0.00 37.83 33.73 3i4n s LYS 227 CO -0.00 -0.05 0.49 0.15 -0.92 0.00 0.00 175.35 175.01 3i4n s LYS 228 N 1.09 3.84 0.87 1.68 -0.14 -0.89 -5.00 119.74 121.19 3i4n s LYS 228 Ca 0.47 0.29 -0.18 0.00 -1.36 0.00 0.00 55.97 55.19 3i4n s LYS 228 Cb -0.20 -2.87 -0.09 0.00 -1.68 0.00 0.00 37.83 33.00 3i4n s LYS 228 CO 0.23 0.46 -0.84 0.00 -0.76 0.00 0.00 175.35 174.44 3i4n n ALA 229 N 0.53 -2.29 0.04 5.17 0.00 -1.26 -4.87 120.51 117.83 3i4n n ALA 229 Ca -0.04 -0.98 -0.10 0.00 0.00 0.00 0.00 53.44 52.32 3i4n n ALA 229 Cb 0.52 -0.64 0.03 0.00 0.00 0.00 0.00 19.45 19.35 3i4n n ALA 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n h ALA 230 N -1.51 0.59 -0.14 0.00 0.00 -1.97 -3.24 119.26 112.99 3i4n h ALA 230 Ca -0.28 -0.59 -0.13 0.00 0.00 0.00 0.00 54.91 53.91 3i4n h ALA 230 Cb 0.96 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 3i4n h ALA 230 CO 0.16 0.74 0.06 -0.35 0.00 0.00 0.00 179.25 179.87 3i4n n PRO 231 N -3.87 1.41 -4.68 0.00 -0.04 -1.26 -4.85 135.00 121.70 3i4n n PRO 231 Ca -0.04 -0.64 -0.30 0.00 -0.04 0.00 0.00 63.50 62.47 3i4n n PRO 231 Cb 0.69 -1.35 -0.17 0.00 -0.04 0.00 0.00 33.50 32.63 3i4n n PRO 231 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3i4n s SER 232 N 1.48 2.78 0.54 3.54 0.15 -1.23 -4.98 113.70 115.97 3i4n s SER 232 Ca 0.20 -0.51 0.25 0.00 0.70 0.00 0.00 55.95 56.59 3i4n s SER 232 Cb 0.12 -1.27 1.50 0.00 -1.71 0.00 0.00 66.02 64.67 3i4n s SER 232 CO -0.01 0.07 2.14 1.55 1.20 0.00 0.00 173.24 178.18 3i4n h PRO 233 N 7.23 0.00 -6.75 5.44 0.13 -1.92 -3.42 132.00 132.71 3i4n h PRO 233 Ca -0.29 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.34 3i4n h PRO 233 Cb 1.19 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 3i4n h PRO 233 CO 0.51 0.07 0.02 0.42 -0.23 0.00 0.00 178.00 178.80 3i4n s ILE 234 N -4.51 4.91 0.00 -3.56 1.09 -1.26 -2.79 121.20 115.07 3i4n s ILE 234 Ca -0.04 0.26 0.00 0.00 -1.10 0.00 0.00 60.65 59.77 3i4n s ILE 234 Cb 0.15 -3.78 0.00 0.00 -1.06 0.00 0.00 42.46 37.76 3i4n s ILE 234 CO 0.60 -0.57 0.00 -0.24 -0.10 0.00 0.00 174.94 174.62 3i4n n SER 235 N -1.53 0.00 -4.39 3.58 2.88 -1.08 -4.78 113.62 108.30 3i4n n SER 235 Ca 0.00 0.03 -0.21 0.00 -1.33 0.00 0.00 58.87 57.36 3i4n n SER 235 Cb 0.54 -0.23 -0.10 0.00 -0.75 0.00 0.00 64.21 63.67 3i4n n SER 235 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3i4n s HIS 236 N -0.46 1.96 0.01 0.66 3.76 -1.26 -2.08 115.29 117.87 3i4n s HIS 236 Ca 0.00 -0.46 0.00 0.00 -0.15 0.00 0.00 55.06 54.45 3i4n s HIS 236 Cb 0.00 -0.90 -0.01 0.00 1.11 0.00 0.00 32.58 32.78 3i4n s HIS 236 CO 0.00 0.48 -0.02 0.08 -0.85 0.00 0.00 174.74 174.43 3i4n s VAL 237 N -2.59 0.14 -0.24 -0.90 1.01 -0.76 -2.79 120.40 114.27 3i4n s VAL 237 Ca 0.24 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.82 3i4n s VAL 237 Cb -0.03 -0.19 0.05 0.00 0.00 0.00 0.00 36.38 36.21 3i4n s VAL 237 CO 0.10 -0.18 -0.13 0.00 0.00 0.00 0.00 175.10 174.89 3i4n s ALA 238 N -0.62 2.49 0.21 5.51 0.00 -1.12 0.05 121.76 128.29 3i4n s ALA 238 Ca -0.06 -1.62 0.08 0.00 0.00 0.00 0.00 51.96 50.36 3i4n s ALA 238 Cb -0.04 -1.49 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 3i4n s ALA 238 CO -0.00 -0.99 0.00 -1.21 0.00 0.00 0.00 175.76 173.56 3i4n s GLU 239 N 1.15 2.37 -0.20 0.00 2.02 0.81 -1.64 118.70 123.22 3i4n s GLU 239 Ca -0.06 -1.21 -0.08 0.00 0.02 0.00 0.00 54.97 53.64 3i4n s GLU 239 Cb -0.18 -2.29 0.08 0.00 0.10 0.00 0.00 34.13 31.84 3i4n s GLU 239 CO -0.07 0.42 0.45 -1.50 0.02 0.00 0.00 175.26 174.58 3i4n s ILE 240 N -1.93 -0.45 -0.12 -1.63 2.07 -1.01 -1.21 121.20 116.91 3i4n s ILE 240 Ca 0.29 0.12 -0.17 0.00 -1.41 0.00 0.00 60.65 59.48 3i4n s ILE 240 Cb -0.08 -0.70 -0.04 0.00 0.13 0.00 0.00 42.46 41.77 3i4n s ILE 240 CO 0.19 0.05 0.45 -0.13 -1.91 0.00 0.00 174.94 173.59 3i4n s ARG 241 N 2.22 4.31 -0.14 3.50 0.52 -1.26 -1.20 118.95 126.91 3i4n s ARG 241 Ca -0.05 0.40 0.02 0.00 -0.52 0.00 0.00 55.73 55.58 3i4n s ARG 241 Cb -0.11 -3.43 0.01 0.00 0.52 0.00 0.00 34.95 31.95 3i4n s ARG 241 CO -0.14 0.19 -0.20 -1.54 0.02 0.00 0.00 175.30 173.64 3i4n s SER 242 N 0.53 2.94 -0.01 0.23 1.04 -1.18 0.27 113.70 117.53 3i4n s SER 242 Ca 0.25 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 56.11 3i4n s SER 242 Cb -0.15 -1.36 0.01 0.00 0.10 0.00 0.00 66.02 64.63 3i4n s SER 242 CO 0.09 0.05 0.01 0.00 0.98 0.00 0.00 173.24 174.37 3i4n s ALA 243 N 0.96 0.13 -0.02 5.32 0.00 -1.23 -2.52 121.76 124.40 3i4n s ALA 243 Ca -0.04 0.12 -0.30 0.00 0.00 0.00 0.00 51.96 51.74 3i4n s ALA 243 Cb -0.15 -0.16 -0.08 0.00 0.00 0.00 0.00 23.12 22.74 3i4n s ALA 243 CO -0.04 -0.04 1.93 -0.51 0.00 0.00 0.00 175.76 177.10 3i4n s LEU 244 N 0.55 4.28 0.46 0.00 1.43 -1.22 -4.82 118.68 119.36 3i4n s LEU 244 Ca -0.05 2.47 0.26 0.00 -1.03 0.00 0.00 54.13 55.78 3i4n s LEU 244 Cb -0.07 -3.53 1.29 0.00 0.03 0.00 0.00 46.19 43.91 3i4n s LEU 244 CO -0.01 -1.14 1.79 -0.08 0.23 0.00 0.00 176.35 177.13 3i4n h GLU 245 N 10.93 0.22 -2.28 1.70 4.81 -1.99 -3.39 114.58 124.57 3i4n h GLU 245 Ca -0.46 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 58.68 3i4n h GLU 245 Cb 1.22 -0.05 -0.22 0.00 0.63 0.00 0.00 28.75 30.34 3i4n h GLU 245 CO 0.95 0.14 -0.01 0.15 -0.73 0.00 0.00 179.01 179.51 3i4n s LYS 246 N -5.26 0.71 0.00 1.92 1.02 -1.26 -5.02 119.74 111.85 3i4n s LYS 246 Ca -0.07 0.81 0.00 0.00 0.02 0.00 0.00 55.97 56.73 3i4n s LYS 246 Cb 0.24 0.35 0.00 0.00 -0.52 0.00 0.00 37.83 37.90 3i4n s LYS 246 CO 0.80 -0.09 0.00 0.41 -0.92 0.00 0.00 175.35 175.55 3i4n n GLY 247 N 2.69 0.07 4.52 -3.33 0.00 -1.26 -4.72 105.19 103.14 3i4n n GLY 247 Ca -0.14 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.14 3i4n n GLY 247 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3i4n n SER 248 N 0.00 0.00 -3.69 1.61 2.88 -1.26 -4.56 113.62 108.60 3i4n n SER 248 Ca 0.00 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.30 3i4n n SER 248 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 3i4n n SER 248 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3i4n n ARG 249 N 0.00 -1.32 -2.46 -1.46 1.74 -1.26 -4.93 116.66 106.97 3i4n n ARG 249 Ca 0.00 0.77 -0.41 0.00 -0.77 0.00 0.00 57.85 57.44 3i4n n ARG 249 Cb 0.00 -3.07 -0.04 0.00 -1.02 0.00 0.00 32.46 28.33 3i4n n ARG 249 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3i4n s PHE 250 N -3.10 3.52 -0.64 -1.55 2.99 -1.26 -4.72 117.98 113.22 3i4n s PHE 250 Ca 0.10 1.51 0.06 0.00 0.00 0.00 0.00 56.93 58.60 3i4n s PHE 250 Cb -0.05 -3.34 0.26 0.00 0.00 0.00 0.00 43.02 39.89 3i4n s PHE 250 CO 0.88 -0.87 0.79 -0.89 -0.00 0.00 0.00 175.22 175.13 3i4n n ILE 251 N 2.61 2.52 -3.54 0.64 5.41 -1.26 -3.38 119.36 122.36 3i4n n ILE 251 Ca 0.04 -5.29 -0.39 0.00 1.00 0.00 0.00 62.75 58.11 3i4n n ILE 251 Cb 0.46 -2.01 -0.11 0.00 -0.71 0.00 0.00 39.64 37.27 3i4n n ILE 251 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3i4n s SER 252 N -2.60 6.07 0.96 4.38 1.04 -1.05 -4.88 113.70 117.62 3i4n s SER 252 Ca 0.41 -0.10 -0.15 0.00 0.48 0.00 0.00 55.95 56.59 3i4n s SER 252 Cb 0.16 -2.14 0.18 0.00 0.10 0.00 0.00 66.02 64.32 3i4n s SER 252 CO -0.02 -0.13 1.22 -0.89 0.98 0.00 0.00 173.24 174.40 3i4n s THR 253 N 1.80 1.94 -0.12 2.02 2.01 -1.26 -3.08 115.64 118.94 3i4n s THR 253 Ca 0.08 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 62.04 3i4n s THR 253 Cb -0.16 -2.87 0.06 0.00 0.01 0.00 0.00 72.50 69.54 3i4n s THR 253 CO 0.11 0.00 0.16 -0.22 -0.69 0.00 0.00 174.62 173.98 3i4n s LEU 254 N -6.03 -0.02 -0.07 4.42 2.96 -0.34 -4.68 118.68 114.92 3i4n s LEU 254 Ca 0.69 0.05 -0.10 0.00 -0.22 0.00 0.00 54.13 54.55 3i4n s LEU 254 Cb -0.08 0.21 -0.05 0.00 0.50 0.00 0.00 46.19 46.77 3i4n s LEU 254 CO 0.53 -0.28 0.25 -1.10 -1.32 0.00 0.00 176.35 174.43 3i4n s GLN 255 N 2.27 3.65 -0.55 1.98 -0.21 -1.25 -2.41 119.66 123.16 3i4n s GLN 255 Ca 0.04 0.09 0.05 0.00 0.02 0.00 0.00 55.36 55.57 3i4n s GLN 255 Cb -0.14 -3.21 0.20 0.00 1.00 0.00 0.00 33.01 30.86 3i4n s GLN 255 CO -0.08 0.73 0.49 0.28 -2.12 0.00 0.00 175.29 174.59 3i4n n VAL 256 N 1.95 0.40 0.00 1.09 0.31 -0.65 -1.57 118.33 119.87 3i4n n VAL 256 Ca -0.17 -4.29 0.00 0.00 -0.01 0.00 0.00 64.34 59.86 3i4n n VAL 256 Cb 0.54 -1.95 0.00 0.00 -0.91 0.00 0.00 33.84 31.52 3i4n n VAL 256 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3i4n n LYS 257 N 2.00 -1.28 -2.70 5.55 5.02 0.42 -2.79 118.16 124.38 3i4n n LYS 257 Ca 0.25 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.48 3i4n n LYS 257 Cb 0.43 0.00 0.10 0.00 -0.02 0.00 0.00 35.03 35.54 3i4n n LYS 257 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3i4n n LEU 258 N 0.00 -1.83 -4.06 -0.35 7.94 -1.12 -3.76 117.00 113.82 3i4n n LEU 258 Ca 0.00 -2.81 -0.36 0.00 -1.11 0.00 0.00 56.01 51.73 3i4n n LEU 258 Cb 0.00 0.95 0.05 0.00 0.53 0.00 0.00 43.42 44.95 3i4n n LEU 258 CO 0.00 1.84 -1.41 -1.22 -1.11 0.00 0.00 177.39 175.50 3i4n n TYR 259 N 0.49 -3.40 -0.51 1.96 4.02 -1.06 -2.63 117.16 116.04 3i4n n TYR 259 Ca 0.01 0.22 0.00 0.00 -0.01 0.00 0.00 57.90 58.12 3i4n n TYR 259 Cb 0.72 -1.46 0.00 0.00 -0.02 0.00 0.00 39.34 38.58 3i4n n TYR 259 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3i4n n GLY 260 N 3.19 -0.78 3.73 2.72 0.00 -1.12 -3.85 105.19 109.09 3i4n n GLY 260 Ca -0.01 -0.55 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 3i4n n GLY 260 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3i4n s ARG 261 N -0.24 2.54 -0.31 1.61 6.06 -1.26 -4.59 118.95 122.76 3i4n s ARG 261 Ca 0.00 1.93 -0.35 0.00 -2.50 0.00 0.00 55.73 54.81 3i4n s ARG 261 Cb 0.00 -1.86 -0.11 0.00 0.06 0.00 0.00 34.95 33.04 3i4n s ARG 261 CO 0.00 -1.57 2.13 -1.91 -2.50 0.00 0.00 175.30 171.45 3i4n n GLU 262 N -2.05 1.26 0.00 5.12 2.13 -1.26 -1.97 120.64 123.87 3i4n n GLU 262 Ca 0.15 0.37 0.00 0.00 0.66 0.00 0.00 57.16 58.34 3i4n n GLU 262 Cb 0.49 -2.52 0.00 0.00 0.27 0.00 0.00 31.44 29.68 3i4n n GLU 262 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3i4n n GLY 263 N 6.11 2.49 3.67 8.31 0.00 -1.26 -5.06 105.19 119.45 3i4n n GLY 263 Ca 0.37 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 3i4n n GLY 263 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i4n s SER 264 N 0.00 6.77 0.00 1.61 1.04 -0.83 -5.00 113.70 117.29 3i4n s SER 264 Ca 0.00 2.13 0.00 0.00 0.48 0.00 0.00 55.95 58.56 3i4n s SER 264 Cb 0.00 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.57 3i4n s SER 264 CO 0.00 -0.82 0.00 -1.54 0.98 0.00 0.00 173.24 171.86 3i4n n SER 265 N 6.25 0.00 -2.71 7.02 3.41 -1.26 -4.23 113.62 122.10 3i4n n SER 265 Ca 0.15 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.61 3i4n n SER 265 Cb 0.43 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.44 3i4n n SER 265 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i4n n ALA 266 N -3.00 -1.13 -0.28 7.33 0.00 -1.26 -4.72 120.51 117.45 3i4n n ALA 266 Ca 0.00 0.16 -0.02 0.00 0.00 0.00 0.00 53.44 53.58 3i4n n ALA 266 Cb 0.00 -3.21 -0.03 0.00 0.00 0.00 0.00 19.45 16.21 3i4n n ALA 266 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3i4n n ARG 267 N -3.52 0.56 -1.59 0.00 5.12 -1.26 -4.28 116.66 111.69 3i4n n ARG 267 Ca -0.08 -0.19 -0.46 0.00 -1.93 0.00 0.00 57.85 55.20 3i4n n ARG 267 Cb 0.57 -1.50 -0.04 0.00 -1.16 0.00 0.00 32.46 30.33 3i4n n ARG 267 CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 3i4n n THR 268 N 2.32 0.43 -2.90 0.55 5.66 -1.25 -4.68 114.28 114.41 3i4n n THR 268 Ca 0.08 -0.29 -0.41 0.00 -3.05 0.00 0.00 64.05 60.38 3i4n n THR 268 Cb 0.27 -2.17 -0.04 0.00 -1.55 0.00 0.00 70.33 66.83 3i4n n THR 268 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 3i4n s ILE 269 N 6.59 4.92 0.10 1.09 1.01 -1.26 -2.55 121.20 131.10 3i4n s ILE 269 Ca 0.99 1.65 0.03 0.00 0.00 0.00 0.00 60.65 63.32 3i4n s ILE 269 Cb -0.55 -4.14 -0.04 0.00 0.01 0.00 0.00 42.46 37.74 3i4n s ILE 269 CO 0.43 0.10 -0.08 -0.54 0.00 0.00 0.00 174.94 174.85 3i4n s LYS 270 N 1.68 0.82 -0.04 2.79 1.02 -1.25 -2.40 119.74 122.37 3i4n s LYS 270 Ca 0.40 -1.23 -0.02 0.00 0.02 0.00 0.00 55.97 55.14 3i4n s LYS 270 Cb -0.17 -0.34 0.02 0.00 -0.52 0.00 0.00 37.83 36.82 3i4n s LYS 270 CO 0.16 0.03 0.09 0.00 -0.92 0.00 0.00 175.35 174.71 3i4n s ALA 271 N -3.01 -0.16 0.26 5.17 0.00 0.15 0.16 121.76 124.33 3i4n s ALA 271 Ca 0.08 0.41 -0.17 0.00 0.00 0.00 0.00 51.96 52.29 3i4n s ALA 271 Cb 0.01 -0.28 -0.08 0.00 0.00 0.00 0.00 23.12 22.77 3i4n s ALA 271 CO -0.02 -0.10 0.71 0.99 0.00 0.00 0.00 175.76 177.34 3i4n s THR 272 N 0.69 4.65 0.03 0.00 2.01 -0.61 -1.27 115.64 121.14 3i4n s THR 272 Ca -0.05 1.07 0.04 0.00 0.31 0.00 0.00 61.69 63.06 3i4n s THR 272 Cb -0.07 -3.73 -0.02 0.00 0.01 0.00 0.00 72.50 68.69 3i4n s THR 272 CO -0.03 0.02 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.04 3i4n s LEU 273 N -2.46 2.14 0.05 4.42 1.43 -1.26 -3.78 118.68 119.22 3i4n s LEU 273 Ca 0.48 -0.39 -0.36 0.00 -1.03 0.00 0.00 54.13 52.83 3i4n s LEU 273 Cb -0.13 -0.53 -0.15 0.00 0.03 0.00 0.00 46.19 45.41 3i4n s LEU 273 CO 0.19 0.03 1.55 -0.81 0.23 0.00 0.00 176.35 177.54 3i4n n PRO 274 N 2.09 1.68 -0.01 1.29 -0.04 -1.26 -0.63 135.00 138.12 3i4n n PRO 274 Ca -0.17 0.61 0.00 0.00 -0.04 0.00 0.00 63.50 63.89 3i4n n PRO 274 Cb 0.55 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.68 3i4n n PRO 274 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3i4n n TYR 275 N 3.76 0.00 -2.77 0.54 4.02 -1.26 -4.96 117.16 116.49 3i4n n TYR 275 Ca 0.19 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.66 3i4n n TYR 275 Cb 0.23 -0.05 -0.04 0.00 -0.02 0.00 0.00 39.34 39.47 3i4n n TYR 275 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3i4n s ILE 276 N -2.92 4.16 -0.01 -0.72 1.01 0.20 -4.02 121.20 118.90 3i4n s ILE 276 Ca 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 60.65 60.54 3i4n s ILE 276 Cb 0.00 -4.74 -0.03 0.00 0.01 0.00 0.00 42.46 37.70 3i4n s ILE 276 CO 0.00 -1.54 0.84 0.29 0.00 0.00 0.00 174.94 174.53 3i4n n LYS 277 N 8.15 0.22 -3.88 2.79 5.02 -0.28 -4.51 118.16 125.66 3i4n n LYS 277 Ca -0.02 -0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 3i4n n LYS 277 Cb 0.47 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 3i4n n LYS 277 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 3i4n n GLN 278 N 3.05 -3.36 -4.03 1.97 7.27 -1.26 -4.76 117.38 116.26 3i4n n GLN 278 Ca 0.05 0.00 -0.22 0.00 0.07 0.00 0.00 57.00 56.89 3i4n n GLN 278 Cb 0.09 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 32.71 3i4n n GLN 278 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 3i4n s ASP 279 N -1.06 5.96 -0.02 1.69 1.01 -1.26 -4.08 116.67 118.91 3i4n s ASP 279 Ca 0.00 -0.06 0.05 0.00 0.71 0.00 0.00 52.55 53.25 3i4n s ASP 279 Cb 0.00 -1.66 -0.01 0.00 1.01 0.00 0.00 42.92 42.26 3i4n s ASP 279 CO 0.00 -0.04 -0.16 -0.63 0.21 0.00 0.00 175.17 174.55 3i4n s ILE 280 N -2.00 1.27 -0.57 0.77 1.01 -0.40 -4.90 121.20 116.38 3i4n s ILE 280 Ca 0.33 -0.67 -0.28 0.00 0.00 0.00 0.00 60.65 60.03 3i4n s ILE 280 Cb -0.09 -1.07 0.02 0.00 0.01 0.00 0.00 42.46 41.33 3i4n s ILE 280 CO 0.27 0.36 1.33 -2.16 0.00 0.00 0.00 174.94 174.74 3i4n s PRO 281 N -0.26 3.39 0.00 2.79 0.04 -1.26 0.34 135.00 140.05 3i4n s PRO 281 Ca 0.04 0.38 0.00 0.00 0.04 0.00 0.00 61.00 61.46 3i4n s PRO 281 Cb -0.07 -4.08 0.00 0.00 0.04 0.00 0.00 34.50 30.39 3i4n s PRO 281 CO -0.00 -1.83 0.00 0.44 0.04 0.00 0.00 177.00 175.65 3i4n n ILE 282 N 6.79 0.00 0.00 0.56 -5.35 -1.01 -1.00 119.36 119.35 3i4n n ILE 282 Ca 0.11 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.59 3i4n n ILE 282 Cb 0.49 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.39 3i4n n ILE 282 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 3i4n n VAL 283 N -2.55 0.00 -0.24 7.28 0.31 -1.26 -2.12 118.33 119.74 3i4n n VAL 283 Ca 0.00 1.29 0.14 0.00 -0.01 0.00 0.00 64.34 65.75 3i4n n VAL 283 Cb 0.00 -2.05 0.26 0.00 -0.91 0.00 0.00 33.84 31.14 3i4n n VAL 283 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3i4n n ILE 284 N -1.73 -0.30 0.28 2.52 5.41 -0.17 -0.48 119.36 124.89 3i4n n ILE 284 Ca 0.00 1.53 -0.13 0.00 1.00 0.00 0.00 62.75 65.15 3i4n n ILE 284 Cb 0.00 -2.30 -0.07 0.00 -0.71 0.00 0.00 39.64 36.57 3i4n n ILE 284 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3i4n h ILE 285 N 0.00 0.00 -1.61 1.39 2.04 -1.58 -1.82 117.51 115.93 3i4n h ILE 285 Ca 0.47 0.00 0.47 0.00 1.00 0.00 0.00 64.86 66.80 3i4n h ILE 285 Cb 1.06 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.08 3i4n h ILE 285 CO -0.64 0.00 1.25 -0.26 0.00 0.00 0.00 178.15 178.51 3i4n h PHE 286 N -0.80 0.00 0.11 1.37 -1.00 -0.24 1.15 116.94 117.53 3i4n h PHE 286 Ca -0.07 0.00 -0.31 0.00 2.81 0.00 0.00 57.97 60.40 3i4n h PHE 286 Cb 0.64 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.19 3i4n h PHE 286 CO -0.04 0.00 -1.62 0.00 -1.61 0.00 0.00 178.31 175.04 3i4n h ARG 287 N 0.00 0.23 -0.86 1.51 3.08 -1.45 0.23 114.38 117.12 3i4n h ARG 287 Ca 0.76 -0.38 0.01 0.00 0.07 0.00 0.00 59.98 60.43 3i4n h ARG 287 Cb 3.26 0.14 -0.04 0.00 0.08 0.00 0.00 29.97 33.41 3i4n h ARG 287 CO -0.01 1.06 0.56 0.00 -1.07 0.00 0.00 179.97 180.51 3i4n h ALA 288 N 0.48 1.37 -0.58 0.04 0.00 0.21 -0.23 119.26 120.56 3i4n h ALA 288 Ca -0.27 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 3i4n h ALA 288 Cb 2.02 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 19.43 3i4n h ALA 288 CO 0.14 0.58 0.19 -0.07 0.00 0.00 0.00 179.25 180.09 3i4n h LEU 289 N 1.17 0.79 0.00 0.00 3.38 -0.76 -3.44 115.31 116.44 3i4n h LEU 289 Ca 0.31 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3i4n h LEU 289 Cb -0.12 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.43 3i4n h LEU 289 CO -0.07 0.74 0.00 0.61 0.09 0.00 0.00 178.44 179.81 3i4n n GLY 290 N -0.95 1.09 2.49 0.83 0.00 -0.10 -4.77 105.19 103.78 3i4n n GLY 290 Ca 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 3i4n n GLY 290 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3i4n n ILE 291 N -0.01 1.03 -0.32 -0.61 5.41 0.78 -4.98 119.36 120.66 3i4n n ILE 291 Ca 0.00 -4.38 0.29 0.00 1.00 0.00 0.00 62.75 59.66 3i4n n ILE 291 Cb 0.00 -0.32 0.63 0.00 -0.71 0.00 0.00 39.64 39.24 3i4n n ILE 291 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3i4n h ILE 292 N 2.09 0.45 -3.46 1.39 2.04 -1.80 -3.37 117.51 114.85 3i4n h ILE 292 Ca 0.07 -0.06 -0.54 0.00 1.00 0.00 0.00 64.86 65.33 3i4n h ILE 292 Cb 0.94 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 3i4n h ILE 292 CO 0.60 0.03 0.09 -2.16 0.00 0.00 0.00 178.15 176.71 3i4n s PRO 293 N -5.22 4.34 0.67 2.37 0.04 -1.26 -4.82 135.00 131.13 3i4n s PRO 293 Ca -0.07 0.93 -0.11 0.00 0.04 0.00 0.00 61.00 61.78 3i4n s PRO 293 Cb 0.24 -3.11 0.17 0.00 0.04 0.00 0.00 34.50 31.84 3i4n s PRO 293 CO 0.80 0.53 0.50 -0.25 0.04 0.00 0.00 177.00 178.61 3i4n n ASP 294 N 1.30 -2.26 0.00 6.66 10.43 -1.26 -1.64 116.55 129.77 3i4n n ASP 294 Ca -0.06 -0.65 0.00 0.00 2.57 0.00 0.00 54.79 56.65 3i4n n ASP 294 Cb 0.50 -0.50 0.00 0.00 1.84 0.00 0.00 41.12 42.96 3i4n n ASP 294 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3i4n n GLY 295 N -1.97 0.00 0.08 0.44 0.00 -1.26 -3.71 105.19 98.78 3i4n n GLY 295 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 3i4n n GLY 295 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3i4n n GLU 296 N 0.00 0.66 0.17 1.61 2.13 -1.12 -2.88 120.64 121.20 3i4n n GLU 296 Ca 0.00 0.11 0.03 0.00 0.66 0.00 0.00 57.16 57.96 3i4n n GLU 296 Cb 0.00 -1.66 0.25 0.00 0.27 0.00 0.00 31.44 30.30 3i4n n GLU 296 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 3i4n h ILE 297 N 0.00 1.05 0.00 6.31 2.04 -1.39 -2.88 117.51 122.64 3i4n h ILE 297 Ca -0.34 -1.80 -0.15 0.00 1.00 0.00 0.00 64.86 63.56 3i4n h ILE 297 Cb 1.92 2.06 -0.02 0.00 -0.74 0.00 0.00 36.82 40.04 3i4n h ILE 297 CO 0.04 0.46 -0.73 -0.07 0.00 0.00 0.00 178.15 177.85 3i4n h LEU 298 N 0.00 0.00 -0.82 1.44 -0.00 -1.84 -3.28 115.31 110.81 3i4n h LEU 298 Ca -0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.86 3i4n h LEU 298 Cb 1.02 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.64 3i4n h LEU 298 CO 0.06 0.73 0.46 -0.33 -0.00 0.00 0.00 178.44 179.36 3i4n h GLU 299 N 0.00 1.15 0.00 1.13 5.08 -1.36 0.40 114.58 120.97 3i4n h GLU 299 Ca -0.01 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 3i4n h GLU 299 Cb 1.42 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 3i4n h GLU 299 CO 0.09 0.84 -0.14 0.45 -1.00 0.00 0.00 179.01 179.26 3i4n h HIS 300 N 1.14 0.00 0.06 4.33 3.86 -1.63 -3.19 115.15 119.73 3i4n h HIS 300 Ca 0.29 0.00 -0.38 0.00 -1.16 0.00 0.00 60.37 59.12 3i4n h HIS 300 Cb 0.02 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.45 3i4n h HIS 300 CO 0.00 0.14 -2.21 -0.89 0.86 0.00 0.00 177.93 175.83 3i4n n ILE 301 N -4.16 1.64 -3.99 2.45 5.41 -0.91 -3.97 119.36 115.84 3i4n n ILE 301 Ca -0.02 -0.59 -0.34 0.00 1.00 0.00 0.00 62.75 62.80 3i4n n ILE 301 Cb 0.21 -1.61 -0.14 0.00 -0.71 0.00 0.00 39.64 37.39 3i4n n ILE 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4n n TYR 303 N 4.54 1.73 0.00 0.00 0.53 -1.26 -4.49 117.16 118.21 3i4n n TYR 303 Ca -0.14 -2.03 0.00 0.00 -1.02 0.00 0.00 57.90 54.72 3i4n n TYR 303 Cb 0.43 -1.26 0.00 0.00 -1.03 0.00 0.00 39.34 37.48 3i4n n TYR 303 CO 0.00 0.00 0.00 -3.47 -1.02 0.00 0.00 176.86 172.37 3i4n n ASP 304 N 0.57 0.00 -2.22 7.72 -0.08 -1.26 -4.92 116.55 116.35 3i4n n ASP 304 Ca 0.45 0.00 -0.19 0.00 -1.51 0.00 0.00 54.79 53.53 3i4n n ASP 304 Cb 0.55 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.92 3i4n n ASP 304 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 3i4n n VAL 305 N 0.00 3.11 -0.38 5.18 0.31 -1.26 -3.26 118.33 122.03 3i4n n VAL 305 Ca 0.00 -2.22 0.00 0.00 -0.01 0.00 0.00 64.34 62.11 3i4n n VAL 305 Cb 0.00 -1.73 0.00 0.00 -0.91 0.00 0.00 33.84 31.20 3i4n n VAL 305 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3i4n n ASN 306 N 1.49 0.00 -2.72 4.52 3.02 -1.26 -4.84 115.26 115.47 3i4n n ASN 306 Ca 0.43 -0.17 -0.25 0.00 -0.03 0.00 0.00 54.58 54.57 3i4n n ASN 306 Cb 0.69 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.78 3i4n n ASN 306 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3i4n n ASP 307 N 0.00 6.68 -0.61 6.41 -0.08 -1.20 -4.62 116.55 123.12 3i4n n ASP 307 Ca 0.00 -2.48 0.48 0.00 -1.51 0.00 0.00 54.79 51.29 3i4n n ASP 307 Cb 0.04 -1.41 0.74 0.00 2.34 0.00 0.00 41.12 42.83 3i4n n ASP 307 CO 0.00 0.00 0.00 -2.67 0.12 0.00 0.00 177.20 174.65 3i4n n TRP 308 N 3.16 0.00 0.26 -0.67 4.27 -1.26 -0.30 117.44 122.90 3i4n n TRP 308 Ca 0.58 0.00 -0.10 0.00 -3.89 0.00 0.00 57.50 54.09 3i4n n TRP 308 Cb 0.51 -0.45 -0.05 0.00 -1.36 0.00 0.00 31.31 29.96 3i4n n TRP 308 CO 0.00 0.00 0.00 1.96 -2.29 0.00 0.00 177.69 177.36 3i4n h GLN 309 N 0.00 -0.65 -0.58 -2.67 4.20 -1.99 0.32 115.11 113.73 3i4n h GLN 309 Ca 0.85 0.04 0.12 0.00 0.06 0.00 0.00 58.65 59.72 3i4n h GLN 309 Cb 3.61 0.15 -0.11 0.00 0.30 0.00 0.00 27.48 31.42 3i4n h GLN 309 CO -0.01 -0.44 -0.20 1.98 -0.67 0.00 0.00 178.83 179.50 3i4n h MET 310 N -0.81 -0.05 0.00 1.46 4.05 -1.06 -1.61 114.93 116.91 3i4n h MET 310 Ca -0.07 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 3i4n h MET 310 Cb 0.52 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.33 3i4n h MET 310 CO 0.11 -0.04 0.00 1.28 0.23 0.00 0.00 176.91 178.50 3i4n n LEU 311 N -5.42 0.00 0.00 3.39 4.77 -0.82 -2.82 117.00 116.10 3i4n n LEU 311 Ca 0.06 0.83 0.00 0.00 -0.03 0.00 0.00 56.01 56.87 3i4n n LEU 311 Cb 0.33 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3i4n n LEU 311 CO 0.05 -0.33 0.00 1.21 -1.33 0.00 0.00 177.39 177.00 3i4n n GLU 312 N -1.85 0.00 -0.25 3.23 4.07 0.11 0.15 120.64 126.10 3i4n n GLU 312 Ca 0.00 0.00 0.05 0.00 -0.06 0.00 0.00 57.16 57.15 3i4n n GLU 312 Cb 0.00 0.00 0.15 0.00 -0.06 0.00 0.00 31.44 31.53 3i4n n GLU 312 CO 0.00 0.00 0.00 0.52 -0.06 0.00 0.00 177.13 177.59 3i4n h MET 313 N 0.00 0.09 -0.66 5.31 2.86 -1.45 0.31 114.93 121.40 3i4n h MET 313 Ca 0.00 -0.01 0.19 0.00 -2.06 0.00 0.00 59.70 57.82 3i4n h MET 313 Cb 0.00 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 3i4n h MET 313 CO 0.00 0.06 0.52 -0.07 1.06 0.00 0.00 176.91 178.49 3i4n h LEU 314 N 0.10 0.00 0.00 1.22 3.38 0.15 -3.13 115.31 117.03 3i4n h LEU 314 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3i4n h LEU 314 Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3i4n h LEU 314 CO -0.66 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.16 3i4n n LYS 315 N -4.12 0.00 -0.34 1.13 5.02 0.11 -0.60 118.16 119.36 3i4n n LYS 315 Ca 0.13 0.73 0.18 0.00 -2.02 0.00 0.00 58.31 57.33 3i4n n LYS 315 Cb 0.77 -1.30 0.40 0.00 -0.02 0.00 0.00 35.03 34.89 3i4n n LYS 315 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3i4n h PRO 316 N 0.00 0.55 -0.68 1.97 0.13 -1.73 1.18 132.00 133.42 3i4n h PRO 316 Ca 0.00 -0.03 0.17 0.00 -0.87 0.00 0.00 66.00 65.27 3i4n h PRO 316 Cb 0.00 -0.12 -0.04 0.00 0.13 0.00 0.00 31.00 30.97 3i4n h PRO 316 CO 0.00 0.37 0.47 0.00 -0.23 0.00 0.00 178.00 178.61 3i4n h VAL 318 N 0.18 0.32 -0.52 0.00 2.07 0.39 -3.04 116.25 115.65 3i4n h VAL 318 Ca 0.33 -0.69 0.15 0.00 0.82 0.00 0.00 66.70 67.31 3i4n h VAL 318 Cb 1.05 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 3i4n h VAL 318 CO -0.06 0.07 0.59 -0.33 0.02 0.00 0.00 177.57 177.86 3i4n h GLU 319 N -1.03 0.00 0.14 1.57 5.08 -1.08 0.37 114.58 119.62 3i4n h GLU 319 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3i4n h GLU 319 Cb 0.50 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 3i4n h GLU 319 CO 0.08 0.00 -0.36 0.22 -1.00 0.00 0.00 179.01 177.96 3i4n h ASP 320 N 0.00 -1.05 -0.09 1.42 1.82 -1.13 -1.71 116.42 115.68 3i4n h ASP 320 Ca 0.25 0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.99 3i4n h ASP 320 Cb 1.42 0.38 0.00 0.00 0.68 0.00 0.00 39.33 41.81 3i4n h ASP 320 CO -0.00 -0.39 0.00 0.61 -1.61 0.00 0.00 179.24 177.84 3i4n n GLY 321 N -1.34 0.22 0.33 -0.78 0.00 0.08 -4.22 105.19 99.48 3i4n n GLY 321 Ca -0.06 -0.11 0.08 0.00 0.00 0.00 0.00 46.02 45.93 3i4n n GLY 321 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3i4n h PHE 322 N 0.53 0.95 0.00 1.61 3.57 -0.82 -0.43 116.94 122.36 3i4n h PHE 322 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3i4n h PHE 322 Cb 0.32 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.78 3i4n h PHE 322 CO 0.09 0.29 0.00 0.28 -2.23 0.00 0.00 178.31 176.74 3i4n n VAL 323 N -4.76 0.00 -4.41 1.41 0.31 -1.26 -4.59 118.33 105.03 3i4n n VAL 323 Ca 0.19 0.00 -0.24 0.00 -0.01 0.00 0.00 64.34 64.28 3i4n n VAL 323 Cb 0.42 -0.35 -0.11 0.00 -0.91 0.00 0.00 33.84 32.89 3i4n n VAL 323 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3i4n s ILE 324 N -2.00 2.22 0.00 2.52 1.01 -0.17 -5.07 121.20 119.71 3i4n s ILE 324 Ca 0.07 -2.18 0.00 0.00 0.00 0.00 0.00 60.65 58.54 3i4n s ILE 324 Cb 0.03 -2.13 0.00 0.00 0.01 0.00 0.00 42.46 40.37 3i4n s ILE 324 CO 0.05 -0.32 0.19 1.67 0.00 0.00 0.00 174.94 176.53 3i4n n GLN 325 N -0.14 0.00 -3.47 2.79 -0.06 -1.26 -5.00 117.38 110.23 3i4n n GLN 325 Ca -0.09 -0.04 -0.11 0.00 -2.00 0.00 0.00 57.00 54.76 3i4n n GLN 325 Cb 0.58 -0.03 -0.03 0.00 -4.06 0.00 0.00 30.24 26.71 3i4n n GLN 325 CO 0.00 0.00 0.00 0.16 -0.20 0.00 0.00 177.06 177.02 3i4n s ASP 326 N -0.02 -0.48 0.00 1.69 -4.77 -1.26 -4.96 116.67 106.87 3i4n s ASP 326 Ca 0.00 0.08 0.00 0.00 -3.30 0.00 0.00 52.55 49.33 3i4n s ASP 326 Cb 0.00 0.49 0.00 0.00 -1.09 0.00 0.00 42.92 42.32 3i4n s ASP 326 CO 0.00 -0.76 0.05 -1.14 0.70 0.00 0.00 175.17 174.02 3i4n n ARG 327 N -0.15 0.06 0.00 2.11 0.63 -1.24 -0.90 116.66 117.16 3i4n n ARG 327 Ca -0.13 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.80 3i4n n ARG 327 Cb 0.63 -1.01 0.00 0.00 0.45 0.00 0.00 32.46 32.53 3i4n n ARG 327 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 3i4n n GLU 328 N -0.20 0.00 0.22 -0.14 4.07 -1.26 -4.23 120.64 119.10 3i4n n GLU 328 Ca 0.00 0.00 0.17 0.00 -0.06 0.00 0.00 57.16 57.27 3i4n n GLU 328 Cb 0.00 -0.12 0.76 0.00 -0.06 0.00 0.00 31.44 32.02 3i4n n GLU 328 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 3i4n h THR 329 N 0.00 0.18 0.41 6.31 2.02 -1.89 -1.10 112.91 118.84 3i4n h THR 329 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 3i4n h THR 329 Cb 0.00 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 3i4n h THR 329 CO 0.00 0.00 -0.20 0.00 0.37 0.00 0.00 175.52 175.69 3i4n h ALA 330 N 1.38 -0.99 -0.03 6.16 0.00 -1.26 -1.57 119.26 122.95 3i4n h ALA 330 Ca 0.10 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3i4n h ALA 330 Cb 0.91 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3i4n h ALA 330 CO -0.00 -0.95 -0.19 -0.07 0.00 0.00 0.00 179.25 178.04 3i4n h LEU 331 N -0.63 0.04 -0.07 0.00 4.07 -1.60 -2.64 115.31 114.47 3i4n h LEU 331 Ca -0.06 -0.01 0.03 0.00 0.08 0.00 0.00 57.88 57.93 3i4n h LEU 331 Cb 0.42 -0.01 -0.04 0.00 1.08 0.00 0.00 40.66 42.12 3i4n h LEU 331 CO 0.09 0.24 -0.14 -0.78 -1.08 0.00 0.00 178.44 176.78 3i4n h ASP 332 N 0.04 -0.42 0.00 -0.43 3.58 -1.19 -2.79 116.42 115.22 3i4n h ASP 332 Ca 0.01 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.52 3i4n h ASP 332 Cb 0.37 0.19 -0.00 0.00 1.72 0.00 0.00 39.33 41.60 3i4n h ASP 332 CO 0.03 -0.19 0.03 0.33 -2.88 0.00 0.00 179.24 176.56 3i4n n PHE 333 N -5.28 0.00 -0.59 0.28 7.35 -0.60 0.14 117.46 118.77 3i4n n PHE 333 Ca -0.04 -0.33 0.00 0.00 -0.76 0.00 0.00 57.45 56.32 3i4n n PHE 333 Cb 0.20 -0.38 0.00 0.00 0.35 0.00 0.00 39.48 39.65 3i4n n PHE 333 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 3i4n n ILE 334 N 1.96 0.00 -0.57 -2.13 5.41 -1.05 -4.83 119.36 118.16 3i4n n ILE 334 Ca 0.02 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.63 3i4n n ILE 334 Cb 0.17 0.66 0.05 0.00 -0.71 0.00 0.00 39.64 39.81 3i4n n ILE 334 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3i4n n GLY 335 N 0.00 3.70 0.00 7.39 0.00 0.37 -2.86 105.19 113.79 3i4n n GLY 335 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.17 3i4n n GLY 335 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i4n n ARG 336 N 0.19 1.30 -2.02 1.61 1.74 -1.26 -4.74 116.66 113.47 3i4n n ARG 336 Ca 0.28 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.98 3i4n n ARG 336 Cb 0.73 -0.19 -0.01 0.00 -1.02 0.00 0.00 32.46 31.97 3i4n n ARG 336 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3i4n n ARG 337 N -0.22 4.32 0.00 5.56 5.12 -1.14 -4.29 116.66 126.02 3i4n n ARG 337 Ca 0.00 -3.50 0.00 0.00 -1.93 0.00 0.00 57.85 52.42 3i4n n ARG 337 Cb 0.00 -2.51 0.00 0.00 -1.16 0.00 0.00 32.46 28.79 3i4n n ARG 337 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3i4n n GLY 338 N 1.18 2.07 3.86 -0.13 0.00 -1.26 -1.13 105.19 109.78 3i4n n GLY 338 Ca 0.57 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 46.09 3i4n n GLY 338 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3i4n s THR 339 N 0.00 4.66 0.21 2.61 -1.32 -1.26 -4.86 115.64 115.68 3i4n s THR 339 Ca 0.00 0.95 -0.31 0.00 -1.21 0.00 0.00 61.69 61.11 3i4n s THR 339 Cb 0.00 -3.80 -0.15 0.00 -1.51 0.00 0.00 72.50 67.04 3i4n s THR 339 CO 0.00 -0.90 1.15 0.00 -2.21 0.00 0.00 174.62 172.66 3i4n n ALA 340 N -2.15 -0.42 0.00 11.08 0.00 -1.26 -4.74 120.51 123.02 3i4n n ALA 340 Ca 0.06 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.93 3i4n n ALA 340 Cb 0.54 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.94 3i4n n ALA 340 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3i4n n LEU 341 N 1.84 0.00 0.00 0.00 7.94 -1.26 -1.42 117.00 124.10 3i4n n LEU 341 Ca 0.13 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.03 3i4n n LEU 341 Cb 0.27 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.22 3i4n n LEU 341 CO 0.61 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.50 3i4n n GLY 342 N -0.44 0.49 2.56 -3.96 0.00 -1.26 -5.08 105.19 97.50 3i4n n GLY 342 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.55 3i4n n GLY 342 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3i4n n ILE 343 N 0.00 0.00 -0.95 -0.61 2.08 -0.51 -4.52 119.36 114.85 3i4n n ILE 343 Ca 0.00 0.00 -0.07 0.00 0.56 0.00 0.00 62.75 63.24 3i4n n ILE 343 Cb 0.00 -0.39 -0.02 0.00 -0.75 0.00 0.00 39.64 38.48 3i4n n ILE 343 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 3i4n n LYS 344 N 5.92 0.00 0.00 0.38 5.02 -1.26 -4.79 118.16 123.43 3i4n n LYS 344 Ca 0.43 -0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.52 3i4n n LYS 344 Cb -0.03 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.66 3i4n n LYS 344 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3i4n n LYS 345 N 4.47 0.00 0.00 1.97 5.02 -1.26 -3.82 118.16 124.54 3i4n n LYS 345 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 3i4n n LYS 345 Cb 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.33 3i4n n LYS 345 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3i4n n GLU 346 N 0.52 0.00 -0.00 1.97 2.13 -1.26 -1.37 120.64 122.63 3i4n n GLU 346 Ca 0.00 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.85 3i4n n GLU 346 Cb 0.00 0.00 0.39 0.00 0.27 0.00 0.00 31.44 32.10 3i4n n GLU 346 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 3i4n h LYS 347 N 0.00 0.53 -0.29 5.31 2.10 -1.92 -1.93 116.57 120.38 3i4n h LYS 347 Ca 0.00 -0.05 0.08 0.00 -2.00 0.00 0.00 60.65 58.68 3i4n h LYS 347 Cb 0.00 -0.11 -0.01 0.00 -0.90 0.00 0.00 32.23 31.21 3i4n h LYS 347 CO 0.00 0.42 0.23 0.07 -2.00 0.00 0.00 179.45 178.17 3i4n h ARG 348 N 0.54 0.00 -0.00 0.07 0.11 -1.50 0.39 114.38 113.98 3i4n h ARG 348 Ca 0.14 0.00 -0.21 0.00 0.10 0.00 0.00 59.98 60.00 3i4n h ARG 348 Cb 0.05 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.13 3i4n h ARG 348 CO -0.02 0.00 -0.90 0.82 0.10 0.00 0.00 179.97 179.97 3i4n h ILE 349 N 0.00 1.43 0.00 0.08 2.04 -1.61 -2.58 117.51 116.87 3i4n h ILE 349 Ca 0.14 -2.48 -0.05 0.00 1.00 0.00 0.00 64.86 63.47 3i4n h ILE 349 Cb 0.60 2.41 -0.01 0.00 -0.74 0.00 0.00 36.82 39.08 3i4n h ILE 349 CO -0.00 0.73 -0.23 -0.61 0.00 0.00 0.00 178.15 178.04 3i4n h GLN 350 N 0.20 0.00 0.13 2.37 5.75 -0.29 -2.83 115.11 120.44 3i4n h GLN 350 Ca -0.06 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.43 3i4n h GLN 350 Cb 1.53 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.08 3i4n h GLN 350 CO 0.15 0.23 -0.06 -0.92 -2.65 0.00 0.00 178.83 175.58 3i4n h TYR 351 N 0.00 -0.16 -0.51 3.99 3.20 -0.49 -2.84 116.97 120.15 3i4n h TYR 351 Ca -0.00 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.94 3i4n h TYR 351 Cb 0.74 0.05 -0.06 0.00 1.54 0.00 0.00 36.73 39.00 3i4n h TYR 351 CO 0.00 0.27 0.16 0.00 -1.64 0.00 0.00 178.16 176.95 3i4n h ALA 352 N 0.08 0.62 -0.11 1.82 0.00 -1.42 -1.93 119.26 118.32 3i4n h ALA 352 Ca -0.02 0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.99 3i4n h ALA 352 Cb 0.50 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3i4n h ALA 352 CO 0.03 -0.25 -0.23 0.87 0.00 0.00 0.00 179.25 179.67 3i4n h LYS 353 N 0.32 -0.20 -0.50 0.00 1.57 -1.50 0.86 116.57 117.12 3i4n h LYS 353 Ca 0.25 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 59.14 3i4n h LYS 353 Cb 0.30 0.04 -0.10 0.00 0.08 0.00 0.00 32.23 32.56 3i4n h LYS 353 CO -0.28 -0.13 -0.35 -0.44 -0.57 0.00 0.00 179.45 177.67 3i4n h ASP 354 N -0.21 -1.19 -0.01 0.86 3.32 -1.25 -1.72 116.42 116.23 3i4n h ASP 354 Ca 0.02 0.21 0.02 0.00 0.02 0.00 0.00 57.03 57.30 3i4n h ASP 354 Cb 0.27 0.56 -0.04 0.00 0.22 0.00 0.00 39.33 40.34 3i4n h ASP 354 CO -0.21 -0.32 -0.43 0.40 -1.72 0.00 0.00 179.24 176.96 3i4n h ILE 355 N -0.22 0.00 -0.48 0.35 2.04 -0.86 0.03 117.51 118.38 3i4n h ILE 355 Ca 0.20 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.20 3i4n h ILE 355 Cb 0.55 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 3i4n h ILE 355 CO -0.62 0.00 0.67 -0.07 0.00 0.00 0.00 178.15 178.13 3i4n h LEU 356 N -0.53 0.00 0.08 1.44 3.38 -0.21 0.42 115.31 119.89 3i4n h LEU 356 Ca 0.01 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 3i4n h LEU 356 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3i4n h LEU 356 CO -0.29 0.00 -0.81 -0.61 0.09 0.00 0.00 178.44 176.81 3i4n h GLN 357 N 0.00 0.16 0.01 1.13 4.15 -0.15 -3.35 115.11 117.07 3i4n h GLN 357 Ca 0.23 -0.28 -0.40 0.00 0.77 0.00 0.00 58.65 58.97 3i4n h GLN 357 Cb 1.57 0.10 -0.06 0.00 0.21 0.00 0.00 27.48 29.30 3i4n h GLN 357 CO -0.00 1.13 -2.28 1.63 -1.93 0.00 0.00 178.83 177.38 3i4n n LYS 358 N -4.24 0.62 0.15 1.69 5.02 -0.50 -4.07 118.16 116.83 3i4n n LYS 358 Ca -0.18 0.28 0.11 0.00 -2.02 0.00 0.00 58.31 56.50 3i4n n LYS 358 Cb 0.73 -1.56 0.06 0.00 -0.02 0.00 0.00 35.03 34.24 3i4n n LYS 358 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3i4n h GLU 359 N -0.63 0.00 -6.18 1.97 4.39 -0.43 -3.37 114.58 110.34 3i4n h GLU 359 Ca -0.59 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 58.53 3i4n h GLU 359 Cb 1.69 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 30.28 3i4n h GLU 359 CO -0.25 0.02 0.83 0.12 -1.16 0.00 0.00 179.01 178.57 3i4n s PHE 360 N -3.28 3.23 -1.53 4.33 5.36 -1.07 -3.73 117.98 121.30 3i4n s PHE 360 Ca 0.02 1.33 -0.04 0.00 -0.96 0.00 0.00 56.93 57.28 3i4n s PHE 360 Cb 0.08 -3.46 0.04 0.00 -0.34 0.00 0.00 43.02 39.34 3i4n s PHE 360 CO 0.75 -0.66 0.11 -0.11 -1.46 0.00 0.00 175.22 173.84 3i4n n LEU 361 N 6.58 -0.88 -0.59 6.12 7.94 -1.26 -4.68 117.00 130.22 3i4n n LEU 361 Ca 0.12 -1.20 0.45 0.00 -1.11 0.00 0.00 56.01 54.27 3i4n n LEU 361 Cb 0.46 -1.51 0.69 0.00 0.53 0.00 0.00 43.42 43.60 3i4n n LEU 361 CO 0.55 0.38 1.28 -0.81 -1.11 0.00 0.00 177.39 177.67 3i4n n PRO 362 N -4.29 0.00 -1.09 1.96 -0.04 -1.24 -4.37 135.00 125.93 3i4n n PRO 362 Ca -0.23 0.93 -0.18 0.00 -0.04 0.00 0.00 63.50 63.98 3i4n n PRO 362 Cb 0.62 -2.17 0.13 0.00 -0.04 0.00 0.00 33.50 32.04 3i4n n PRO 362 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 3i4n n HIS 363 N -3.61 -3.93 0.00 0.54 1.44 -1.26 -3.49 115.22 104.90 3i4n n HIS 363 Ca 0.37 -0.71 0.00 0.00 -2.01 0.00 0.00 57.72 55.38 3i4n n HIS 363 Cb 1.72 -0.64 0.00 0.00 0.12 0.00 0.00 29.99 31.19 3i4n n HIS 363 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 3i4n n ILE 364 N -3.26 0.00 0.00 0.61 5.41 -1.26 -4.68 119.36 116.18 3i4n n ILE 364 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.85 3i4n n ILE 364 Cb 0.36 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.29 3i4n n ILE 364 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 176.55 177.62 3i4n n THR 365 N -0.23 0.00 0.09 1.39 5.66 -1.23 -4.96 114.28 115.00 3i4n n THR 365 Ca 0.00 0.00 0.09 0.00 -3.05 0.00 0.00 64.05 61.09 3i4n n THR 365 Cb 0.00 0.00 0.18 0.00 -1.55 0.00 0.00 70.33 68.96 3i4n n THR 365 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3i4n n GLN 366 N -0.76 2.32 0.00 1.09 6.02 -1.25 -4.80 117.38 120.00 3i4n n GLN 366 Ca 0.00 -2.09 0.00 0.00 -0.01 0.00 0.00 57.00 54.90 3i4n n GLN 366 Cb 0.00 -1.40 0.00 0.00 1.02 0.00 0.00 30.24 29.86 3i4n n GLN 366 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3i4n n LEU 367 N 1.09 0.00 0.10 1.08 4.77 -1.26 -4.24 117.00 118.53 3i4n n LEU 367 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3i4n n LEU 367 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3i4n n LEU 367 CO 0.12 0.00 0.00 1.21 -1.33 0.00 0.00 177.39 177.39 3i4n n GLU 368 N 0.00 0.00 -0.20 3.23 2.13 -1.26 -4.88 120.64 119.65 3i4n n GLU 368 Ca 0.00 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.81 3i4n n GLU 368 Cb 0.00 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.69 3i4n n GLU 368 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3i4n n GLY 369 N -1.20 1.29 1.60 8.31 0.00 -1.26 -3.66 105.19 110.27 3i4n n GLY 369 Ca 0.00 -0.15 0.02 0.00 0.00 0.00 0.00 46.02 45.90 3i4n n GLY 369 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i4n n PHE 370 N 2.29 0.33 -0.34 1.61 3.01 -1.26 -4.84 117.46 118.26 3i4n n PHE 370 Ca 0.05 -1.01 0.25 0.00 1.01 0.00 0.00 57.45 57.75 3i4n n PHE 370 Cb 0.19 -0.19 0.53 0.00 -0.01 0.00 0.00 39.48 40.01 3i4n n PHE 370 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 3i4n h GLU 371 N 1.32 0.34 -0.07 -1.08 3.07 -1.86 -1.10 114.58 115.19 3i4n h GLU 371 Ca -0.15 -0.02 -0.08 0.00 -0.50 0.00 0.00 59.36 58.61 3i4n h GLU 371 Cb 1.63 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 29.47 3i4n h GLU 371 CO 0.13 0.22 -0.26 0.66 -1.40 0.00 0.00 179.01 178.35 3i4n h SER 372 N 0.35 0.36 -0.45 1.42 4.64 -1.88 -2.01 113.55 115.98 3i4n h SER 372 Ca 0.62 -0.62 0.06 0.00 -0.47 0.00 0.00 61.79 61.38 3i4n h SER 372 Cb 1.65 -0.11 -0.05 0.00 -0.31 0.00 0.00 62.40 63.58 3i4n h SER 372 CO -0.31 0.92 0.15 -0.09 -0.87 0.00 0.00 176.83 176.63 3i4n h ARG 373 N -0.18 0.30 0.04 4.77 2.43 -1.54 -0.16 114.38 120.04 3i4n h ARG 373 Ca -0.01 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3i4n h ARG 373 Cb 0.90 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 3i4n h ARG 373 CO 0.06 0.20 -0.02 0.87 -1.51 0.00 0.00 179.97 179.57 3i4n h LYS 374 N 0.31 -0.05 -0.72 0.20 1.57 -1.57 -3.08 116.57 113.23 3i4n h LYS 374 Ca 0.21 0.00 0.17 0.00 -1.87 0.00 0.00 60.65 59.17 3i4n h LYS 374 Cb 0.22 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 3i4n h LYS 374 CO -0.22 0.37 0.50 0.00 -0.57 0.00 0.00 179.45 179.52 3i4n h ALA 375 N 0.46 2.35 0.00 3.86 0.00 -1.08 0.15 119.26 124.99 3i4n h ALA 375 Ca -0.01 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 3i4n h ALA 375 Cb 0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3i4n h ALA 375 CO 0.01 -0.55 -0.47 0.74 0.00 0.00 0.00 179.25 178.97 3i4n h PHE 376 N 0.23 0.00 0.17 0.00 -1.00 -0.98 -2.35 116.94 113.00 3i4n h PHE 376 Ca 0.35 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.13 3i4n h PHE 376 Cb 1.06 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.62 3i4n h PHE 376 CO -0.00 0.47 -0.08 0.35 -1.61 0.00 0.00 178.31 177.44 3i4n h PHE 377 N 0.00 -0.21 -0.93 -0.55 3.57 -0.69 0.11 116.94 118.23 3i4n h PHE 377 Ca -0.00 -0.01 0.27 0.00 3.53 0.00 0.00 57.97 61.76 3i4n h PHE 377 Cb 1.09 0.07 -0.15 0.00 2.79 0.00 0.00 35.95 39.76 3i4n h PHE 377 CO 0.00 0.18 0.36 1.25 -2.23 0.00 0.00 178.31 177.86 3i4n h LEU 378 N -0.93 0.19 0.01 0.59 5.85 -1.16 1.99 115.31 121.85 3i4n h LEU 378 Ca -0.02 0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 3i4n h LEU 378 Cb 0.48 0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.74 3i4n h LEU 378 CO 0.04 -0.15 -0.01 1.23 -0.34 0.00 0.00 178.44 179.21 3i4n h GLY 379 N 0.25 -0.02 0.36 3.75 0.00 -1.40 -0.83 103.07 105.18 3i4n h GLY 379 Ca 0.62 0.01 0.24 0.00 0.00 0.00 0.00 47.33 48.19 3i4n h GLY 379 CO -0.64 -0.01 0.59 -1.82 0.00 0.00 0.00 176.54 174.66 3i4n h TYR 380 N -0.30 0.04 0.20 5.60 3.20 0.55 0.16 116.97 126.43 3i4n h TYR 380 Ca -0.00 0.00 -0.29 0.00 3.14 0.00 0.00 58.73 61.58 3i4n h TYR 380 Cb 0.29 -0.01 0.03 0.00 1.54 0.00 0.00 36.73 38.57 3i4n h TYR 380 CO 0.02 0.01 -1.32 0.52 -1.64 0.00 0.00 178.16 175.75 3i4n h MET 381 N 0.03 0.43 0.00 1.82 2.86 0.49 -3.05 114.93 117.51 3i4n h MET 381 Ca 0.40 -0.74 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 3i4n h MET 381 Cb 1.54 0.27 0.00 0.00 0.06 0.00 0.00 31.60 33.47 3i4n h MET 381 CO -0.02 1.35 0.00 -0.89 1.06 0.00 0.00 176.91 178.42 3i4n n ILE 382 N -3.84 1.64 0.00 -1.22 5.41 0.39 -1.73 119.36 120.00 3i4n n ILE 382 Ca -0.18 0.41 0.00 0.00 1.00 0.00 0.00 62.75 63.98 3i4n n ILE 382 Cb 1.00 -1.32 0.00 0.00 -0.71 0.00 0.00 39.64 38.61 3i4n n ILE 382 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 3i4n n ASN 383 N -1.50 0.00 -0.47 4.38 5.15 -0.17 -3.67 115.26 118.98 3i4n n ASN 383 Ca 0.01 0.28 0.39 0.00 -0.60 0.00 0.00 54.58 54.66 3i4n n ASN 383 Cb 0.06 -0.32 0.65 0.00 -0.53 0.00 0.00 39.78 39.63 3i4n n ASN 383 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3i4n n ARG 384 N -1.57 -0.03 0.34 1.20 5.12 -1.05 0.70 116.66 121.38 3i4n n ARG 384 Ca 0.00 1.12 -0.17 0.00 -1.93 0.00 0.00 57.85 56.87 3i4n n ARG 384 Cb 0.00 -2.27 -0.09 0.00 -1.16 0.00 0.00 32.46 28.94 3i4n n ARG 384 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 3i4n h LEU 385 N 0.00 -0.72 -0.70 0.55 5.85 -1.49 -3.02 115.31 115.78 3i4n h LEU 385 Ca 0.82 0.03 -0.14 0.00 0.84 0.00 0.00 57.88 59.42 3i4n h LEU 385 Cb 2.76 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 43.97 3i4n h LEU 385 CO -0.35 -0.51 -0.59 -0.07 -0.34 0.00 0.00 178.44 176.58 3i4n h LEU 386 N -0.84 0.22 -1.60 2.25 3.38 0.20 -2.03 115.31 116.90 3i4n h LEU 386 Ca -0.08 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.79 3i4n h LEU 386 Cb 0.65 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 3i4n h LEU 386 CO 0.14 0.76 0.51 -0.07 0.09 0.00 0.00 178.44 179.86 3i4n h LEU 387 N 0.15 0.00 0.00 1.67 4.07 -0.76 -1.29 115.31 119.16 3i4n h LEU 387 Ca -0.00 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.68 3i4n h LEU 387 Cb 1.08 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.78 3i4n h LEU 387 CO 0.09 0.00 -1.95 0.00 -1.08 0.00 0.00 178.44 175.50 3i4n h ALA 389 N -0.42 2.31 -3.60 0.00 0.00 -0.63 -1.94 119.26 114.97 3i4n h ALA 389 Ca -0.41 -0.02 -0.67 0.00 0.00 0.00 0.00 54.91 53.81 3i4n h ALA 389 Cb 1.44 0.04 -0.37 0.00 0.00 0.00 0.00 17.79 18.90 3i4n h ALA 389 CO -0.20 -1.13 -0.70 -0.51 0.00 0.00 0.00 179.25 176.71 3i4n s LEU 390 N -6.18 4.40 -0.81 0.00 1.43 -0.55 -5.02 118.68 111.95 3i4n s LEU 390 Ca -0.02 -1.81 -0.07 0.00 -1.03 0.00 0.00 54.13 51.19 3i4n s LEU 390 Cb 0.10 -1.66 -0.27 0.00 0.03 0.00 0.00 46.19 44.38 3i4n s LEU 390 CO 0.34 -0.35 1.90 0.47 0.23 0.00 0.00 176.35 178.94 3i4n n ASP 391 N 4.42 -1.52 0.00 2.29 9.92 -0.73 -4.27 116.55 126.66 3i4n n ASP 391 Ca -0.04 -0.68 0.00 0.00 -0.53 0.00 0.00 54.79 53.54 3i4n n ASP 391 Cb 0.42 -0.53 0.00 0.00 -0.64 0.00 0.00 41.12 40.37 3i4n n ASP 391 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3i4n n ARG 392 N 5.18 0.00 -3.83 -1.24 1.74 -1.08 -5.04 116.66 112.39 3i4n n ARG 392 Ca 0.55 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 57.37 3i4n n ARG 392 Cb 0.20 -0.58 -0.17 0.00 -1.02 0.00 0.00 32.46 30.88 3i4n n ARG 392 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3i4n s LYS 393 N -1.17 1.08 0.99 5.56 -0.14 -0.51 -5.00 119.74 120.54 3i4n s LYS 393 Ca 0.00 -0.23 -0.15 0.00 -1.36 0.00 0.00 55.97 54.23 3i4n s LYS 393 Cb 0.00 -1.57 -0.02 0.00 -1.68 0.00 0.00 37.83 34.56 3i4n s LYS 393 CO 0.00 -0.37 -0.10 -0.25 -0.76 0.00 0.00 175.35 173.87 3i4n n ASP 394 N 5.01 -3.36 -4.73 2.83 8.00 -1.26 -4.24 116.55 118.80 3i4n n ASP 394 Ca -0.10 0.22 -0.42 0.00 0.71 0.00 0.00 54.79 55.20 3i4n n ASP 394 Cb 0.49 -1.01 -0.03 0.00 -0.02 0.00 0.00 41.12 40.55 3i4n n ASP 394 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 3i4n s GLN 395 N -3.04 4.29 0.22 -1.24 0.74 -1.26 -4.90 119.66 114.46 3i4n s GLN 395 Ca 0.51 2.20 -0.31 0.00 0.05 0.00 0.00 55.36 57.80 3i4n s GLN 395 Cb -0.18 -3.18 -0.15 0.00 1.10 0.00 0.00 33.01 30.61 3i4n s GLN 395 CO 0.72 -0.44 1.18 -0.25 -0.55 0.00 0.00 175.29 175.95 3i4n n ASP 396 N 3.27 1.64 -4.64 6.67 8.00 -0.66 -4.90 116.55 125.94 3i4n n ASP 396 Ca 0.10 1.15 -0.43 0.00 0.71 0.00 0.00 54.79 56.32 3i4n n ASP 396 Cb 0.41 -1.28 -0.03 0.00 -0.02 0.00 0.00 41.12 40.20 3i4n n ASP 396 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3i4n s ASP 397 N -0.07 6.94 0.00 -2.24 -1.08 -1.26 -4.91 116.67 114.04 3i4n s ASP 397 Ca 0.69 1.12 0.16 0.00 -0.52 0.00 0.00 52.55 53.99 3i4n s ASP 397 Cb -0.77 -2.50 0.81 0.00 -1.46 0.00 0.00 42.92 39.00 3i4n s ASP 397 CO 0.54 -0.69 1.44 0.54 0.52 0.00 0.00 175.17 177.52 3i4n n ARG 398 N 6.39 0.25 -0.70 4.34 1.74 -1.26 -3.38 116.66 124.03 3i4n n ARG 398 Ca 0.09 0.13 0.03 0.00 -0.77 0.00 0.00 57.85 57.33 3i4n n ARG 398 Cb 0.47 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 30.61 3i4n n ARG 398 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3i4n n ASP 399 N -1.26 1.99 -4.61 0.55 8.00 -1.26 -4.97 116.55 114.98 3i4n n ASP 399 Ca 0.08 -3.88 -0.43 0.00 0.71 0.00 0.00 54.79 51.27 3i4n n ASP 399 Cb 0.12 -0.55 -0.02 0.00 -0.02 0.00 0.00 41.12 40.65 3i4n n ASP 399 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 3i4n s HIS 400 N -3.26 2.67 0.60 1.24 2.46 -1.22 -4.82 115.29 112.97 3i4n s HIS 400 Ca 0.40 0.78 0.29 0.00 0.47 0.00 0.00 55.06 57.00 3i4n s HIS 400 Cb 0.38 -4.21 1.58 0.00 -0.13 0.00 0.00 32.58 30.20 3i4n s HIS 400 CO -0.05 -1.57 1.98 0.35 -2.47 0.00 0.00 174.74 172.98 3i4n h PHE 401 N 9.65 0.00 0.00 3.88 3.57 -1.94 0.82 116.94 132.92 3i4n h PHE 401 Ca -0.25 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.25 3i4n h PHE 401 Cb 1.08 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.82 3i4n h PHE 401 CO 0.94 0.00 0.00 0.41 -2.23 0.00 0.00 178.31 177.43 3i4n n GLY 402 N -1.42 -1.06 0.81 2.40 0.00 -1.26 -2.02 105.19 102.64 3i4n n GLY 402 Ca 0.04 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.08 3i4n n GLY 402 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3i4n n LYS 403 N -1.51 2.97 -5.05 1.61 5.02 0.28 -4.61 118.16 116.87 3i4n n LYS 403 Ca 0.04 -2.45 -0.32 0.00 -2.02 0.00 0.00 58.31 53.56 3i4n n LYS 403 Cb 0.19 -1.56 -0.15 0.00 -0.02 0.00 0.00 35.03 33.49 3i4n n LYS 403 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3i4n s LYS 404 N -1.84 2.83 -0.09 1.97 -0.14 -0.86 -0.17 119.74 121.43 3i4n s LYS 404 Ca 0.33 -0.80 0.04 0.00 -1.36 0.00 0.00 55.97 54.18 3i4n s LYS 404 Cb 0.23 -2.35 -0.01 0.00 -1.68 0.00 0.00 37.83 34.02 3i4n s LYS 404 CO 0.13 0.36 -0.21 1.03 -0.76 0.00 0.00 175.35 175.90 3i4n s ARG 405 N -0.08 2.98 -0.42 1.68 1.81 0.36 -4.75 118.95 120.53 3i4n s ARG 405 Ca -0.04 -0.84 -0.14 0.00 -1.72 0.00 0.00 55.73 53.00 3i4n s ARG 405 Cb -0.14 -2.34 0.04 0.00 -0.45 0.00 0.00 34.95 32.06 3i4n s ARG 405 CO 0.04 0.26 0.30 -0.51 -0.68 0.00 0.00 175.30 174.71 3i4n s LEU 406 N 0.17 5.16 0.01 2.53 1.43 -0.73 -2.22 118.68 125.03 3i4n s LEU 406 Ca -0.12 -1.10 -0.30 0.00 -1.03 0.00 0.00 54.13 51.58 3i4n s LEU 406 Cb -0.16 -2.11 -0.05 0.00 0.03 0.00 0.00 46.19 43.90 3i4n s LEU 406 CO 0.07 -0.50 1.23 -1.81 0.23 0.00 0.00 176.35 175.58 3i4n s ASP 407 N 1.93 7.03 0.00 2.29 1.01 0.61 -4.64 116.67 124.90 3i4n s ASP 407 Ca 0.04 1.96 0.00 0.00 0.71 0.00 0.00 52.55 55.26 3i4n s ASP 407 Cb -0.21 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.15 3i4n s ASP 407 CO 0.07 -0.56 0.00 -0.11 0.21 0.00 0.00 175.17 174.79 3i4n n LEU 408 N 4.63 0.00 0.00 1.23 7.94 -1.26 -1.18 117.00 128.35 3i4n n LEU 408 Ca 0.10 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.00 3i4n n LEU 408 Cb 0.46 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.41 3i4n n LEU 408 CO 0.56 -0.45 0.31 0.00 -1.11 0.00 0.00 177.39 176.69 3i4n n ALA 409 N -3.00 0.00 -0.16 1.96 0.00 -1.26 -2.16 120.51 115.89 3i4n n ALA 409 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 3i4n n ALA 409 Cb 0.00 0.31 -0.07 0.00 0.00 0.00 0.00 19.45 19.68 3i4n n ALA 409 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3i4n h GLY 410 N 0.00 -0.80 -0.92 0.00 0.00 -1.80 -1.76 103.07 97.79 3i4n h GLY 410 Ca 0.00 0.66 0.24 0.00 0.00 0.00 0.00 47.33 48.23 3i4n h GLY 410 CO 0.00 -0.13 -0.05 -2.55 0.00 0.00 0.00 176.54 173.81 3i4n h PRO 411 N -0.33 0.01 0.28 4.80 0.11 -1.70 0.21 132.00 135.39 3i4n h PRO 411 Ca 0.11 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.21 3i4n h PRO 411 Cb 0.58 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.69 3i4n h PRO 411 CO -0.63 0.01 -0.13 -0.07 -0.21 0.00 0.00 178.00 176.97 3i4n h LEU 412 N 0.01 -0.32 -1.54 2.35 3.38 -0.82 -2.32 115.31 116.05 3i4n h LEU 412 Ca 0.55 -0.03 0.25 0.00 0.09 0.00 0.00 57.88 58.74 3i4n h LEU 412 Cb 1.06 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.82 3i4n h LEU 412 CO -0.93 -0.18 0.66 -0.07 0.09 0.00 0.00 178.44 178.02 3i4n h LEU 413 N -0.44 0.34 0.32 1.67 3.38 -0.11 0.79 115.31 121.26 3i4n h LEU 413 Ca -0.04 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 3i4n h LEU 413 Cb 0.33 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3i4n h LEU 413 CO 0.06 0.09 -0.32 0.00 0.09 0.00 0.00 178.44 178.36 3i4n h ALA 414 N 1.59 -0.68 -1.12 1.53 0.00 -0.44 -0.35 119.26 119.78 3i4n h ALA 414 Ca 0.53 -0.11 0.31 0.00 0.00 0.00 0.00 54.91 55.65 3i4n h ALA 414 Cb 1.50 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 19.67 3i4n h ALA 414 CO -0.20 -0.92 0.75 0.37 0.00 0.00 0.00 179.25 179.25 3i4n h GLN 415 N -0.67 0.23 0.16 0.00 4.15 -0.76 -0.73 115.11 117.50 3i4n h GLN 415 Ca -0.02 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 3i4n h GLN 415 Cb 0.61 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.25 3i4n h GLN 415 CO -0.06 0.15 -0.08 -0.07 -1.93 0.00 0.00 178.83 176.84 3i4n h LEU 416 N 0.24 -0.18 -1.13 -2.39 3.38 -1.14 -2.42 115.31 111.67 3i4n h LEU 416 Ca 0.61 0.01 0.27 0.00 0.09 0.00 0.00 57.88 58.86 3i4n h LEU 416 Cb 1.86 0.05 -0.12 0.00 0.09 0.00 0.00 40.66 42.54 3i4n h LEU 416 CO -0.23 0.22 0.63 0.15 0.09 0.00 0.00 178.44 179.30 3i4n h PHE 417 N -0.91 0.88 0.37 1.13 3.57 -0.60 0.87 116.94 122.25 3i4n h PHE 417 Ca -0.02 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 3i4n h PHE 417 Cb 0.16 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.66 3i4n h PHE 417 CO 0.01 0.03 -0.18 -0.22 -2.23 0.00 0.00 178.31 175.71 3i4n h LYS 418 N 0.48 -0.48 -0.55 1.11 3.64 -1.25 0.94 116.57 120.45 3i4n h LYS 418 Ca 0.65 0.03 0.12 0.00 -1.27 0.00 0.00 60.65 60.18 3i4n h LYS 418 Cb 1.42 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 33.32 3i4n h LYS 418 CO -0.43 -0.32 0.38 1.15 -2.27 0.00 0.00 179.45 177.95 3i4n h THR 419 N -0.83 0.82 0.00 1.00 2.02 -0.89 -1.95 112.91 113.09 3i4n h THR 419 Ca -0.05 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.06 3i4n h THR 419 Cb 0.39 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 3i4n h THR 419 CO 0.08 0.04 0.00 0.18 0.37 0.00 0.00 175.52 176.19 3i4n n LEU 420 N -4.44 1.10 -0.24 2.58 4.77 0.30 -3.10 117.00 117.97 3i4n n LEU 420 Ca 0.09 0.39 0.22 0.00 -0.03 0.00 0.00 56.01 56.69 3i4n n LEU 420 Cb 0.47 -0.23 0.41 0.00 -2.33 0.00 0.00 43.42 41.75 3i4n n LEU 420 CO 0.35 -0.23 0.77 0.33 -1.33 0.00 0.00 177.39 177.28 3i4n n PHE 421 N -1.18 0.82 0.06 -1.77 7.35 0.33 0.20 117.46 123.27 3i4n n PHE 421 Ca 0.00 0.89 -0.03 0.00 -0.76 0.00 0.00 57.45 57.55 3i4n n PHE 421 Cb 0.00 -1.28 0.22 0.00 0.35 0.00 0.00 39.48 38.77 3i4n n PHE 421 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 3i4n h LYS 422 N 0.00 0.35 0.00 -4.13 1.57 -1.49 0.85 116.57 113.72 3i4n h LYS 422 Ca 0.61 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 59.24 3i4n h LYS 422 Cb 1.59 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.88 3i4n h LYS 422 CO -0.60 0.65 -0.05 -0.22 -0.57 0.00 0.00 179.45 178.67 3i4n h LYS 423 N 0.30 0.00 0.01 3.15 3.64 0.23 -2.78 116.57 121.12 3i4n h LYS 423 Ca 0.04 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.08 3i4n h LYS 423 Cb 0.75 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.51 3i4n h LYS 423 CO 0.06 0.05 -2.07 -0.11 -2.27 0.00 0.00 179.45 175.10 3i4n n LEU 424 N -3.20 0.87 0.04 5.20 7.94 -0.80 -3.73 117.00 123.33 3i4n n LEU 424 Ca -0.00 0.19 0.04 0.00 -1.11 0.00 0.00 56.01 55.12 3i4n n LEU 424 Cb 0.28 0.09 0.43 0.00 0.53 0.00 0.00 43.42 44.74 3i4n n LEU 424 CO 0.27 0.52 1.10 0.74 -1.11 0.00 0.00 177.39 178.91 3i4n h THR 425 N 0.01 1.11 -0.01 1.96 2.02 -0.59 -0.82 112.91 116.59 3i4n h THR 425 Ca -0.43 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.45 3i4n h THR 425 Cb 2.10 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 3i4n h THR 425 CO 0.05 0.13 -0.20 2.29 0.37 0.00 0.00 175.52 178.15 3i4n n LYS 426 N -4.44 1.19 0.06 6.66 2.85 -1.11 -3.96 118.16 119.40 3i4n n LYS 426 Ca 0.02 -0.76 -0.11 0.00 -1.05 0.00 0.00 58.31 56.41 3i4n n LYS 426 Cb 0.11 -1.48 -0.13 0.00 -0.65 0.00 0.00 35.03 32.87 3i4n n LYS 426 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 3i4n h ASP 427 N 1.86 0.17 0.40 -5.58 3.32 -1.23 -3.30 116.42 112.06 3i4n h ASP 427 Ca 0.00 -0.21 -0.11 0.00 0.02 0.00 0.00 57.03 56.73 3i4n h ASP 427 Cb 0.56 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 3i4n h ASP 427 CO 0.00 1.17 -0.48 0.40 -1.72 0.00 0.00 179.24 178.61 3i4n h ILE 428 N 0.03 1.35 -0.84 0.35 2.04 -1.65 -3.15 117.51 115.64 3i4n h ILE 428 Ca -0.12 -1.68 0.21 0.00 1.00 0.00 0.00 64.86 64.26 3i4n h ILE 428 Cb 1.90 1.86 -0.13 0.00 -0.74 0.00 0.00 36.82 39.71 3i4n h ILE 428 CO 0.14 0.49 0.26 -0.26 0.00 0.00 0.00 178.15 178.79 3i4n h PHE 429 N 0.08 0.42 0.00 1.37 -1.00 -1.74 1.09 116.94 117.15 3i4n h PHE 429 Ca 0.00 0.05 0.00 0.00 2.81 0.00 0.00 57.97 60.83 3i4n h PHE 429 Cb 0.89 -0.05 0.00 0.00 3.61 0.00 0.00 35.95 40.40 3i4n h PHE 429 CO 0.01 -0.12 0.00 0.00 -1.61 0.00 0.00 178.31 176.59 3i4n h ARG 430 N 0.29 0.00 0.15 1.51 3.08 -1.74 0.35 114.38 118.01 3i4n h ARG 430 Ca 0.51 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 60.25 3i4n h ARG 430 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.02 3i4n h ARG 430 CO -0.57 0.00 -1.48 -0.92 -1.07 0.00 0.00 179.97 175.93 3i4n h TYR 431 N 0.00 0.57 0.11 3.04 3.20 0.11 -3.24 116.97 120.76 3i4n h TYR 431 Ca 0.00 -0.41 -0.34 0.00 3.14 0.00 0.00 58.73 61.12 3i4n h TYR 431 Cb 0.01 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 3i4n h TYR 431 CO 0.00 1.41 -1.80 0.52 -1.64 0.00 0.00 178.16 176.65 3i4n h MET 432 N 0.09 0.24 0.00 1.82 0.00 -1.03 -2.85 114.93 113.19 3i4n h MET 432 Ca -0.23 -0.40 0.00 0.00 0.00 0.00 0.00 59.70 59.07 3i4n h MET 432 Cb 2.04 0.15 0.00 0.00 0.00 0.00 0.00 31.60 33.79 3i4n h MET 432 CO 0.19 1.08 0.00 1.96 0.00 0.00 0.00 176.91 180.14 3i4n h GLN 433 N 0.06 0.00 -0.00 1.72 4.20 -0.52 -1.82 115.11 118.76 3i4n h GLN 433 Ca -0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.36 3i4n h GLN 433 Cb 2.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.82 3i4n h GLN 433 CO 0.12 0.00 -0.39 0.54 -0.67 0.00 0.00 178.83 178.43 3i4n n ARG 434 N -2.34 3.87 -1.64 1.46 1.74 -1.22 -4.82 116.66 113.71 3i4n n ARG 434 Ca 0.00 -0.07 -0.42 0.00 -0.77 0.00 0.00 57.85 56.59 3i4n n ARG 434 Cb 0.14 -0.93 -0.02 0.00 -1.02 0.00 0.00 32.46 30.62 3i4n n ARG 434 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3i4n n THR 435 N -1.09 2.86 0.00 0.55 -1.04 -0.68 -4.72 114.28 110.15 3i4n n THR 435 Ca 0.02 -2.58 0.00 0.00 -2.04 0.00 0.00 64.05 59.45 3i4n n THR 435 Cb 0.14 -2.46 0.00 0.00 -1.82 0.00 0.00 70.33 66.20 3i4n n THR 435 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 3i4n n VAL 436 N 5.71 0.89 0.00 12.58 0.31 -1.26 -5.00 118.33 131.56 3i4n n VAL 436 Ca 0.50 0.45 0.00 0.00 -0.01 0.00 0.00 64.34 65.28 3i4n n VAL 436 Cb 0.41 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.89 3i4n n VAL 436 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3i4n n GLU 437 N -1.20 0.00 -1.38 5.55 1.02 -1.26 -5.24 120.64 118.13 3i4n n GLU 437 Ca 0.00 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.90 3i4n n GLU 437 Cb 0.23 -0.29 -0.06 0.00 -0.02 0.00 0.00 31.44 31.30 3i4n n GLU 437 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 3i4n n LEU 446 N 0.00 6.32 -0.17 -4.62 -0.00 -1.26 -5.28 117.00 112.00 3i4n n LEU 446 Ca 0.00 -3.89 -0.02 0.00 -0.00 0.00 0.00 56.01 52.10 3i4n n LEU 446 Cb 0.00 -1.24 -0.00 0.00 -0.00 0.00 0.00 43.42 42.18 3i4n n LEU 446 CO 0.00 1.68 -0.02 0.00 -0.00 0.00 0.00 177.39 179.05 3i4n n ALA 447 N 1.02 -0.04 -3.55 1.47 0.00 -1.26 -5.02 120.51 113.12 3i4n n ALA 447 Ca 0.46 0.01 -0.29 0.00 0.00 0.00 0.00 53.44 53.63 3i4n n ALA 447 Cb 0.60 -0.62 -0.13 0.00 0.00 0.00 0.00 19.45 19.30 3i4n n ALA 447 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3i4n s ILE 448 N -2.07 0.57 -1.32 0.00 1.01 -1.26 -4.78 121.20 113.35 3i4n s ILE 448 Ca 0.00 -1.94 -0.08 0.00 0.00 0.00 0.00 60.65 58.63 3i4n s ILE 448 Cb 0.00 -1.41 -0.07 0.00 0.01 0.00 0.00 42.46 40.99 3i4n s ILE 448 CO 0.00 -0.94 2.58 -3.20 0.00 0.00 0.00 174.94 173.38 3i4n n ASN 449 N 3.95 7.02 -0.37 3.58 5.15 -1.26 -4.70 115.26 128.63 3i4n n ASN 449 Ca 0.10 -2.47 0.32 0.00 -0.60 0.00 0.00 54.58 51.93 3i4n n ASN 449 Cb 0.36 -1.36 0.50 0.00 -0.53 0.00 0.00 39.78 38.75 3i4n n ASN 449 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3i4n n ALA 450 N 3.93 1.15 -0.05 5.20 0.00 -1.26 0.19 120.51 129.66 3i4n n ALA 450 Ca 0.64 0.40 0.16 0.00 0.00 0.00 0.00 53.44 54.63 3i4n n ALA 450 Cb 0.19 -0.69 0.58 0.00 0.00 0.00 0.00 19.45 19.53 3i4n n ALA 450 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3i4n h LYS 451 N 0.00 0.23 -0.13 0.00 3.64 -1.98 -2.53 116.57 115.80 3i4n h LYS 451 Ca 0.57 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.96 3i4n h LYS 451 Cb 2.68 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 34.40 3i4n h LYS 451 CO -0.01 0.15 -0.39 1.15 -2.27 0.00 0.00 179.45 178.09 3i4n h THR 452 N 0.24 0.00 0.64 1.00 2.02 0.16 -1.75 112.91 115.22 3i4n h THR 452 Ca 0.28 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.42 3i4n h THR 452 Cb 0.76 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 67.18 3i4n h THR 452 CO -0.05 0.00 -0.31 0.40 0.37 0.00 0.00 175.52 175.93 3i4n h ILE 453 N -0.40 0.15 -0.19 3.11 2.04 -1.70 -1.99 117.51 118.53 3i4n h ILE 453 Ca 0.03 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.57 3i4n h ILE 453 Cb 0.48 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 3i4n h ILE 453 CO -0.33 0.02 -0.11 0.41 0.00 0.00 0.00 178.15 178.14 3i4n n THR 454 N -5.36 -0.13 0.44 -0.27 -1.04 -0.98 -1.08 114.28 105.86 3i4n n THR 454 Ca -0.12 1.08 -0.19 0.00 -2.04 0.00 0.00 64.05 62.78 3i4n n THR 454 Cb 0.36 -1.40 -0.09 0.00 -1.82 0.00 0.00 70.33 67.37 3i4n n THR 454 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 3i4n h SER 455 N 0.00 -0.99 -0.03 8.00 4.64 -1.41 -3.27 113.55 120.49 3i4n h SER 455 Ca 0.03 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3i4n h SER 455 Cb 0.08 0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3i4n h SER 455 CO -0.18 -0.69 -0.02 0.61 -0.87 0.00 0.00 176.83 175.69 3i4n n GLY 456 N -1.58 -0.92 0.34 -0.77 0.00 -0.25 0.13 105.19 102.14 3i4n n GLY 456 Ca -0.15 0.19 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 3i4n n GLY 456 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3i4n h LEU 457 N 0.00 -1.08 -0.12 0.99 3.38 -1.49 -2.00 115.31 114.98 3i4n h LEU 457 Ca 0.00 0.25 0.01 0.00 0.09 0.00 0.00 57.88 58.24 3i4n h LEU 457 Cb 0.01 0.59 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 3i4n h LEU 457 CO -0.03 -0.29 -0.17 0.11 0.09 0.00 0.00 178.44 178.16 3i4n h LYS 458 N -0.08 -0.12 -0.42 1.13 1.57 0.10 -2.37 116.57 116.39 3i4n h LYS 458 Ca 0.30 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 59.18 3i4n h LYS 458 Cb 0.57 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.83 3i4n h LYS 458 CO -0.78 -0.08 -0.08 0.98 -0.57 0.00 0.00 179.45 178.92 3i4n n TYR 459 N -3.50 0.18 0.00 -1.35 9.36 -0.75 -1.06 117.16 120.03 3i4n n TYR 459 Ca -0.01 0.51 0.00 0.00 3.32 0.00 0.00 57.90 61.72 3i4n n TYR 459 Cb 0.10 -0.76 0.00 0.00 -0.63 0.00 0.00 39.34 38.05 3i4n n TYR 459 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3i4n n ALA 460 N -3.76 -0.17 -0.37 2.98 0.00 -0.90 -2.72 120.51 115.56 3i4n n ALA 460 Ca 0.07 0.00 0.37 0.00 0.00 0.00 0.00 53.44 53.88 3i4n n ALA 460 Cb 0.24 0.00 0.62 0.00 0.00 0.00 0.00 19.45 20.31 3i4n n ALA 460 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3i4n h LEU 461 N 0.00 0.00 0.00 0.00 4.07 -0.97 0.65 115.31 119.06 3i4n h LEU 461 Ca 0.00 0.00 -0.26 0.00 0.08 0.00 0.00 57.88 57.70 3i4n h LEU 461 Cb 0.00 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.76 3i4n h LEU 461 CO 0.00 0.00 -1.00 0.00 -1.08 0.00 0.00 178.44 176.36 3i4n h ALA 462 N 0.84 0.12 -2.97 1.53 0.00 -1.15 -3.43 119.26 114.20 3i4n h ALA 462 Ca 0.63 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3i4n h ALA 462 Cb 3.04 0.06 0.00 0.00 0.00 0.00 0.00 17.79 20.89 3i4n h ALA 462 CO -0.01 0.65 0.00 0.25 0.00 0.00 0.00 179.25 180.15 3i4n n THR 463 N -3.89 0.00 0.00 0.00 -2.24 0.20 -5.06 114.28 103.28 3i4n n THR 463 Ca -0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 3i4n n THR 463 Cb 0.86 -0.87 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 3i4n n THR 463 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i4n n GLY 464 N 2.89 -0.23 3.40 3.38 0.00 0.57 -4.77 105.19 110.43 3i4n n GLY 464 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 3i4n n GLY 464 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i4n s ASN 465 N 0.00 6.60 -0.50 1.61 0.02 -1.26 -2.19 114.94 119.22 3i4n s ASN 465 Ca 0.00 -2.16 -0.04 0.00 -1.02 0.00 0.00 52.86 49.64 3i4n s ASN 465 Cb 0.00 -2.32 -0.06 0.00 0.02 0.00 0.00 41.25 38.89 3i4n s ASN 465 CO 0.00 -0.91 1.86 0.79 0.02 0.00 0.00 177.10 178.87 3i4n n TRP 466 N 5.62 0.75 -3.07 2.20 5.03 -1.26 -4.40 117.44 122.32 3i4n n TRP 466 Ca 0.15 -1.35 0.03 0.00 3.03 0.00 0.00 57.50 59.36 3i4n n TRP 466 Cb 0.47 -1.28 -0.00 0.00 -1.03 0.00 0.00 31.31 29.47 3i4n n TRP 466 CO 0.00 0.00 0.00 0.20 -0.03 0.00 0.00 177.69 177.86 3i4n s GLY 467 N 3.42 -1.25 0.00 6.99 0.00 -1.26 -4.62 107.32 110.60 3i4n s GLY 467 Ca 0.30 1.21 0.00 0.00 0.00 0.00 0.00 44.72 46.23 3i4n s GLY 467 CO -0.02 3.96 0.00 1.18 0.00 0.00 0.00 173.10 178.22 3i4n n GLU 468 N 4.66 0.00 0.00 2.90 4.71 -1.26 -4.56 120.64 127.09 3i4n n GLU 468 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.23 3i4n n GLU 468 Cb 0.58 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 31.01 3i4n n GLU 468 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3i4n n GLN 469 N 0.00 0.00 -0.04 3.49 10.64 -1.26 -4.81 117.38 125.40 3i4n n GLN 469 Ca 0.00 0.00 0.01 0.00 -1.83 0.00 0.00 57.00 55.18 3i4n n GLN 469 Cb 0.00 0.00 -0.00 0.00 -0.86 0.00 0.00 30.24 29.38 3i4n n GLN 469 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 3i4n n LYS 470 N 0.00 -0.08 -1.55 2.61 5.02 -1.26 -3.27 118.16 119.63 3i4n n LYS 470 Ca 0.00 0.05 -0.38 0.00 -2.02 0.00 0.00 58.31 55.96 3i4n n LYS 470 Cb 0.00 -0.09 -0.03 0.00 -0.02 0.00 0.00 35.03 34.89 3i4n n LYS 470 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3i4n n LYS 471 N -0.45 3.91 -3.65 1.97 5.02 -1.26 -4.79 118.16 118.91 3i4n n LYS 471 Ca 0.00 -2.60 -0.03 0.00 -2.02 0.00 0.00 58.31 53.66 3i4n n LYS 471 Cb 0.02 -2.68 -0.07 0.00 -0.02 0.00 0.00 35.03 32.28 3i4n n LYS 471 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i4n s ALA 472 N 0.80 -2.29 -0.66 7.82 0.00 -1.20 -5.01 121.76 121.22 3i4n s ALA 472 Ca 0.64 1.84 -0.02 0.00 0.00 0.00 0.00 51.96 54.41 3i4n s ALA 472 Cb 0.19 -1.76 0.26 0.00 0.00 0.00 0.00 23.12 21.82 3i4n s ALA 472 CO -0.07 -0.20 2.26 0.00 0.00 0.00 0.00 175.76 177.75 3i4n n MET 473 N 2.27 2.56 -0.02 0.00 0.00 -1.26 -4.67 117.12 116.00 3i4n n MET 473 Ca -0.13 -2.97 0.00 0.00 0.00 0.00 0.00 57.70 54.60 3i4n n MET 473 Cb 0.57 -2.18 0.01 0.00 0.00 0.00 0.00 33.22 31.61 3i4n n MET 473 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 3i4n n SER 474 N -0.09 0.73 0.00 3.17 3.41 -1.26 -4.79 113.62 114.79 3i4n n SER 474 Ca 0.52 -2.02 0.00 0.00 -0.26 0.00 0.00 58.87 57.11 3i4n n SER 474 Cb 0.42 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 3i4n n SER 474 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3i4n n SER 475 N -0.16 0.00 -3.19 4.04 3.41 -1.26 -4.89 113.62 111.56 3i4n n SER 475 Ca 0.01 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.42 3i4n n SER 475 Cb 0.17 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.08 3i4n n SER 475 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3i4n n ARG 476 N 0.00 0.88 -1.45 4.33 1.74 -1.26 -4.87 116.66 116.02 3i4n n ARG 476 Ca 0.00 -3.32 -0.46 0.00 -0.77 0.00 0.00 57.85 53.30 3i4n n ARG 476 Cb 0.00 -1.53 -0.09 0.00 -1.02 0.00 0.00 32.46 29.82 3i4n n ARG 476 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3i4n n ALA 477 N 0.69 0.66 0.00 7.54 0.00 -0.93 -3.20 120.51 125.27 3i4n n ALA 477 Ca 0.24 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3i4n n ALA 477 Cb 0.61 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.54 3i4n n ALA 477 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i4n n GLY 478 N 6.58 0.05 3.79 0.00 0.00 -1.17 -4.97 105.19 109.47 3i4n n GLY 478 Ca 0.50 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.16 3i4n n GLY 478 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i4n s VAL 479 N 0.00 4.26 -0.24 1.61 1.01 -1.19 -4.56 120.40 121.28 3i4n s VAL 479 Ca 0.00 1.73 -0.05 0.00 0.00 0.00 0.00 61.98 63.66 3i4n s VAL 479 Cb 0.00 -3.93 0.02 0.00 0.00 0.00 0.00 36.38 32.47 3i4n s VAL 479 CO 0.00 0.07 0.10 -0.24 0.00 0.00 0.00 175.10 175.03 3i4n n SER 480 N 0.37 -4.72 0.00 3.32 2.88 -1.25 -4.17 113.62 110.06 3i4n n SER 480 Ca 0.02 1.32 0.00 0.00 -1.33 0.00 0.00 58.87 58.88 3i4n n SER 480 Cb 0.51 -5.05 0.00 0.00 -0.75 0.00 0.00 64.21 58.92 3i4n n SER 480 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3i4n n GLN 481 N 1.04 3.83 -3.68 -1.46 6.02 -1.08 -4.48 117.38 117.57 3i4n n GLN 481 Ca -0.16 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.54 3i4n n GLN 481 Cb 0.25 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.39 3i4n n GLN 481 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3i4n s VAL 482 N 3.05 1.49 0.00 5.09 -7.23 -1.26 -1.84 120.40 119.70 3i4n s VAL 482 Ca 0.00 -2.94 0.00 0.00 -1.81 0.00 0.00 61.98 57.23 3i4n s VAL 482 Cb 0.00 -2.02 0.00 0.00 0.56 0.00 0.00 36.38 34.92 3i4n s VAL 482 CO 0.00 -0.99 0.00 -0.11 -0.31 0.00 0.00 175.10 173.69 3i4n n LEU 483 N 3.06 0.00 -4.73 1.32 7.94 -0.75 -4.81 117.00 119.03 3i4n n LEU 483 Ca 0.16 0.00 -0.42 0.00 -1.11 0.00 0.00 56.01 54.64 3i4n n LEU 483 Cb 0.37 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.30 3i4n n LEU 483 CO 0.21 0.00 1.09 0.20 -1.11 0.00 0.00 177.39 177.78 3i4n s ASN 484 N 0.00 6.75 -0.41 1.96 -0.87 -1.26 -4.94 114.94 116.17 3i4n s ASN 484 Ca 0.00 2.47 0.11 0.00 -1.57 0.00 0.00 52.86 53.88 3i4n s ASN 484 Cb 0.00 -2.60 0.38 0.00 -0.02 0.00 0.00 41.25 39.01 3i4n s ASN 484 CO 0.00 -0.67 0.86 -1.14 -2.57 0.00 0.00 177.10 173.58 3i4n n ARG 485 N 3.32 1.73 -0.13 -0.60 3.00 -1.26 -3.85 116.66 118.87 3i4n n ARG 485 Ca 0.10 -3.78 -0.27 0.00 -0.00 0.00 0.00 57.85 53.90 3i4n n ARG 485 Cb 0.41 -1.77 -0.09 0.00 0.00 0.00 0.00 32.46 31.00 3i4n n ARG 485 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 3i4n n TYR 486 N 0.02 0.00 -3.97 -0.14 4.02 -1.26 -4.86 117.16 110.98 3i4n n TYR 486 Ca 0.24 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 58.04 3i4n n TYR 486 Cb 0.64 -0.91 -0.11 0.00 -0.02 0.00 0.00 39.34 38.94 3i4n n TYR 486 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3i4n s THR 487 N -2.46 0.12 0.12 -0.72 2.01 -1.26 -3.94 115.64 109.50 3i4n s THR 487 Ca -0.35 -0.98 -0.29 0.00 0.31 0.00 0.00 61.69 60.38 3i4n s THR 487 Cb 0.13 -0.48 -0.08 0.00 0.01 0.00 0.00 72.50 72.08 3i4n s THR 487 CO 0.45 -0.54 1.60 0.22 -0.69 0.00 0.00 174.62 175.66 3i4n h TYR 488 N 4.33 -1.04 -1.07 4.92 3.20 -1.79 0.36 116.97 125.88 3i4n h TYR 488 Ca -0.32 0.03 0.28 0.00 3.14 0.00 0.00 58.73 61.86 3i4n h TYR 488 Cb 1.20 0.45 -0.09 0.00 1.54 0.00 0.00 36.73 39.83 3i4n h TYR 488 CO 0.62 -0.47 0.69 0.66 -1.64 0.00 0.00 178.16 178.03 3i4n h SER 489 N -0.57 0.39 0.26 -2.11 4.64 -1.86 0.10 113.55 114.40 3i4n h SER 489 Ca 0.04 0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.43 3i4n h SER 489 Cb 0.62 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3i4n h SER 489 CO -0.26 0.06 -0.13 -1.28 -0.87 0.00 0.00 176.83 174.36 3i4n h SER 490 N 0.33 -0.30 -1.04 4.97 0.87 -1.11 -2.68 113.55 114.60 3i4n h SER 490 Ca 0.61 -0.23 0.34 0.00 -1.23 0.00 0.00 61.79 61.27 3i4n h SER 490 Cb 1.64 0.08 -0.15 0.00 -0.44 0.00 0.00 62.40 63.53 3i4n h SER 490 CO -0.28 0.16 0.60 0.74 -0.53 0.00 0.00 176.83 177.52 3i4n h THR 491 N -0.85 0.26 0.13 2.23 2.02 0.16 -1.96 112.91 114.89 3i4n h THR 491 Ca -0.04 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 3i4n h THR 491 Cb 0.51 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 3i4n h THR 491 CO 0.06 0.05 -0.06 -0.07 0.37 0.00 0.00 175.52 175.87 3i4n h LEU 492 N 0.26 -0.14 -0.59 2.58 3.38 -1.34 -3.16 115.31 116.30 3i4n h LEU 492 Ca 0.75 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.84 3i4n h LEU 492 Cb 1.84 0.04 -0.11 0.00 0.09 0.00 0.00 40.66 42.52 3i4n h LEU 492 CO -0.59 -0.05 -0.17 -0.24 0.09 0.00 0.00 178.44 177.49 3i4n n SER 493 N -2.76 -0.26 -0.36 -0.43 2.88 -0.79 0.21 113.62 112.11 3i4n n SER 493 Ca -0.02 1.02 -0.03 0.00 -1.33 0.00 0.00 58.87 58.51 3i4n n SER 493 Cb 0.07 -0.29 0.10 0.00 -0.75 0.00 0.00 64.21 63.34 3i4n n SER 493 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 3i4n h HIS 494 N 0.00 1.24 -0.47 0.66 -0.00 -1.53 -2.95 115.15 112.09 3i4n h HIS 494 Ca 0.26 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.64 3i4n h HIS 494 Cb 0.41 -0.41 -0.02 0.00 -0.00 0.00 0.00 27.41 27.39 3i4n h HIS 494 CO -0.47 0.80 0.25 -0.07 -0.00 0.00 0.00 177.93 178.44 3i4n h LEU 495 N 1.32 0.59 -7.32 0.26 3.38 0.24 -3.25 115.31 110.53 3i4n h LEU 495 Ca 0.35 -0.10 -0.77 0.00 0.09 0.00 0.00 57.88 57.45 3i4n h LEU 495 Cb -0.11 -0.15 -0.23 0.00 0.09 0.00 0.00 40.66 40.26 3i4n h LEU 495 CO -0.07 0.52 1.07 -2.11 0.09 0.00 0.00 178.44 177.93 3i4n n ARG 496 N -4.67 3.67 -4.52 1.13 1.85 -1.01 -4.87 116.66 108.24 3i4n n ARG 496 Ca 0.01 -4.13 -0.25 0.00 -1.00 0.00 0.00 57.85 52.49 3i4n n ARG 496 Cb 0.09 -2.76 -0.10 0.00 -1.05 0.00 0.00 32.46 28.64 3i4n n ARG 496 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 3i4n s ARG 497 N -0.36 1.82 -0.17 2.89 3.52 -1.23 -3.05 118.95 122.37 3i4n s ARG 497 Ca 0.36 -2.06 -0.04 0.00 -0.13 0.00 0.00 55.73 53.86 3i4n s ARG 497 Cb -0.02 -0.95 0.08 0.00 -1.56 0.00 0.00 34.95 32.50 3i4n s ARG 497 CO -0.01 -0.27 0.18 0.99 -0.81 0.00 0.00 175.30 175.38 3i4n s THR 498 N -3.17 -0.26 -0.01 4.11 2.01 0.44 -3.54 115.64 115.23 3i4n s THR 498 Ca 0.29 -0.04 -0.06 0.00 0.31 0.00 0.00 61.69 62.20 3i4n s THR 498 Cb 0.06 -0.59 -0.04 0.00 0.01 0.00 0.00 72.50 71.94 3i4n s THR 498 CO 0.14 -0.16 0.23 0.21 -0.69 0.00 0.00 174.62 174.35 3i4n s ASN 499 N 2.28 6.45 -0.25 3.53 2.47 -0.11 0.14 114.94 129.45 3i4n s ASN 499 Ca 0.05 0.49 -0.02 0.00 0.42 0.00 0.00 52.86 53.80 3i4n s ASN 499 Cb -0.15 -2.06 0.13 0.00 -1.45 0.00 0.00 41.25 37.72 3i4n s ASN 499 CO -0.10 0.28 0.33 -0.89 -3.72 0.00 0.00 177.10 172.99 3i4n s THR 500 N -1.27 -0.50 0.98 -5.21 2.01 -1.06 -1.69 115.64 108.89 3i4n s THR 500 Ca 0.26 -0.22 -0.15 0.00 0.31 0.00 0.00 61.69 61.89 3i4n s THR 500 Cb -0.13 -0.85 -0.05 0.00 0.01 0.00 0.00 72.50 71.48 3i4n s THR 500 CO 0.15 -0.25 -0.19 -0.81 -0.69 0.00 0.00 174.62 172.83 3i4n n PRO 501 N 5.34 -0.19 -3.95 4.92 -0.04 -1.26 -4.81 135.00 135.00 3i4n n PRO 501 Ca -0.03 -0.03 -0.22 0.00 -0.04 0.00 0.00 63.50 63.17 3i4n n PRO 501 Cb 0.49 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 32.45 3i4n n PRO 501 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3i4n n ILE 502 N -3.13 0.00 0.00 0.52 -6.64 -1.26 -5.11 119.36 103.74 3i4n n ILE 502 Ca 0.02 -1.83 0.00 0.00 -1.77 0.00 0.00 62.75 59.18 3i4n n ILE 502 Cb 0.55 0.50 0.00 0.00 -1.44 0.00 0.00 39.64 39.25 3i4n n ILE 502 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 3i4n n GLY 503 N 0.18 -2.83 0.00 3.28 0.00 -1.26 -4.89 105.19 99.67 3i4n n GLY 503 Ca -0.11 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3i4n n GLY 503 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i4n n ARG 504 N -0.41 0.12 -4.16 1.61 1.74 -1.26 -5.13 116.66 109.17 3i4n n ARG 504 Ca 0.00 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.95 3i4n n ARG 504 Cb 0.00 -0.01 -0.08 0.00 -1.02 0.00 0.00 32.46 31.35 3i4n n ARG 504 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3i4n s ASP 505 N 0.00 0.40 -0.99 0.55 1.01 -1.26 -5.07 116.67 111.31 3i4n s ASP 505 Ca 0.00 -1.36 -0.30 0.00 0.71 0.00 0.00 52.55 51.61 3i4n s ASP 505 Cb 0.00 0.48 -0.22 0.00 1.01 0.00 0.00 42.92 44.18 3i4n s ASP 505 CO 0.00 -0.98 2.66 0.61 0.21 0.00 0.00 175.17 177.67 3i4n n GLY 506 N -0.38 -0.48 3.04 0.21 0.00 -1.26 -4.77 105.19 101.56 3i4n n GLY 506 Ca 0.02 1.08 -0.42 0.00 0.00 0.00 0.00 46.02 46.70 3i4n n GLY 506 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3i4n n LYS 507 N 8.32 2.79 -2.48 1.61 4.76 -1.26 -4.91 118.16 126.99 3i4n n LYS 507 Ca 0.66 -2.73 -0.40 0.00 -2.87 0.00 0.00 58.31 52.97 3i4n n LYS 507 Cb 0.05 -3.34 -0.03 0.00 -1.84 0.00 0.00 35.03 29.87 3i4n n LYS 507 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3i4n s LEU 508 N 3.04 3.29 0.00 -0.35 2.96 -1.26 -4.45 118.68 121.92 3i4n s LEU 508 Ca 0.51 -0.74 0.00 0.00 -0.22 0.00 0.00 54.13 53.67 3i4n s LEU 508 Cb 0.11 -2.56 0.00 0.00 0.50 0.00 0.00 46.19 44.23 3i4n s LEU 508 CO -0.01 -1.83 0.00 0.00 -1.32 0.00 0.00 176.35 173.19 3i4n n ALA 509 N 9.80 0.00 -0.60 5.97 0.00 -1.26 -5.04 120.51 129.38 3i4n n ALA 509 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 3i4n n ALA 509 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 3i4n n ALA 509 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3i4n n LYS 510 N 0.00 0.00 0.00 0.00 2.85 -1.26 -3.38 118.16 116.37 3i4n n LYS 510 Ca 0.00 0.52 0.00 0.00 -1.05 0.00 0.00 58.31 57.78 3i4n n LYS 510 Cb 0.00 -0.93 0.00 0.00 -0.65 0.00 0.00 35.03 33.45 3i4n n LYS 510 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 3i4n n PRO 511 N -1.42 0.00 -0.17 -1.58 -0.02 -1.26 -2.15 135.00 128.39 3i4n n PRO 511 Ca 0.00 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.63 3i4n n PRO 511 Cb 0.00 -0.13 0.25 0.00 -0.02 0.00 0.00 33.50 33.60 3i4n n PRO 511 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3i4n n ARG 512 N 0.00 -0.02 -0.63 -0.52 1.74 -1.25 -4.61 116.66 111.37 3i4n n ARG 512 Ca 0.00 0.50 -0.31 0.00 -0.77 0.00 0.00 57.85 57.27 3i4n n ARG 512 Cb 0.00 -0.96 0.19 0.00 -1.02 0.00 0.00 32.46 30.67 3i4n n ARG 512 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 3i4n n GLN 513 N -3.54 -1.68 -3.75 5.56 -0.06 -0.92 -4.48 117.38 108.51 3i4n n GLN 513 Ca 0.15 -0.47 -0.37 0.00 -2.00 0.00 0.00 57.00 54.32 3i4n n GLN 513 Cb 0.58 -1.86 -0.12 0.00 -4.06 0.00 0.00 30.24 24.78 3i4n n GLN 513 CO 0.00 0.00 0.00 -1.17 -0.20 0.00 0.00 177.06 175.69 3i4n s LEU 514 N -3.02 3.52 0.55 1.69 2.96 -1.26 -5.03 118.68 118.09 3i4n s LEU 514 Ca 0.60 -0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 54.32 3i4n s LEU 514 Cb -0.17 -1.95 0.02 0.00 0.50 0.00 0.00 46.19 44.60 3i4n s LEU 514 CO 0.66 -0.03 0.80 -2.28 -1.32 0.00 0.00 176.35 174.18 3i4n s HIS 515 N 1.58 3.03 -0.03 5.38 5.65 -1.26 -5.02 115.29 124.63 3i4n s HIS 515 Ca 0.06 0.23 -0.22 0.00 0.25 0.00 0.00 55.06 55.38 3i4n s HIS 515 Cb -0.15 -2.70 -0.24 0.00 -1.18 0.00 0.00 32.58 28.31 3i4n s HIS 515 CO 0.04 -0.81 1.06 -0.91 -0.65 0.00 0.00 174.74 173.47 3i4n h ASN 516 N 0.02 0.37 0.00 9.88 -0.26 -1.99 -2.86 115.58 120.75 3i4n h ASN 516 Ca -0.44 -0.77 0.00 0.00 -0.56 0.00 0.00 56.30 54.53 3i4n h ASN 516 Cb 1.28 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 38.43 3i4n h ASN 516 CO 0.56 1.10 0.01 0.35 -1.06 0.00 0.00 177.43 178.39 3i4n n THR 517 N -4.36 1.10 0.11 2.81 -2.24 -1.26 -0.53 114.28 109.90 3i4n n THR 517 Ca -0.10 0.29 -0.00 0.00 -2.27 0.00 0.00 64.05 61.96 3i4n n THR 517 Cb 0.59 -1.29 -0.02 0.00 -2.10 0.00 0.00 70.33 67.51 3i4n n THR 517 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 3i4n h HIS 518 N 0.00 0.00 -1.23 4.78 3.86 -1.87 -3.42 115.15 117.27 3i4n h HIS 518 Ca 0.00 0.00 -0.77 0.00 -1.16 0.00 0.00 60.37 58.44 3i4n h HIS 518 Cb 0.02 0.00 0.04 0.00 1.06 0.00 0.00 27.41 28.53 3i4n h HIS 518 CO 0.00 0.64 0.32 1.87 0.86 0.00 0.00 177.93 181.63 3i4n n TRP 519 N -3.23 1.15 0.00 2.45 -0.00 0.31 -1.67 117.44 116.45 3i4n n TRP 519 Ca 0.00 0.91 0.00 0.00 -0.00 0.00 0.00 57.50 58.42 3i4n n TRP 519 Cb 0.80 -2.21 0.00 0.00 -0.00 0.00 0.00 31.31 29.90 3i4n n TRP 519 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3i4n n GLY 520 N 2.35 2.24 0.13 5.87 0.00 -1.26 -4.72 105.19 109.80 3i4n n GLY 520 Ca 0.22 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.02 3i4n n GLY 520 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i4n n LEU 521 N 0.00 2.40 -4.47 0.99 4.77 -0.67 -4.40 117.00 115.62 3i4n n LEU 521 Ca 0.00 0.24 -0.30 0.00 -0.03 0.00 0.00 56.01 55.93 3i4n n LEU 521 Cb 0.00 -1.03 -0.12 0.00 -2.33 0.00 0.00 43.42 39.94 3i4n n LEU 521 CO 0.00 0.68 -0.50 -0.69 -1.33 0.00 0.00 177.39 175.54 3i4n s VAL 522 N -2.49 2.74 0.34 4.08 1.01 -0.91 0.51 120.40 125.67 3i4n s VAL 522 Ca -0.27 -1.50 -0.28 0.00 0.00 0.00 0.00 61.98 59.94 3i4n s VAL 522 Cb 0.07 -2.23 -0.10 0.00 0.00 0.00 0.00 36.38 34.13 3i4n s VAL 522 CO 0.68 0.14 1.20 0.00 0.00 0.00 0.00 175.10 177.12 3i4n h PRO 524 N 3.30 0.00 0.00 0.00 0.13 -1.90 -3.40 132.00 130.13 3i4n h PRO 524 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3i4n h PRO 524 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3i4n h PRO 524 CO 0.65 0.58 -1.60 0.00 -0.23 0.00 0.00 178.00 177.41 3i4n n ALA 525 N -2.36 2.62 -2.89 -0.56 0.00 -1.26 -4.88 120.51 111.17 3i4n n ALA 525 Ca -0.05 -0.35 -0.44 0.00 0.00 0.00 0.00 53.44 52.61 3i4n n ALA 525 Cb 0.88 -0.50 -0.03 0.00 0.00 0.00 0.00 19.45 19.80 3i4n n ALA 525 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3i4n s GLU 526 N -2.96 3.60 0.01 0.00 2.12 -1.26 -3.87 118.70 116.34 3i4n s GLU 526 Ca -0.05 -1.70 -0.05 0.00 0.36 0.00 0.00 54.97 53.53 3i4n s GLU 526 Cb 0.09 -4.96 -0.01 0.00 0.26 0.00 0.00 34.13 29.52 3i4n s GLU 526 CO 0.60 -1.81 0.09 -0.08 -0.54 0.00 0.00 175.26 173.52 3i4n s THR 527 N 2.90 0.10 -0.02 -1.70 -1.32 -1.26 -4.13 115.64 110.20 3i4n s THR 527 Ca 0.34 -0.83 -0.30 0.00 -1.21 0.00 0.00 61.69 59.69 3i4n s THR 527 Cb -0.04 -0.50 -0.06 0.00 -1.51 0.00 0.00 72.50 70.39 3i4n s THR 527 CO -0.10 -0.46 1.59 -2.16 -2.21 0.00 0.00 174.62 171.29 3i4n s PRO 528 N -1.68 4.20 0.73 7.08 0.04 -1.26 -4.91 135.00 139.21 3i4n s PRO 528 Ca -0.13 2.15 -0.15 0.00 0.04 0.00 0.00 61.00 62.91 3i4n s PRO 528 Cb -0.07 -3.82 0.04 0.00 0.04 0.00 0.00 34.50 30.69 3i4n s PRO 528 CO -0.00 -0.77 1.22 -1.21 0.04 0.00 0.00 177.00 176.28 3i4n s GLU 529 N 3.44 2.12 1.59 4.56 2.02 -1.26 -3.50 118.70 127.68 3i4n s GLU 529 Ca 0.71 1.80 0.00 0.00 0.02 0.00 0.00 54.97 57.50 3i4n s GLU 529 Cb -0.34 -1.83 0.00 0.00 0.10 0.00 0.00 34.13 32.07 3i4n s GLU 529 CO 0.29 -1.86 0.00 0.41 0.02 0.00 0.00 175.26 174.12 3i4n n GLY 530 N 0.48 0.35 3.38 -1.39 0.00 -1.26 -4.64 105.19 102.10 3i4n n GLY 530 Ca 0.14 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.39 3i4n n GLY 530 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4n n GLN 531 N -0.38 0.00 -1.03 1.61 10.64 -1.26 -0.17 117.38 126.79 3i4n n GLN 531 Ca 0.00 0.00 -0.13 0.00 -1.83 0.00 0.00 57.00 55.04 3i4n n GLN 531 Cb 0.00 0.00 -0.16 0.00 -0.86 0.00 0.00 30.24 29.22 3i4n n GLN 531 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3i4n n ALA 532 N 4.28 6.41 -2.22 2.61 0.00 -1.26 -4.90 120.51 125.43 3i4n n ALA 532 Ca 0.00 -1.92 -0.43 0.00 0.00 0.00 0.00 53.44 51.09 3i4n n ALA 532 Cb 0.00 -2.34 -0.02 0.00 0.00 0.00 0.00 19.45 17.09 3i4n n ALA 532 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n n GLY 534 N 5.04 1.07 0.09 0.00 0.00 -1.26 -4.64 105.19 105.49 3i4n n GLY 534 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.23 3i4n n GLY 534 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i4n n LEU 535 N 0.00 0.72 -4.30 0.99 4.77 -1.06 -4.24 117.00 113.87 3i4n n LEU 535 Ca 0.00 0.31 -0.34 0.00 -0.03 0.00 0.00 56.01 55.95 3i4n n LEU 535 Cb 0.00 0.07 -0.15 0.00 -2.33 0.00 0.00 43.42 41.01 3i4n n LEU 535 CO 0.00 0.09 -0.45 -0.69 -1.33 0.00 0.00 177.39 175.01 3i4n s VAL 536 N -3.04 2.91 0.25 4.08 1.01 -1.21 -2.56 120.40 121.84 3i4n s VAL 536 Ca -0.03 -0.68 0.09 0.00 0.00 0.00 0.00 61.98 61.35 3i4n s VAL 536 Cb 0.09 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 3i4n s VAL 536 CO 0.82 0.50 -0.14 -0.54 0.00 0.00 0.00 175.10 175.74 3i4n s LYS 537 N 0.86 1.52 -0.18 2.72 1.02 0.12 -4.47 119.74 121.33 3i4n s LYS 537 Ca -0.04 -1.71 -0.01 0.00 0.02 0.00 0.00 55.97 54.23 3i4n s LYS 537 Cb -0.15 -1.37 -0.01 0.00 -0.52 0.00 0.00 37.83 35.79 3i4n s LYS 537 CO -0.00 0.20 -0.11 -0.80 -0.92 0.00 0.00 175.35 173.72 3i4n s ASN 538 N -3.42 3.95 0.78 2.83 0.01 -1.26 0.17 114.94 118.00 3i4n s ASN 538 Ca 0.27 -0.42 -0.14 0.00 -0.71 0.00 0.00 52.86 51.86 3i4n s ASN 538 Cb -0.01 -1.64 0.06 0.00 0.41 0.00 0.00 41.25 40.07 3i4n s ASN 538 CO 0.11 0.05 1.12 0.18 -1.51 0.00 0.00 177.10 177.06 3i4n n LEU 539 N 4.28 4.14 0.00 0.60 4.77 -1.17 -0.92 117.00 128.70 3i4n n LEU 539 Ca -0.19 0.61 -0.14 0.00 -0.03 0.00 0.00 56.01 56.27 3i4n n LEU 539 Cb 0.51 -1.48 0.11 0.00 -2.33 0.00 0.00 43.42 40.24 3i4n n LEU 539 CO 0.29 -1.80 0.35 -1.20 -1.33 0.00 0.00 177.39 173.69 3i4n n SER 540 N -2.71 -0.84 -0.08 -1.43 7.64 0.18 -4.38 113.62 112.00 3i4n n SER 540 Ca 0.13 -0.99 -0.16 0.00 1.01 0.00 0.00 58.87 58.86 3i4n n SER 540 Cb 0.50 -0.48 -0.11 0.00 -1.01 0.00 0.00 64.21 63.11 3i4n n SER 540 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3i4n h LEU 541 N 0.00 0.00 -0.32 -3.43 3.38 -1.44 -3.39 115.31 110.11 3i4n h LEU 541 Ca -0.20 -0.71 -0.06 0.00 0.09 0.00 0.00 57.88 56.99 3i4n h LEU 541 Cb 0.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3i4n h LEU 541 CO 0.13 1.17 -0.05 0.24 0.09 0.00 0.00 178.44 180.03 3i4n h MET 542 N -1.00 0.59 -4.56 1.13 2.86 -1.87 -3.47 114.93 108.62 3i4n h MET 542 Ca -0.15 -0.21 -0.42 0.00 -2.06 0.00 0.00 59.70 56.86 3i4n h MET 542 Cb 1.06 -0.04 0.18 0.00 0.06 0.00 0.00 31.60 32.86 3i4n h MET 542 CO -0.09 0.76 -1.41 -1.13 1.06 0.00 0.00 176.91 176.10 3i4n n SER 543 N -4.49 -4.55 -3.76 1.22 3.41 -1.26 -4.79 113.62 99.40 3i4n n SER 543 Ca -0.02 0.15 -0.08 0.00 -0.26 0.00 0.00 58.87 58.66 3i4n n SER 543 Cb 0.30 -0.58 -0.02 0.00 -0.26 0.00 0.00 64.21 63.65 3i4n n SER 543 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i4n s ILE 545 N -3.81 2.99 -0.22 0.00 1.01 -1.26 -1.65 121.20 118.27 3i4n s ILE 545 Ca 0.09 -1.43 -0.29 0.00 0.00 0.00 0.00 60.65 59.02 3i4n s ILE 545 Cb -0.05 -2.38 -0.01 0.00 0.01 0.00 0.00 42.46 40.04 3i4n s ILE 545 CO 0.02 0.11 1.38 -0.94 0.00 0.00 0.00 174.94 175.51 3i4n s SER 546 N -2.14 6.71 0.00 3.58 1.04 0.13 -4.87 113.70 118.14 3i4n s SER 546 Ca 0.19 1.53 -0.23 0.00 0.48 0.00 0.00 55.95 57.92 3i4n s SER 546 Cb -0.11 -2.54 -0.18 0.00 0.10 0.00 0.00 66.02 63.30 3i4n s SER 546 CO 0.11 -0.99 1.29 1.62 0.98 0.00 0.00 173.24 176.24 3i4n h VAL 547 N 5.81 1.38 0.00 5.02 3.04 -1.92 0.42 116.25 130.00 3i4n h VAL 547 Ca -0.29 -1.27 0.00 0.00 -1.01 0.00 0.00 66.70 64.14 3i4n h VAL 547 Cb 1.12 2.07 0.00 0.00 -2.01 0.00 0.00 31.29 32.46 3i4n h VAL 547 CO 1.00 0.35 0.00 0.61 -1.01 0.00 0.00 177.57 178.52 3i4n n GLY 548 N 0.26 3.52 3.80 3.17 0.00 -1.26 -4.67 105.19 110.01 3i4n n GLY 548 Ca -0.07 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.09 3i4n n GLY 548 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i4n s THR 549 N 0.00 2.37 -0.08 2.61 2.01 -0.75 -5.01 115.64 116.79 3i4n s THR 549 Ca 0.00 -1.56 -0.14 0.00 0.31 0.00 0.00 61.69 60.30 3i4n s THR 549 Cb 0.00 -2.93 -0.05 0.00 0.01 0.00 0.00 72.50 69.53 3i4n s THR 549 CO 0.00 0.00 0.34 -0.62 -0.69 0.00 0.00 174.62 173.65 3i4n s ASP 550 N -4.01 6.61 -0.00 3.53 -1.08 -1.26 -4.75 116.67 115.71 3i4n s ASP 550 Ca 0.43 0.73 -0.24 0.00 -0.52 0.00 0.00 52.55 52.94 3i4n s ASP 550 Cb 0.01 -2.20 -0.15 0.00 -1.46 0.00 0.00 42.92 39.12 3i4n s ASP 550 CO 0.24 0.23 1.08 1.55 0.52 0.00 0.00 175.17 178.79 3i4n h PRO 551 N 5.59 -0.56 -0.57 4.34 0.13 -2.00 -3.39 132.00 135.55 3i4n h PRO 551 Ca -0.48 0.04 0.07 0.00 -0.87 0.00 0.00 66.00 64.76 3i4n h PRO 551 Cb 1.20 0.13 -0.08 0.00 0.13 0.00 0.00 31.00 32.38 3i4n h PRO 551 CO 0.67 -0.25 -0.29 -1.33 -0.23 0.00 0.00 178.00 176.57 3i4n n MET 552 N -5.20 -0.20 0.00 0.86 2.81 -1.26 -0.86 117.12 113.27 3i4n n MET 552 Ca -0.10 0.87 0.02 0.00 -1.81 0.00 0.00 57.70 56.68 3i4n n MET 552 Cb 0.29 -1.28 0.09 0.00 -0.71 0.00 0.00 33.22 31.61 3i4n n MET 552 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 3i4n n PRO 553 N -4.77 0.08 0.00 0.03 -0.04 -1.26 -0.30 135.00 128.75 3i4n n PRO 553 Ca 0.03 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 3i4n n PRO 553 Cb 0.18 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 3i4n n PRO 553 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 3i4n n ILE 554 N -1.08 0.00 0.23 0.52 5.41 -0.04 -3.87 119.36 120.54 3i4n n ILE 554 Ca 0.02 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.65 3i4n n ILE 554 Cb 0.01 -0.46 -0.07 0.00 -0.71 0.00 0.00 39.64 38.42 3i4n n ILE 554 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3i4n h ILE 555 N 0.00 0.27 0.40 1.39 2.04 -0.22 -2.48 117.51 118.91 3i4n h ILE 555 Ca 0.00 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.31 3i4n h ILE 555 Cb 0.57 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 3i4n h ILE 555 CO 0.00 0.05 -0.35 0.74 0.00 0.00 0.00 178.15 178.60 3i4n h THR 556 N -1.05 0.00 -1.89 -0.27 2.02 -0.92 -1.69 112.91 109.11 3i4n h THR 556 Ca -0.06 0.00 0.56 0.00 0.77 0.00 0.00 66.41 67.67 3i4n h THR 556 Cb 0.57 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.89 3i4n h THR 556 CO 0.11 0.00 1.34 0.15 0.37 0.00 0.00 175.52 177.49 3i4n h PHE 557 N -0.73 0.08 0.00 3.16 3.57 -1.67 -2.13 116.94 119.22 3i4n h PHE 557 Ca -0.05 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 3i4n h PHE 557 Cb 0.62 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.34 3i4n h PHE 557 CO -0.16 -0.04 -0.09 -0.07 -2.23 0.00 0.00 178.31 175.72 3i4n h LEU 558 N 0.00 0.00 -3.44 0.59 3.38 -0.84 -3.35 115.31 111.65 3i4n h LEU 558 Ca 0.93 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.68 3i4n h LEU 558 Cb 3.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 44.39 3i4n h LEU 558 CO -0.08 0.66 0.00 -1.54 0.09 0.00 0.00 178.44 177.57 3i4n n SER 559 N -4.72 1.55 -1.55 -0.43 3.41 -0.80 0.13 113.62 111.21 3i4n n SER 559 Ca -0.04 -1.32 -0.03 0.00 -0.26 0.00 0.00 58.87 57.23 3i4n n SER 559 Cb 0.15 -0.32 -0.00 0.00 -0.26 0.00 0.00 64.21 63.77 3i4n n SER 559 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3i4n n GLU 560 N 1.70 0.37 0.00 4.33 1.02 -1.23 -4.68 120.64 122.14 3i4n n GLU 560 Ca 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 57.16 55.65 3i4n n GLU 560 Cb 0.15 0.19 0.00 0.00 -0.02 0.00 0.00 31.44 31.77 3i4n n GLU 560 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 3i4n n TRP 561 N -0.18 0.00 0.00 -0.32 7.02 0.12 -5.01 117.44 119.07 3i4n n TRP 561 Ca -0.15 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.33 3i4n n TRP 561 Cb 0.85 0.03 0.00 0.00 -2.42 0.00 0.00 31.31 29.77 3i4n n TRP 561 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3i4n n GLY 562 N 0.00 0.74 3.31 6.99 0.00 -1.20 -5.01 105.19 110.02 3i4n n GLY 562 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 3i4n n GLY 562 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3i4n s MET 563 N 0.00 3.08 -0.33 1.61 0.00 -1.25 -3.91 119.30 118.51 3i4n s MET 563 Ca 0.00 -1.83 -0.28 0.00 0.00 0.00 0.00 55.69 53.58 3i4n s MET 563 Cb 0.00 -4.31 -0.02 0.00 0.00 0.00 0.00 34.83 30.50 3i4n s MET 563 CO 0.00 -1.32 1.77 -1.21 0.00 0.00 0.00 175.02 174.26 3i4n s GLU 564 N 1.37 3.37 -0.18 4.11 2.02 0.32 -4.71 118.70 125.00 3i4n s GLU 564 Ca 0.05 1.42 -0.34 0.00 0.02 0.00 0.00 54.97 56.12 3i4n s GLU 564 Cb -0.27 -4.18 -0.11 0.00 0.10 0.00 0.00 34.13 29.67 3i4n s GLU 564 CO 0.01 -1.82 1.98 -0.35 0.02 0.00 0.00 175.26 175.11 3i4n n PRO 565 N 8.39 1.84 -0.21 0.39 -0.04 -1.26 -1.65 135.00 142.46 3i4n n PRO 565 Ca 0.22 0.63 0.21 0.00 -0.04 0.00 0.00 63.50 64.53 3i4n n PRO 565 Cb 0.47 -2.64 0.33 0.00 -0.04 0.00 0.00 33.50 31.61 3i4n n PRO 565 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 3i4n n LEU 566 N 7.89 0.00 -0.35 1.53 7.94 -1.23 -0.60 117.00 132.19 3i4n n LEU 566 Ca 0.28 0.50 0.24 0.00 -1.11 0.00 0.00 56.01 55.92 3i4n n LEU 566 Cb 0.29 -0.20 0.49 0.00 0.53 0.00 0.00 43.42 44.53 3i4n n LEU 566 CO 0.74 -0.50 1.18 -0.33 -1.11 0.00 0.00 177.39 177.37 3i4n h GLU 567 N 0.00 0.38 -2.36 1.96 4.39 -1.90 -3.10 114.58 113.94 3i4n h GLU 567 Ca 0.37 -0.02 -0.60 0.00 0.34 0.00 0.00 59.36 59.45 3i4n h GLU 567 Cb 1.94 -0.08 -0.42 0.00 -0.10 0.00 0.00 28.75 30.09 3i4n h GLU 567 CO -0.00 0.25 -0.63 -0.25 -1.16 0.00 0.00 179.01 177.22 3i4n n ASP 568 N -4.80 3.31 -4.98 1.42 8.00 0.23 -4.98 116.55 114.77 3i4n n ASP 568 Ca 0.29 -3.33 -0.21 0.00 0.71 0.00 0.00 54.79 52.25 3i4n n ASP 568 Cb 0.94 -0.68 0.03 0.00 -0.02 0.00 0.00 41.12 41.38 3i4n n ASP 568 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3i4n s TYR 569 N -2.15 2.92 -0.31 1.24 5.04 -1.17 -4.92 117.35 118.00 3i4n s TYR 569 Ca 0.36 -0.04 0.05 0.00 -2.44 0.00 0.00 57.07 55.00 3i4n s TYR 569 Cb 0.11 -2.60 0.18 0.00 0.35 0.00 0.00 41.96 40.00 3i4n s TYR 569 CO -0.05 -0.69 0.51 0.14 -1.34 0.00 0.00 175.55 174.12 3i4n s VAL 570 N -2.65 -0.83 0.33 3.14 -7.23 -1.26 -5.05 120.40 106.85 3i4n s VAL 570 Ca 0.55 -0.16 0.08 0.00 -1.81 0.00 0.00 61.98 60.64 3i4n s VAL 570 Cb -0.10 -0.88 0.38 0.00 0.56 0.00 0.00 36.38 36.34 3i4n s VAL 570 CO 0.37 -0.14 1.59 1.55 -0.31 0.00 0.00 175.10 178.16 3i4n h PRO 571 N 7.92 0.04 0.00 4.82 0.13 -1.86 -1.80 132.00 141.24 3i4n h PRO 571 Ca -0.03 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 3i4n h PRO 571 Cb 1.16 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3i4n h PRO 571 CO 0.19 0.03 -0.44 1.12 -0.23 0.00 0.00 178.00 178.66 3i4n h HIS 572 N 0.04 0.00 -0.93 1.56 2.07 -1.92 -3.25 115.15 112.72 3i4n h HIS 572 Ca 0.68 0.00 0.18 0.00 -2.85 0.00 0.00 60.37 58.37 3i4n h HIS 572 Cb 1.56 0.00 -0.17 0.00 2.57 0.00 0.00 27.41 31.37 3i4n h HIS 572 CO -0.30 0.00 -0.27 0.37 -3.07 0.00 0.00 177.93 174.66 3i4n h GLN 573 N -0.98 -0.01 -3.48 5.12 4.15 -1.97 -2.15 115.11 115.79 3i4n h GLN 573 Ca 0.00 0.00 -0.70 0.00 0.77 0.00 0.00 58.65 58.72 3i4n h GLN 573 Cb 0.44 0.00 -0.35 0.00 0.21 0.00 0.00 27.48 27.79 3i4n h GLN 573 CO 0.00 -0.01 -0.24 -1.12 -1.93 0.00 0.00 178.83 175.54 3i4n s SER 574 N -5.27 5.60 0.00 -0.69 0.01 -0.68 -4.99 113.70 107.68 3i4n s SER 574 Ca -0.15 -3.20 0.00 0.00 1.31 0.00 0.00 55.95 53.92 3i4n s SER 574 Cb 0.24 -1.89 0.00 0.00 0.21 0.00 0.00 66.02 64.58 3i4n s SER 574 CO 0.75 -0.30 0.14 -0.81 0.41 0.00 0.00 173.24 173.43 3i4n n PRO 575 N 3.05 0.00 -1.14 12.44 -0.04 -0.81 -4.32 135.00 144.17 3i4n n PRO 575 Ca 0.14 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.34 3i4n n PRO 575 Cb 0.38 -0.53 -0.09 0.00 -0.04 0.00 0.00 33.50 33.22 3i4n n PRO 575 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3i4n n ASP 576 N -0.25 6.99 -3.85 3.54 8.00 -1.26 -4.91 116.55 124.81 3i4n n ASP 576 Ca 0.00 -2.51 0.00 0.00 0.71 0.00 0.00 54.79 52.99 3i4n n ASP 576 Cb 0.00 -1.47 0.00 0.00 -0.02 0.00 0.00 41.12 39.63 3i4n n ASP 576 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i4n n ALA 577 N 3.10 0.00 -2.70 2.24 0.00 -1.26 -5.02 120.51 116.87 3i4n n ALA 577 Ca 0.61 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.98 3i4n n ALA 577 Cb 0.54 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.10 3i4n n ALA 577 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3i4n n THR 578 N -0.45 0.12 -0.42 0.00 -1.04 -1.21 -4.93 114.28 106.34 3i4n n THR 578 Ca 0.00 -1.68 -0.16 0.00 -2.04 0.00 0.00 64.05 60.16 3i4n n THR 578 Cb 0.00 0.96 -0.02 0.00 -1.82 0.00 0.00 70.33 69.45 3i4n n THR 578 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 3i4n n ARG 579 N -0.54 0.00 -3.44 -2.82 1.85 -1.26 -4.12 116.66 106.33 3i4n n ARG 579 Ca -0.02 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.45 3i4n n ARG 579 Cb 0.85 -0.39 -0.06 0.00 -1.05 0.00 0.00 32.46 31.81 3i4n n ARG 579 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3i4n s VAL 580 N 0.33 4.95 -0.08 8.89 1.01 0.85 -2.22 120.40 134.13 3i4n s VAL 580 Ca 0.25 0.94 0.04 0.00 0.00 0.00 0.00 61.98 63.21 3i4n s VAL 580 Cb -0.36 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.27 3i4n s VAL 580 CO 0.18 0.57 -0.21 -0.36 0.00 0.00 0.00 175.10 175.27 3i4n s PHE 581 N -1.09 2.26 -0.06 5.22 2.99 0.57 -3.00 117.98 124.88 3i4n s PHE 581 Ca 0.25 -0.86 -0.01 0.00 0.00 0.00 0.00 56.93 56.31 3i4n s PHE 581 Cb -0.17 -1.53 0.03 0.00 0.00 0.00 0.00 43.02 41.35 3i4n s PHE 581 CO 0.15 -0.34 0.00 0.08 -0.00 0.00 0.00 175.22 175.11 3i4n s VAL 582 N 0.31 0.30 -1.35 -0.44 1.01 -0.75 0.24 120.40 119.73 3i4n s VAL 582 Ca -0.15 0.12 -0.10 0.00 0.00 0.00 0.00 61.98 61.85 3i4n s VAL 582 Cb -0.16 -0.44 0.08 0.00 0.00 0.00 0.00 36.38 35.85 3i4n s VAL 582 CO 0.07 0.22 0.55 0.59 0.00 0.00 0.00 175.10 176.53 3i4n n ASN 583 N 4.82 -3.84 -2.28 3.32 4.13 0.40 -0.73 115.26 121.10 3i4n n ASN 583 Ca -0.13 -0.46 -0.14 0.00 1.68 0.00 0.00 54.58 55.52 3i4n n ASN 583 Cb 0.50 -3.16 0.04 0.00 -1.54 0.00 0.00 39.78 35.62 3i4n n ASN 583 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3i4n n GLY 584 N -1.24 0.01 2.98 7.41 0.00 -1.26 -4.93 105.19 108.16 3i4n n GLY 584 Ca -0.01 -0.14 -0.19 0.00 0.00 0.00 0.00 46.02 45.69 3i4n n GLY 584 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i4n s VAL 585 N -3.12 0.65 -0.87 1.61 1.01 0.09 -4.82 120.40 114.96 3i4n s VAL 585 Ca 0.31 -0.31 -0.21 0.00 0.00 0.00 0.00 61.98 61.78 3i4n s VAL 585 Cb -0.14 -0.58 0.10 0.00 0.00 0.00 0.00 36.38 35.76 3i4n s VAL 585 CO 0.39 0.20 1.15 0.86 0.00 0.00 0.00 175.10 177.70 3i4n s TRP 586 N 0.11 2.86 -2.20 5.22 -0.11 -1.26 -1.81 118.94 121.75 3i4n s TRP 586 Ca -0.01 -1.02 0.21 0.00 1.22 0.00 0.00 56.10 56.50 3i4n s TRP 586 Cb -0.07 -4.37 0.93 0.00 -1.50 0.00 0.00 33.47 28.46 3i4n s TRP 586 CO 0.00 -1.64 1.64 0.72 -4.62 0.00 0.00 176.95 173.05 3i4n n HIS 587 N 7.39 0.12 0.00 5.86 8.25 -1.16 -4.81 115.22 130.87 3i4n n HIS 587 Ca 0.17 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 3i4n n HIS 587 Cb 0.48 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.59 3i4n n HIS 587 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i4n n GLY 588 N 1.02 0.70 3.15 -1.41 0.00 -1.26 -3.47 105.19 103.92 3i4n n GLY 588 Ca 0.16 -2.06 -0.10 0.00 0.00 0.00 0.00 46.02 44.02 3i4n n GLY 588 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i4n s VAL 589 N -1.44 0.12 0.04 1.61 1.01 -0.66 -0.11 120.40 120.98 3i4n s VAL 589 Ca 0.00 -1.91 0.02 0.00 0.00 0.00 0.00 61.98 60.09 3i4n s VAL 589 Cb 0.00 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 3i4n s VAL 589 CO 0.00 -0.47 -0.07 -2.28 0.00 0.00 0.00 175.10 172.28 3i4n s HIS 590 N -4.04 0.59 0.00 5.22 5.04 -1.25 0.12 115.29 120.97 3i4n s HIS 590 Ca 0.24 -0.50 0.00 0.00 -1.54 0.00 0.00 55.06 53.26 3i4n s HIS 590 Cb 0.07 -0.36 0.00 0.00 0.04 0.00 0.00 32.58 32.34 3i4n s HIS 590 CO 0.02 -0.10 0.00 0.54 -2.34 0.00 0.00 174.74 172.85 3i4n n ARG 591 N 1.51 3.26 -1.29 2.88 1.74 -1.25 -3.35 116.66 120.16 3i4n n ARG 591 Ca -0.23 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.54 3i4n n ARG 591 Cb 0.55 0.00 -0.15 0.00 -1.02 0.00 0.00 32.46 31.84 3i4n n ARG 591 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3i4n n ASN 592 N 0.00 -0.15 0.04 0.55 2.85 -1.26 -4.71 115.26 112.58 3i4n n ASN 592 Ca 0.00 -0.01 0.11 0.00 -0.11 0.00 0.00 54.58 54.57 3i4n n ASN 592 Cb 0.00 -0.70 -0.04 0.00 1.24 0.00 0.00 39.78 40.28 3i4n n ASN 592 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3i4n n PRO 593 N 6.61 0.48 -0.26 1.20 -0.04 -1.26 -4.25 135.00 137.48 3i4n n PRO 593 Ca 0.57 -0.02 0.24 0.00 -0.04 0.00 0.00 63.50 64.25 3i4n n PRO 593 Cb 0.05 -1.64 0.42 0.00 -0.04 0.00 0.00 33.50 32.29 3i4n n PRO 593 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3i4n n ALA 594 N -2.04 0.78 -0.09 0.55 0.00 -1.26 0.21 120.51 118.67 3i4n n ALA 594 Ca -0.00 0.64 -0.09 0.00 0.00 0.00 0.00 53.44 53.99 3i4n n ALA 594 Cb 0.50 -0.69 -0.14 0.00 0.00 0.00 0.00 19.45 19.12 3i4n n ALA 594 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3i4n n ARG 595 N -4.30 1.14 -0.38 0.00 1.74 -1.26 -4.22 116.66 109.37 3i4n n ARG 595 Ca 0.26 -0.01 0.30 0.00 -0.77 0.00 0.00 57.85 57.64 3i4n n ARG 595 Cb 0.94 -1.45 0.58 0.00 -1.02 0.00 0.00 32.46 31.51 3i4n n ARG 595 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3i4n h LEU 596 N 0.00 0.35 0.30 0.55 5.85 0.24 0.69 115.31 123.29 3i4n h LEU 596 Ca -0.47 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.36 3i4n h LEU 596 Cb 2.07 0.10 0.00 0.00 0.37 0.00 0.00 40.66 43.20 3i4n h LEU 596 CO 0.02 -0.10 -0.15 -0.03 -0.34 0.00 0.00 178.44 177.85 3i4n h MET 597 N 0.22 -0.39 -1.46 1.25 4.05 -1.23 -2.33 114.93 115.03 3i4n h MET 597 Ca 0.74 0.03 0.44 0.00 -0.28 0.00 0.00 59.70 60.63 3i4n h MET 597 Cb 2.09 0.09 -0.10 0.00 -0.80 0.00 0.00 31.60 32.88 3i4n h MET 597 CO -0.42 -0.05 1.00 1.49 0.23 0.00 0.00 176.91 179.16 3i4n h GLU 598 N -0.87 0.07 0.20 0.39 4.81 0.13 0.84 114.58 120.15 3i4n h GLU 598 Ca -0.04 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 3i4n h GLU 598 Cb 0.52 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.89 3i4n h GLU 598 CO 0.07 0.05 -0.10 1.15 -0.73 0.00 0.00 179.01 179.45 3i4n h THR 599 N 0.07 0.00 -0.95 0.32 2.02 -0.91 -2.89 112.91 110.57 3i4n h THR 599 Ca 0.79 -0.44 0.24 0.00 0.77 0.00 0.00 66.41 67.77 3i4n h THR 599 Cb 2.77 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 69.11 3i4n h THR 599 CO -0.22 0.00 0.64 -0.07 0.37 0.00 0.00 175.52 176.24 3i4n h LEU 600 N -0.71 0.29 0.00 2.58 3.38 -0.36 -0.44 115.31 120.05 3i4n h LEU 600 Ca -0.03 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3i4n h LEU 600 Cb 0.21 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3i4n h LEU 600 CO 0.05 0.10 0.00 0.54 0.09 0.00 0.00 178.44 179.21 3i4n n ARG 601 N -4.46 0.00 0.00 1.13 1.74 0.27 -2.69 116.66 112.65 3i4n n ARG 601 Ca 0.21 0.24 0.01 0.00 -0.77 0.00 0.00 57.85 57.54 3i4n n ARG 601 Cb 0.83 -1.15 0.05 0.00 -1.02 0.00 0.00 32.46 31.17 3i4n n ARG 601 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3i4n n THR 602 N -1.23 0.00 0.06 0.55 -1.04 -1.09 0.42 114.28 111.95 3i4n n THR 602 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 3i4n n THR 602 Cb 0.00 -0.73 -0.06 0.00 -1.82 0.00 0.00 70.33 67.72 3i4n n THR 602 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3i4n h LEU 603 N 0.00 0.00 0.02 -4.42 7.12 -0.86 -3.19 115.31 113.98 3i4n h LEU 603 Ca 0.00 0.00 -0.21 0.00 0.13 0.00 0.00 57.88 57.80 3i4n h LEU 603 Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.11 3i4n h LEU 603 CO 0.00 0.66 -1.16 -0.09 -0.13 0.00 0.00 178.44 177.72 3i4n h ARG 604 N 0.00 0.05 0.00 1.25 2.43 0.13 -2.67 114.38 115.57 3i4n h ARG 604 Ca -0.11 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 3i4n h ARG 604 Cb 1.60 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 31.18 3i4n h ARG 604 CO 0.07 1.04 0.00 0.54 -1.51 0.00 0.00 179.97 180.11 3i4n n ARG 605 N -4.33 0.00 -0.05 0.20 1.74 -1.01 -1.01 116.66 112.21 3i4n n ARG 605 Ca -0.28 0.03 -0.04 0.00 -0.77 0.00 0.00 57.85 56.79 3i4n n ARG 605 Cb 0.71 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.63 3i4n n ARG 605 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 3i4n n LYS 606 N -0.99 0.29 0.00 5.56 4.81 -1.21 -2.26 118.16 124.37 3i4n n LYS 606 Ca 0.00 0.29 0.00 0.00 -0.87 0.00 0.00 58.31 57.73 3i4n n LYS 606 Cb 0.00 -1.20 0.00 0.00 0.02 0.00 0.00 35.03 33.85 3i4n n LYS 606 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3i4n n GLY 607 N 1.58 0.53 0.30 3.14 0.00 -0.18 -4.65 105.19 105.92 3i4n n GLY 607 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.90 3i4n n GLY 607 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3i4n n ASP 608 N 0.00 1.47 -4.65 1.61 2.03 -1.01 -4.89 116.55 111.11 3i4n n ASP 608 Ca 0.00 0.24 -0.40 0.00 0.52 0.00 0.00 54.79 55.15 3i4n n ASP 608 Cb 0.00 -0.61 -0.06 0.00 -0.72 0.00 0.00 41.12 39.73 3i4n n ASP 608 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 3i4n s ILE 609 N -2.43 5.03 -0.09 5.18 -4.36 -1.18 -4.97 121.20 118.38 3i4n s ILE 609 Ca -0.19 1.14 -0.29 0.00 -0.26 0.00 0.00 60.65 61.05 3i4n s ILE 609 Cb 0.03 -3.93 -0.14 0.00 1.25 0.00 0.00 42.46 39.67 3i4n s ILE 609 CO 0.28 0.10 0.83 -3.20 0.24 0.00 0.00 174.94 173.20 3i4n n ASN 610 N 5.16 0.22 0.00 4.36 2.85 -1.26 -4.28 115.26 122.31 3i4n n ASN 610 Ca -0.02 0.80 0.02 0.00 -0.11 0.00 0.00 54.58 55.27 3i4n n ASN 610 Cb 0.50 -0.62 0.09 0.00 1.24 0.00 0.00 39.78 40.98 3i4n n ASN 610 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 3i4n n PRO 611 N 1.50 0.16 -0.09 1.20 -0.02 -1.26 -2.70 135.00 133.79 3i4n n PRO 611 Ca 0.16 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.55 3i4n n PRO 611 Cb 0.03 -1.29 -0.03 0.00 -0.02 0.00 0.00 33.50 32.19 3i4n n PRO 611 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3i4n n GLU 612 N -0.79 0.52 -1.46 -0.52 2.13 -1.26 -4.09 120.64 115.17 3i4n n GLU 612 Ca 0.02 0.25 -0.48 0.00 0.66 0.00 0.00 57.16 57.62 3i4n n GLU 612 Cb 0.01 -1.46 -0.03 0.00 0.27 0.00 0.00 31.44 30.23 3i4n n GLU 612 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3i4n n VAL 613 N -4.48 1.84 -3.82 6.31 0.31 -1.10 -4.84 118.33 112.55 3i4n n VAL 613 Ca -0.13 -0.46 -0.22 0.00 -0.01 0.00 0.00 64.34 63.52 3i4n n VAL 613 Cb 0.49 -0.30 -0.05 0.00 -0.91 0.00 0.00 33.84 33.07 3i4n n VAL 613 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3i4n s SER 614 N -0.78 4.89 -0.29 4.52 1.04 -0.65 -4.96 113.70 117.47 3i4n s SER 614 Ca 0.64 -0.78 -0.16 0.00 0.48 0.00 0.00 55.95 56.14 3i4n s SER 614 Cb -0.88 -0.64 0.14 0.00 0.10 0.00 0.00 66.02 64.73 3i4n s SER 614 CO 0.57 -0.52 0.91 0.00 0.98 0.00 0.00 173.24 175.18 3i4n s MET 615 N -4.01 0.44 -0.03 4.02 0.23 -1.26 -1.01 119.30 117.68 3i4n s MET 615 Ca 0.44 0.80 0.05 0.00 -1.03 0.00 0.00 55.69 55.94 3i4n s MET 615 Cb -0.02 0.16 -0.01 0.00 -1.53 0.00 0.00 34.83 33.43 3i4n s MET 615 CO 0.26 -0.10 -0.17 0.42 -2.03 0.00 0.00 175.02 173.40 3i4n s ILE 616 N 1.57 1.37 -0.41 3.16 1.09 -0.62 -4.87 121.20 122.49 3i4n s ILE 616 Ca -0.08 -0.71 -0.10 0.00 -1.10 0.00 0.00 60.65 58.66 3i4n s ILE 616 Cb -0.04 -1.15 0.07 0.00 -1.06 0.00 0.00 42.46 40.27 3i4n s ILE 616 CO -0.16 0.39 0.25 -0.60 -0.10 0.00 0.00 174.94 174.71 3i4n s ARG 617 N -0.21 2.66 -1.10 2.79 3.52 -1.26 -1.77 118.95 123.57 3i4n s ARG 617 Ca 0.02 -1.37 -0.15 0.00 -0.13 0.00 0.00 55.73 54.10 3i4n s ARG 617 Cb -0.09 -3.77 0.17 0.00 -1.56 0.00 0.00 34.95 29.71 3i4n s ARG 617 CO 0.00 -0.89 1.28 0.34 -0.81 0.00 0.00 175.30 175.22 3i4n s ASP 618 N 1.99 6.96 0.14 -2.12 -1.08 -0.81 -4.87 116.67 116.88 3i4n s ASP 618 Ca 0.03 -2.77 -0.29 0.00 -0.52 0.00 0.00 52.55 48.99 3i4n s ASP 618 Cb -0.22 -2.37 -0.04 0.00 -1.46 0.00 0.00 42.92 38.82 3i4n s ASP 618 CO 0.03 -0.78 1.57 0.40 0.52 0.00 0.00 175.17 176.91 3i4n h ILE 619 N 4.90 0.09 -1.01 4.11 2.04 -1.94 1.01 117.51 126.72 3i4n h ILE 619 Ca 0.25 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.29 3i4n h ILE 619 Cb 0.92 0.09 -0.11 0.00 -0.74 0.00 0.00 36.82 36.99 3i4n h ILE 619 CO 1.16 0.00 0.61 0.03 0.00 0.00 0.00 178.15 179.95 3i4n h ARG 620 N -0.41 0.76 0.00 2.37 3.08 -1.98 -0.06 114.38 118.14 3i4n h ARG 620 Ca 0.10 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3i4n h ARG 620 Cb 0.61 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3i4n h ARG 620 CO -0.52 0.50 -0.99 -1.91 -1.07 0.00 0.00 179.97 175.98 3i4n n GLU 621 N -4.75 0.45 -2.77 0.04 4.07 -0.87 -5.02 120.64 111.79 3i4n n GLU 621 Ca 0.23 0.06 -0.02 0.00 -0.06 0.00 0.00 57.16 57.37 3i4n n GLU 621 Cb 0.56 -1.71 0.01 0.00 -0.06 0.00 0.00 31.44 30.24 3i4n n GLU 621 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 3i4n n LYS 622 N -2.33 -1.17 -3.75 5.31 5.02 0.34 -5.05 118.16 116.53 3i4n n LYS 622 Ca 0.01 1.20 -0.14 0.00 -2.02 0.00 0.00 58.31 57.37 3i4n n LYS 622 Cb 0.50 -4.93 -0.08 0.00 -0.02 0.00 0.00 35.03 30.50 3i4n n LYS 622 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3i4n s GLU 623 N -3.18 0.69 -0.28 1.97 2.02 -1.10 -4.08 118.70 114.75 3i4n s GLU 623 Ca 0.06 -0.17 0.02 0.00 0.02 0.00 0.00 54.97 54.89 3i4n s GLU 623 Cb -0.01 0.31 0.08 0.00 0.10 0.00 0.00 34.13 34.61 3i4n s GLU 623 CO 0.60 -0.19 -0.02 -1.17 0.02 0.00 0.00 175.26 174.49 3i4n s LEU 624 N -1.34 3.39 0.11 1.80 2.96 -0.94 -1.92 118.68 122.74 3i4n s LEU 624 Ca -0.13 -1.57 -0.18 0.00 -0.22 0.00 0.00 54.13 52.03 3i4n s LEU 624 Cb -0.05 -1.37 -0.07 0.00 0.50 0.00 0.00 46.19 45.21 3i4n s LEU 624 CO 0.04 -0.29 0.57 -0.54 -1.32 0.00 0.00 176.35 174.82 3i4n s LYS 625 N 1.20 4.13 -0.17 1.98 -0.14 -0.73 0.21 119.74 126.23 3i4n s LYS 625 Ca -0.00 0.67 -0.04 0.00 -1.36 0.00 0.00 55.97 55.23 3i4n s LYS 625 Cb -0.19 -3.12 0.08 0.00 -1.68 0.00 0.00 37.83 32.92 3i4n s LYS 625 CO -0.09 0.57 0.23 0.42 -0.76 0.00 0.00 175.35 175.73 3i4n s ILE 626 N -1.25 -0.35 -0.37 2.17 1.01 0.14 -1.59 121.20 120.95 3i4n s ILE 626 Ca 0.33 0.07 -0.01 0.00 0.00 0.00 0.00 60.65 61.04 3i4n s ILE 626 Cb -0.18 -0.56 0.10 0.00 0.01 0.00 0.00 42.46 41.83 3i4n s ILE 626 CO 0.19 -0.05 0.13 -0.36 0.00 0.00 0.00 174.94 174.85 3i4n s PHE 627 N 2.36 3.55 -0.68 3.97 2.99 -0.18 0.15 117.98 130.14 3i4n s PHE 627 Ca 0.05 -2.41 0.25 0.00 0.00 0.00 0.00 56.93 54.82 3i4n s PHE 627 Cb -0.14 -2.93 0.50 0.00 0.00 0.00 0.00 43.02 40.45 3i4n s PHE 627 CO -0.10 -0.93 1.47 -2.37 -0.00 0.00 0.00 175.22 173.28 3i4n n THR 628 N 4.54 0.42 -0.27 0.64 5.66 -1.26 -1.64 114.28 122.36 3i4n n THR 628 Ca -0.03 -0.27 -0.10 0.00 -3.05 0.00 0.00 64.05 60.60 3i4n n THR 628 Cb 0.42 -0.26 0.01 0.00 -1.55 0.00 0.00 70.33 68.95 3i4n n THR 628 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 3i4n n ASP 629 N -2.13 -1.49 -4.11 1.09 2.03 -1.26 -1.80 116.55 108.87 3i4n n ASP 629 Ca 0.04 0.04 -0.33 0.00 0.52 0.00 0.00 54.79 55.06 3i4n n ASP 629 Cb 0.43 -0.19 -0.16 0.00 -0.72 0.00 0.00 41.12 40.48 3i4n n ASP 629 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3i4n s ALA 630 N -0.54 2.37 0.00 -1.67 0.00 -1.26 -4.18 121.76 116.48 3i4n s ALA 630 Ca 0.11 -1.32 0.00 0.00 0.00 0.00 0.00 51.96 50.75 3i4n s ALA 630 Cb -0.04 -1.25 0.00 0.00 0.00 0.00 0.00 23.12 21.83 3i4n s ALA 630 CO 0.21 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.88 3i4n n GLY 631 N 4.59 1.32 3.39 0.00 0.00 0.14 -4.87 105.19 109.75 3i4n n GLY 631 Ca -0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 3i4n n GLY 631 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i4n s ARG 632 N 0.00 2.25 -0.01 1.61 0.52 -1.26 -1.77 118.95 120.30 3i4n s ARG 632 Ca 0.00 -0.85 -0.15 0.00 -0.52 0.00 0.00 55.73 54.22 3i4n s ARG 632 Cb 0.00 -2.19 -0.06 0.00 0.52 0.00 0.00 34.95 33.23 3i4n s ARG 632 CO 0.00 0.58 0.41 0.08 0.02 0.00 0.00 175.30 176.39 3i4n s VAL 633 N -0.69 5.04 0.13 3.52 1.01 -1.26 -0.70 120.40 127.45 3i4n s VAL 633 Ca 0.11 0.84 -0.16 0.00 0.00 0.00 0.00 61.98 62.77 3i4n s VAL 633 Cb -0.10 -3.71 0.03 0.00 0.00 0.00 0.00 36.38 32.60 3i4n s VAL 633 CO 0.00 0.57 0.40 -0.72 0.00 0.00 0.00 175.10 175.35 3i4n s TYR 634 N -1.00 -0.18 0.18 5.22 -0.85 -0.66 -3.35 117.35 116.72 3i4n s TYR 634 Ca 0.24 -0.15 0.01 0.00 -0.52 0.00 0.00 57.07 56.65 3i4n s TYR 634 Cb -0.17 0.25 -0.01 0.00 0.38 0.00 0.00 41.96 42.42 3i4n s TYR 634 CO 0.13 -0.71 0.05 2.89 -1.52 0.00 0.00 175.55 176.39 3i4n n ARG 635 N -0.23 0.89 -4.20 -3.49 1.85 -1.19 -1.42 116.66 108.87 3i4n n ARG 635 Ca -0.15 -1.45 -0.32 0.00 -1.00 0.00 0.00 57.85 54.93 3i4n n ARG 635 Cb 0.64 0.73 -0.08 0.00 -1.05 0.00 0.00 32.46 32.70 3i4n n ARG 635 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 3i4n s PRO 636 N -2.66 2.79 -0.07 2.89 0.04 -1.26 -1.63 135.00 135.09 3i4n s PRO 636 Ca 0.07 -0.65 -0.04 0.00 0.04 0.00 0.00 61.00 60.42 3i4n s PRO 636 Cb 0.00 -2.68 0.03 0.00 0.04 0.00 0.00 34.50 31.90 3i4n s PRO 636 CO 0.05 0.60 0.18 -0.51 0.04 0.00 0.00 177.00 177.36 3i4n s LEU 637 N -1.84 0.83 0.09 -3.56 1.43 -0.52 -4.59 118.68 110.51 3i4n s LEU 637 Ca 0.23 0.36 -0.31 0.00 -1.03 0.00 0.00 54.13 53.38 3i4n s LEU 637 Cb -0.12 0.51 -0.10 0.00 0.03 0.00 0.00 46.19 46.51 3i4n s LEU 637 CO 0.14 -0.13 1.89 0.49 0.23 0.00 0.00 176.35 178.98 3i4n n PHE 638 N 3.86 2.58 -2.34 0.29 0.99 -0.22 -2.55 117.46 120.07 3i4n n PHE 638 Ca -0.22 -0.23 -0.42 0.00 -0.00 0.00 0.00 57.45 56.57 3i4n n PHE 638 Cb 0.54 -2.76 -0.03 0.00 -1.00 0.00 0.00 39.48 36.24 3i4n n PHE 638 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 3i4n s ILE 639 N 3.41 4.04 -0.61 4.37 1.01 -0.73 -0.82 121.20 131.87 3i4n s ILE 639 Ca 0.85 1.35 0.03 0.00 0.00 0.00 0.00 60.65 62.87 3i4n s ILE 639 Cb -0.47 -3.87 0.38 0.00 0.01 0.00 0.00 42.46 38.52 3i4n s ILE 639 CO 0.39 -0.04 1.41 0.52 0.00 0.00 0.00 174.94 177.23 3i4n n VAL 640 N 4.87 3.04 -2.16 2.92 0.31 0.10 0.10 118.33 127.52 3i4n n VAL 640 Ca 0.13 -4.88 -0.41 0.00 -0.01 0.00 0.00 64.34 59.17 3i4n n VAL 640 Cb 0.45 -1.29 -0.03 0.00 -0.91 0.00 0.00 33.84 32.06 3i4n n VAL 640 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3i4n s GLU 641 N -3.74 4.38 0.00 5.55 0.41 -1.25 -4.03 118.70 120.02 3i4n s GLU 641 Ca 0.49 2.15 0.00 0.00 -0.41 0.00 0.00 54.97 57.20 3i4n s GLU 641 Cb 0.39 -3.11 0.00 0.00 -1.78 0.00 0.00 34.13 29.63 3i4n s GLU 641 CO -0.25 -0.18 0.44 -0.40 -0.49 0.00 0.00 175.26 174.38 3i4n n ASP 642 N 1.34 1.30 -2.09 -0.19 5.75 -1.26 -3.41 116.55 117.99 3i4n n ASP 642 Ca 0.02 -0.88 -0.03 0.00 -0.01 0.00 0.00 54.79 53.89 3i4n n ASP 642 Cb 0.42 -0.23 -0.04 0.00 -1.03 0.00 0.00 41.12 40.25 3i4n n ASP 642 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3i4n n ASP 643 N 0.88 1.99 -3.78 -1.12 8.00 -1.26 -4.50 116.55 116.77 3i4n n ASP 643 Ca 0.00 -1.72 -0.30 0.00 0.71 0.00 0.00 54.79 53.48 3i4n n ASP 643 Cb 0.20 -0.49 -0.14 0.00 -0.02 0.00 0.00 41.12 40.68 3i4n n ASP 643 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3i4n s GLU 644 N 1.81 1.35 0.33 -1.24 2.56 -1.15 -4.93 118.70 117.42 3i4n s GLU 644 Ca 0.14 -1.98 0.06 0.00 0.00 0.00 0.00 54.97 53.19 3i4n s GLU 644 Cb 0.07 -2.54 0.70 0.00 2.00 0.00 0.00 34.13 34.36 3i4n s GLU 644 CO 0.00 -1.11 1.87 0.66 -0.56 0.00 0.00 175.26 176.12 3i4n h SER 645 N 6.95 0.76 -1.40 -1.70 4.64 -1.85 -2.83 113.55 118.13 3i4n h SER 645 Ca -0.04 0.04 -0.75 0.00 -0.47 0.00 0.00 61.79 60.57 3i4n h SER 645 Cb 0.94 -0.12 -0.15 0.00 -0.31 0.00 0.00 62.40 62.77 3i4n h SER 645 CO 0.52 0.41 2.00 0.18 -0.87 0.00 0.00 176.83 179.07 3i4n n LEU 646 N -4.57 6.43 0.00 5.97 4.77 -1.26 -4.81 117.00 123.53 3i4n n LEU 646 Ca 0.17 -4.58 0.00 0.00 -0.03 0.00 0.00 56.01 51.58 3i4n n LEU 646 Cb 0.40 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 39.97 3i4n n LEU 646 CO 0.29 1.25 0.00 0.61 -1.33 0.00 0.00 177.39 178.21 3i4n n GLY 647 N 3.11 0.71 0.00 -0.72 0.00 -1.07 -5.07 105.19 102.14 3i4n n GLY 647 Ca 0.40 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.76 3i4n n GLY 647 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3i4n n HIS 648 N 0.00 0.00 -3.54 1.61 1.44 -1.21 -4.98 115.22 108.54 3i4n n HIS 648 Ca 0.00 0.00 -0.24 0.00 -2.01 0.00 0.00 57.72 55.47 3i4n n HIS 648 Cb 0.00 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.09 3i4n n HIS 648 CO 0.00 0.00 0.00 0.21 -2.81 0.00 0.00 176.34 173.74 3i4n s LYS 649 N 3.01 3.49 0.00 -1.40 2.20 -1.26 -2.93 119.74 122.85 3i4n s LYS 649 Ca 0.00 -0.39 0.00 0.00 -0.36 0.00 0.00 55.97 55.22 3i4n s LYS 649 Cb 0.00 -2.73 0.00 0.00 -1.51 0.00 0.00 37.83 33.59 3i4n s LYS 649 CO 0.00 0.25 0.00 -1.91 -0.36 0.00 0.00 175.35 173.33 3i4n n GLU 650 N -1.45 0.00 -1.64 4.03 4.07 -1.22 -4.91 120.64 119.52 3i4n n GLU 650 Ca -0.05 0.00 -0.54 0.00 -0.06 0.00 0.00 57.16 56.51 3i4n n GLU 650 Cb 0.56 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.87 3i4n n GLU 650 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 3i4n n LEU 651 N 0.00 2.10 -1.80 4.31 4.77 -1.26 -3.76 117.00 121.36 3i4n n LEU 651 Ca 0.00 1.09 -0.01 0.00 -0.03 0.00 0.00 56.01 57.06 3i4n n LEU 651 Cb 0.00 -1.19 -0.02 0.00 -2.33 0.00 0.00 43.42 39.88 3i4n n LEU 651 CO 0.00 -0.72 0.67 1.17 -1.33 0.00 0.00 177.39 177.17 3i4n n LYS 652 N 3.85 0.67 -3.65 3.23 4.81 0.29 -4.56 118.16 122.80 3i4n n LYS 652 Ca 0.22 -0.09 -0.15 0.00 -0.87 0.00 0.00 58.31 57.41 3i4n n LYS 652 Cb 0.18 -1.31 -0.08 0.00 0.02 0.00 0.00 35.03 33.84 3i4n n LYS 652 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3i4n s VAL 653 N 1.02 0.02 0.23 3.15 1.01 -1.26 -4.56 120.40 120.00 3i4n s VAL 653 Ca 0.06 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 61.95 3i4n s VAL 653 Cb 0.03 -0.81 -0.05 0.00 0.00 0.00 0.00 36.38 35.55 3i4n s VAL 653 CO 0.00 -0.07 0.00 -0.13 0.00 0.00 0.00 175.10 174.90 3i4n s ARG 654 N -0.67 1.31 0.59 2.72 1.81 -1.26 -4.71 118.95 118.74 3i4n s ARG 654 Ca -0.08 -1.66 0.11 0.00 -1.72 0.00 0.00 55.73 52.38 3i4n s ARG 654 Cb -0.03 -0.55 0.59 0.00 -0.45 0.00 0.00 34.95 34.51 3i4n s ARG 654 CO 0.05 -0.11 1.29 -0.22 -0.68 0.00 0.00 175.30 175.63 3i4n h LYS 655 N 2.49 0.00 0.38 3.54 1.63 -0.99 0.56 116.57 124.19 3i4n h LYS 655 Ca -0.38 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.40 3i4n h LYS 655 Cb 1.22 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.86 3i4n h LYS 655 CO 0.64 0.00 -0.18 0.78 -3.45 0.00 0.00 179.45 177.24 3i4n h GLY 656 N 0.00 -0.54 -0.90 5.01 0.00 -1.79 -2.34 103.07 102.51 3i4n h GLY 656 Ca 0.00 0.20 0.26 0.00 0.00 0.00 0.00 47.33 47.79 3i4n h GLY 656 CO 0.00 -0.20 0.03 0.45 0.00 0.00 0.00 176.54 176.82 3i4n h HIS 657 N -1.07 -0.04 0.00 5.60 3.86 -0.10 0.25 115.15 123.64 3i4n h HIS 657 Ca -0.05 0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 3i4n h HIS 657 Cb 0.39 0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.04 3i4n h HIS 657 CO 0.01 -0.41 0.00 -0.89 0.86 0.00 0.00 177.93 177.50 3i4n n ILE 658 N -5.47 0.00 0.33 2.45 5.41 -1.06 -0.64 119.36 120.38 3i4n n ILE 658 Ca 0.22 1.45 0.14 0.00 1.00 0.00 0.00 62.75 65.56 3i4n n ILE 658 Cb 0.73 -2.32 0.77 0.00 -0.71 0.00 0.00 39.64 38.11 3i4n n ILE 658 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4n h ALA 659 N -1.78 1.37 0.00 -1.39 0.00 -0.81 0.83 119.26 117.49 3i4n h ALA 659 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3i4n h ALA 659 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3i4n h ALA 659 CO 0.00 -0.37 -0.79 -0.22 0.00 0.00 0.00 179.25 177.87 3i4n h LYS 660 N 0.00 0.00 0.00 0.00 3.64 -0.14 -2.64 116.57 117.42 3i4n h LYS 660 Ca 0.00 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 3i4n h LYS 660 Cb 0.74 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 3i4n h LYS 660 CO 0.00 0.71 -0.68 -0.07 -2.27 0.00 0.00 179.45 177.14 3i4n h LEU 661 N 0.00 0.00 -2.18 5.20 3.38 0.29 -3.28 115.31 118.72 3i4n h LEU 661 Ca -0.02 -0.70 0.01 0.00 0.09 0.00 0.00 57.88 57.25 3i4n h LEU 661 Cb 1.58 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.33 3i4n h LEU 661 CO 0.09 1.25 0.28 0.24 0.09 0.00 0.00 178.44 180.39 3i4n h MET 662 N -1.00 0.00 -0.92 1.13 2.86 -0.64 0.96 114.93 117.32 3i4n h MET 662 Ca -0.19 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.49 3i4n h MET 662 Cb 1.14 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.74 3i4n h MET 662 CO -0.11 0.00 0.60 0.00 1.06 0.00 0.00 176.91 178.46 3i4n h ALA 663 N 1.47 1.22 0.00 6.32 0.00 -1.53 -0.95 119.26 125.79 3i4n h ALA 663 Ca 0.01 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3i4n h ALA 663 Cb 0.57 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3i4n h ALA 663 CO -0.00 0.47 -0.54 1.15 0.00 0.00 0.00 179.25 180.33 3i4n h THR 664 N 1.17 0.62 0.00 0.00 2.02 0.79 -3.02 112.91 114.49 3i4n h THR 664 Ca 0.37 -1.91 -0.04 0.00 0.77 0.00 0.00 66.41 65.60 3i4n h THR 664 Cb -0.01 2.26 -0.01 0.00 -1.74 0.00 0.00 68.15 68.65 3i4n h THR 664 CO -0.12 0.35 -0.17 -0.33 0.37 0.00 0.00 175.52 175.62 3i4n h GLU 665 N 0.00 0.00 0.02 6.66 5.08 -0.59 0.33 114.58 126.07 3i4n h GLU 665 Ca -0.02 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3i4n h GLU 665 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 3i4n h GLU 665 CO 0.05 0.17 -0.01 -0.92 -1.00 0.00 0.00 179.01 177.30 3i4n h TYR 666 N 0.00 -0.02 -0.11 4.33 3.20 -1.18 -3.33 116.97 119.86 3i4n h TYR 666 Ca -0.00 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 3i4n h TYR 666 Cb 0.34 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 3i4n h TYR 666 CO 0.00 -0.01 0.03 0.00 -1.64 0.00 0.00 178.16 176.54 3i4n n GLN 667 N -2.19 1.54 -4.00 1.82 10.64 -1.15 -5.13 117.38 118.91 3i4n n GLN 667 Ca -0.00 -0.52 -0.32 0.00 -1.83 0.00 0.00 57.00 54.32 3i4n n GLN 667 Cb 0.01 -1.52 -0.02 0.00 -0.86 0.00 0.00 30.24 27.85 3i4n n GLN 667 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 3i4n n ASP 668 N 0.14 -1.84 0.00 2.61 10.43 0.12 -5.00 116.55 123.00 3i4n n ASP 668 Ca 0.06 -1.13 0.00 0.00 2.57 0.00 0.00 54.79 56.29 3i4n n ASP 668 Cb 0.48 -2.54 0.00 0.00 1.84 0.00 0.00 41.12 40.90 3i4n n ASP 668 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 3i4n n GLU 678 N -4.53 0.00 -3.45 -1.24 2.13 -1.26 -4.98 120.64 107.32 3i4n n GLU 678 Ca -0.23 0.00 -0.44 0.00 0.66 0.00 0.00 57.16 57.15 3i4n n GLU 678 Cb 0.64 -0.32 -0.05 0.00 0.27 0.00 0.00 31.44 31.98 3i4n n GLU 678 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 3i4n s TYR 679 N -1.00 3.57 0.94 4.31 5.04 -1.26 -5.07 117.35 123.87 3i4n s TYR 679 Ca 0.00 -2.04 -0.13 0.00 -2.44 0.00 0.00 57.07 52.46 3i4n s TYR 679 Cb 0.00 -3.63 0.16 0.00 0.35 0.00 0.00 41.96 38.83 3i4n s TYR 679 CO 0.00 -0.96 1.14 -0.08 -1.34 0.00 0.00 175.55 174.31 3i4n s THR 680 N 0.48 1.98 0.09 4.34 -1.32 -1.26 -4.71 115.64 115.24 3i4n s THR 680 Ca 0.14 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.50 3i4n s THR 680 Cb -0.17 -2.71 -0.21 0.00 -1.51 0.00 0.00 72.50 67.89 3i4n s THR 680 CO -0.05 0.00 1.24 -0.25 -2.21 0.00 0.00 174.62 173.35 3i4n h TRP 681 N -1.62 0.96 -0.98 9.09 2.91 -1.95 -3.16 115.95 121.20 3i4n h TRP 681 Ca -0.50 -0.50 0.30 0.00 1.13 0.00 0.00 58.89 59.31 3i4n h TRP 681 Cb 1.33 -0.12 -0.15 0.00 -0.51 0.00 0.00 29.16 29.71 3i4n h TRP 681 CO 0.09 1.33 0.51 1.03 -1.03 0.00 0.00 178.44 180.37 3i4n h SER 682 N 0.39 0.43 0.54 2.65 0.87 -1.93 0.79 113.55 117.29 3i4n h SER 682 Ca -0.11 0.19 -0.18 0.00 -1.23 0.00 0.00 61.79 60.46 3i4n h SER 682 Cb 1.62 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 63.72 3i4n h SER 682 CO 0.19 -0.12 -0.78 0.77 -0.53 0.00 0.00 176.83 176.36 3i4n h SER 683 N 0.33 0.23 0.05 6.23 4.64 -1.93 -2.84 113.55 120.26 3i4n h SER 683 Ca 0.69 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3i4n h SER 683 Cb 1.52 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.55 3i4n h SER 683 CO -0.60 0.92 0.00 0.18 -0.87 0.00 0.00 176.83 176.45 3i4n n LEU 684 N -3.72 0.00 -0.08 5.97 4.77 0.27 0.12 117.00 124.33 3i4n n LEU 684 Ca -0.03 0.28 -0.09 0.00 -0.03 0.00 0.00 56.01 56.14 3i4n n LEU 684 Cb 0.74 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.52 3i4n n LEU 684 CO 0.46 -0.25 -0.64 -0.11 -1.33 0.00 0.00 177.39 175.52 3i4n n LEU 685 N -1.28 1.82 -0.25 2.23 7.94 -1.10 -2.08 117.00 124.28 3i4n n LEU 685 Ca 0.01 0.30 0.11 0.00 -1.11 0.00 0.00 56.01 55.32 3i4n n LEU 685 Cb 0.02 -0.69 0.37 0.00 0.53 0.00 0.00 43.42 43.65 3i4n n LEU 685 CO 0.02 -0.28 1.22 0.78 -1.11 0.00 0.00 177.39 178.02 3i4n h ASN 686 N -0.87 0.66 0.00 1.96 2.35 -1.19 0.39 115.58 118.88 3i4n h ASN 686 Ca -0.04 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3i4n h ASN 686 Cb 0.91 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.18 3i4n h ASN 686 CO -0.02 0.36 0.00 -0.62 -1.65 0.00 0.00 177.43 175.49 3i4n n GLU 687 N -4.54 0.68 -2.87 0.81 1.02 0.31 -4.24 120.64 111.82 3i4n n GLU 687 Ca 0.16 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 57.11 3i4n n GLU 687 Cb 0.41 -1.17 -0.03 0.00 -0.02 0.00 0.00 31.44 30.63 3i4n n GLU 687 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i4n n GLY 688 N 0.63 -0.26 0.10 0.62 0.00 0.14 -4.72 105.19 101.71 3i4n n GLY 688 Ca 0.00 0.03 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 3i4n n GLY 688 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3i4n h LEU 689 N -0.38 0.22 -7.23 0.99 3.38 -1.62 -3.46 115.31 107.21 3i4n h LEU 689 Ca -0.26 -0.36 -0.09 0.00 0.09 0.00 0.00 57.88 57.26 3i4n h LEU 689 Cb 0.77 -0.07 -0.20 0.00 0.09 0.00 0.00 40.66 41.24 3i4n h LEU 689 CO 0.39 1.31 -0.05 -0.69 0.09 0.00 0.00 178.44 179.49 3i4n s VAL 690 N -2.61 0.02 0.33 1.22 1.01 -0.89 -1.77 120.40 117.72 3i4n s VAL 690 Ca -0.08 -0.18 0.10 0.00 0.00 0.00 0.00 61.98 61.82 3i4n s VAL 690 Cb 0.08 -0.80 -0.06 0.00 0.00 0.00 0.00 36.38 35.60 3i4n s VAL 690 CO 0.83 -0.10 -0.10 -1.61 0.00 0.00 0.00 175.10 174.11 3i4n s GLU 691 N -0.92 1.82 -0.57 2.72 2.02 -1.06 -4.47 118.70 118.25 3i4n s GLU 691 Ca -0.10 -1.88 -0.18 0.00 0.02 0.00 0.00 54.97 52.84 3i4n s GLU 691 Cb -0.03 -1.75 0.11 0.00 0.10 0.00 0.00 34.13 32.57 3i4n s GLU 691 CO 0.06 0.18 0.62 0.71 0.02 0.00 0.00 175.26 176.85 3i4n s TYR 692 N -2.58 3.09 -0.41 1.61 4.12 -1.25 -1.44 117.35 120.49 3i4n s TYR 692 Ca 0.32 -1.06 -0.18 0.00 0.02 0.00 0.00 57.07 56.17 3i4n s TYR 692 Cb 0.01 -3.90 0.02 0.00 -1.52 0.00 0.00 41.96 36.56 3i4n s TYR 692 CO 0.17 -1.18 0.46 0.42 0.02 0.00 0.00 175.55 175.43 3i4n s ILE 693 N 2.27 5.06 0.85 2.71 1.01 -0.65 -4.84 121.20 127.62 3i4n s ILE 693 Ca 0.08 -0.24 -0.12 0.00 0.00 0.00 0.00 60.65 60.37 3i4n s ILE 693 Cb -0.26 -4.04 0.10 0.00 0.01 0.00 0.00 42.46 38.27 3i4n s ILE 693 CO 0.05 -0.41 1.11 1.51 0.00 0.00 0.00 174.94 177.21 3i4n s ASP 694 N 1.82 4.04 0.13 3.58 -4.77 -1.26 -3.19 116.67 117.01 3i4n s ASP 694 Ca 0.13 1.18 -0.28 0.00 -3.30 0.00 0.00 52.55 50.28 3i4n s ASP 694 Cb -0.17 -1.85 -0.06 0.00 -1.09 0.00 0.00 42.92 39.76 3i4n s ASP 694 CO 0.14 -2.24 1.60 0.00 0.70 0.00 0.00 175.17 175.37 3i4n h ALA 695 N -1.28 -0.51 -0.20 2.11 0.00 -1.91 -1.56 119.26 115.91 3i4n h ALA 695 Ca -0.49 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.43 3i4n h ALA 695 Cb 1.30 0.62 -0.04 0.00 0.00 0.00 0.00 17.79 19.67 3i4n h ALA 695 CO 0.60 -0.86 -0.28 1.49 0.00 0.00 0.00 179.25 180.20 3i4n h GLU 696 N -0.49 -0.19 -0.91 0.00 4.57 -1.92 -1.34 114.58 114.30 3i4n h GLU 696 Ca 0.06 0.01 0.16 0.00 -1.18 0.00 0.00 59.36 58.42 3i4n h GLU 696 Cb 0.59 0.04 -0.08 0.00 -0.16 0.00 0.00 28.75 29.14 3i4n h GLU 696 CO -0.29 -0.13 0.59 1.49 -1.18 0.00 0.00 179.01 179.49 3i4n h GLU 697 N -0.20 0.62 -0.76 1.92 4.81 -1.88 0.25 114.58 119.34 3i4n h GLU 697 Ca 0.04 -0.04 0.13 0.00 -0.13 0.00 0.00 59.36 59.35 3i4n h GLU 697 Cb 0.29 -0.14 -0.09 0.00 0.63 0.00 0.00 28.75 29.45 3i4n h GLU 697 CO -0.29 0.41 0.35 1.49 -0.73 0.00 0.00 179.01 180.24 3i4n h GLU 698 N 0.64 0.53 -1.73 1.92 4.81 -0.19 -1.41 114.58 119.15 3i4n h GLU 698 Ca 0.47 -0.03 0.50 0.00 -0.13 0.00 0.00 59.36 60.17 3i4n h GLU 698 Cb 0.85 -0.12 -0.07 0.00 0.63 0.00 0.00 28.75 30.04 3i4n h GLU 698 CO -0.23 0.35 1.28 0.39 -0.73 0.00 0.00 179.01 180.07 3i4n n GLU 699 N -4.92 0.00 -3.06 1.92 -0.58 0.08 -1.78 120.64 112.30 3i4n n GLU 699 Ca 0.14 0.98 -0.31 0.00 -0.42 0.00 0.00 57.16 57.55 3i4n n GLU 699 Cb 0.37 -2.27 -0.04 0.00 -0.57 0.00 0.00 31.44 28.93 3i4n n GLU 699 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 3i4n n SER 700 N -3.68 4.89 -3.75 1.62 3.41 -0.53 -5.01 113.62 110.57 3i4n n SER 700 Ca 0.39 -3.58 -0.07 0.00 -0.26 0.00 0.00 58.87 55.35 3i4n n SER 700 Cb 1.80 -0.76 -0.02 0.00 -0.26 0.00 0.00 64.21 64.97 3i4n n SER 700 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3i4n s ILE 701 N -3.63 0.00 -0.08 -1.33 -4.36 -0.73 -5.01 121.20 106.06 3i4n s ILE 701 Ca 0.43 -0.70 0.00 0.00 -0.26 0.00 0.00 60.65 60.11 3i4n s ILE 701 Cb 0.20 -1.80 0.02 0.00 1.25 0.00 0.00 42.46 42.13 3i4n s ILE 701 CO -0.07 0.00 -0.06 -0.22 0.24 0.00 0.00 174.94 174.83 3i4n s LEU 702 N -2.88 1.15 -0.07 0.37 2.96 -1.26 -4.97 118.68 113.99 3i4n s LEU 702 Ca 0.10 -0.22 0.03 0.00 -0.22 0.00 0.00 54.13 53.82 3i4n s LEU 702 Cb -0.04 -0.67 -0.02 0.00 0.50 0.00 0.00 46.19 45.97 3i4n s LEU 702 CO 0.02 -0.10 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.18 3i4n s ILE 703 N 1.43 2.99 -0.14 6.68 1.01 -1.26 -0.06 121.20 131.85 3i4n s ILE 703 Ca -0.02 -0.73 -0.14 0.00 0.00 0.00 0.00 60.65 59.77 3i4n s ILE 703 Cb -0.13 -2.19 -0.05 0.00 0.01 0.00 0.00 42.46 40.10 3i4n s ILE 703 CO -0.04 0.57 0.31 0.00 0.00 0.00 0.00 174.94 175.78 3i4n s ALA 704 N -0.41 3.61 0.00 9.38 0.00 -1.09 -4.98 121.76 128.27 3i4n s ALA 704 Ca 0.05 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 51.58 3i4n s ALA 704 Cb -0.12 -2.38 0.00 0.00 0.00 0.00 0.00 23.12 20.61 3i4n s ALA 704 CO 0.02 0.15 0.00 -0.12 0.00 0.00 0.00 175.76 175.81 3i4n n MET 705 N 3.34 0.00 -2.35 0.00 1.56 -1.26 -2.83 117.12 115.58 3i4n n MET 705 Ca -0.12 0.00 -0.42 0.00 -0.27 0.00 0.00 57.70 56.89 3i4n n MET 705 Cb 0.52 -0.43 -0.03 0.00 2.15 0.00 0.00 33.22 35.43 3i4n n MET 705 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 3i4n s GLN 706 N 0.00 4.44 0.00 2.12 1.11 -1.26 -3.59 119.66 122.48 3i4n s GLN 706 Ca 0.00 1.88 0.00 0.00 0.01 0.00 0.00 55.36 57.25 3i4n s GLN 706 Cb 0.00 -3.28 0.00 0.00 -1.01 0.00 0.00 33.01 28.72 3i4n s GLN 706 CO 0.00 -0.22 0.00 -0.35 0.01 0.00 0.00 175.29 174.73 3i4n n PRO 707 N 3.26 0.00 0.00 2.91 -0.04 -1.26 -3.71 135.00 136.16 3i4n n PRO 707 Ca 0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 3i4n n PRO 707 Cb 0.45 -0.42 0.00 0.00 -0.04 0.00 0.00 33.50 33.49 3i4n n PRO 707 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3i4n n GLU 708 N 0.00 0.00 0.00 0.54 0.28 -1.26 -2.85 120.64 117.35 3i4n n GLU 708 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 3i4n n GLU 708 Cb 0.00 -0.09 0.00 0.00 1.43 0.00 0.00 31.44 32.78 3i4n n GLU 708 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3i4n n ASP 709 N 0.00 0.00 -2.78 -1.84 8.00 -1.26 -1.82 116.55 116.85 3i4n n ASP 709 Ca 0.00 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.30 3i4n n ASP 709 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.04 3i4n n ASP 709 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3i4n n LEU 710 N -1.59 5.20 0.00 0.64 4.77 -1.13 -4.23 117.00 120.66 3i4n n LEU 710 Ca 0.00 -2.99 0.00 0.00 -0.03 0.00 0.00 56.01 52.99 3i4n n LEU 710 Cb 0.00 -1.15 0.00 0.00 -2.33 0.00 0.00 43.42 39.94 3i4n n LEU 710 CO 0.00 1.09 0.00 -0.62 -1.33 0.00 0.00 177.39 176.53 3i4n n GLU 711 N 3.44 0.00 0.00 3.23 -0.58 -0.76 -4.89 120.64 121.08 3i4n n GLU 711 Ca 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.20 3i4n n GLU 711 Cb 0.36 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.23 3i4n n GLU 711 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 3i4n n PRO 712 N -2.36 1.88 0.00 3.49 -0.04 -1.26 -5.08 135.00 131.62 3i4n n PRO 712 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3i4n n PRO 712 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 3i4n n PRO 712 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3i4n n ALA 713 N -3.00 0.00 -3.00 0.55 0.00 -1.26 -5.09 120.51 108.71 3i4n n ALA 713 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3i4n n ALA 713 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3i4n n ALA 713 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3i4n n GLU 714 N 0.00 0.00 0.04 0.00 0.00 -1.26 -5.15 120.64 114.27 3i4n n GLU 714 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 3i4n n GLU 714 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 3i4n n GLU 714 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3i4n n ALA 715 N -3.00 0.00 0.00 -1.84 0.00 -1.26 -5.33 120.51 109.08 3i4n n ALA 715 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3i4n n ALA 715 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3i4n n ALA 715 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3i4n n ASP 722 N -2.49 0.00 -3.82 0.00 5.75 -1.26 -5.37 116.55 109.36 3i4n n ASP 722 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 3i4n n ASP 722 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 3i4n n ASP 722 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 3i4n n VAL 723 N 1.36 0.00 -3.44 2.12 0.31 -1.26 -4.96 118.33 112.45 3i4n n VAL 723 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.95 3i4n n VAL 723 Cb 0.00 -0.29 -0.08 0.00 -0.91 0.00 0.00 33.84 32.56 3i4n n VAL 723 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3i4n s ASP 724 N -1.82 6.35 0.32 4.52 -1.08 -1.26 -4.97 116.67 118.72 3i4n s ASP 724 Ca 0.00 0.41 0.24 0.00 -0.52 0.00 0.00 52.55 52.68 3i4n s ASP 724 Cb 0.00 -2.20 1.13 0.00 -1.46 0.00 0.00 42.92 40.39 3i4n s ASP 724 CO 0.00 -0.06 1.74 1.55 0.52 0.00 0.00 175.17 178.92 3i4n h PRO 725 N 7.49 0.00 0.00 4.34 0.13 -1.97 -3.18 132.00 138.81 3i4n h PRO 725 Ca -0.36 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.40 3i4n h PRO 725 Cb 1.16 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.22 3i4n h PRO 725 CO 0.70 0.00 -2.41 0.00 -0.23 0.00 0.00 178.00 176.06 3i4n n ALA 726 N -1.81 1.49 -1.00 -0.56 0.00 -1.26 -5.00 120.51 112.37 3i4n n ALA 726 Ca 0.01 -1.26 0.00 0.00 0.00 0.00 0.00 53.44 52.19 3i4n n ALA 726 Cb 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.46 3i4n n ALA 726 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i4n n LYS 727 N -2.90 0.16 -1.23 0.00 5.02 -1.20 -4.90 118.16 113.11 3i4n n LYS 727 Ca -0.37 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 55.92 3i4n n LYS 727 Cb 1.10 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 36.11 3i4n n LYS 727 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 3i4n n ARG 728 N -0.56 1.31 -4.04 1.97 1.85 -1.26 -5.04 116.66 110.89 3i4n n ARG 728 Ca 0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.53 3i4n n ARG 728 Cb 0.00 0.00 -0.15 0.00 -1.05 0.00 0.00 32.46 31.26 3i4n n ARG 728 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 3i4n s ILE 729 N 0.50 2.29 -0.08 8.89 1.01 -1.26 -4.93 121.20 127.63 3i4n s ILE 729 Ca 0.00 -1.73 -0.02 0.00 0.00 0.00 0.00 60.65 58.90 3i4n s ILE 729 Cb 0.00 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.03 3i4n s ILE 729 CO 0.00 -0.14 0.02 -0.13 0.00 0.00 0.00 174.94 174.69 3i4n s ARG 730 N 1.09 3.03 0.93 2.79 0.52 -1.26 -5.10 118.95 120.94 3i4n s ARG 730 Ca -0.05 -0.38 -0.13 0.00 -0.52 0.00 0.00 55.73 54.64 3i4n s ARG 730 Cb -0.20 -2.83 0.03 0.00 0.52 0.00 0.00 34.95 32.47 3i4n s ARG 730 CO -0.05 0.71 0.43 0.28 0.02 0.00 0.00 175.30 176.69 3i4n n VAL 731 N 2.07 0.19 -1.52 3.52 0.31 -1.26 -5.00 118.33 116.65 3i4n n VAL 731 Ca -0.18 -0.21 -0.02 0.00 -0.01 0.00 0.00 64.34 63.91 3i4n n VAL 731 Cb 0.54 -0.64 0.01 0.00 -0.91 0.00 0.00 33.84 32.84 3i4n n VAL 731 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3i4n n SER 732 N -1.25 0.05 -3.88 4.52 7.64 -1.26 -5.00 113.62 114.43 3i4n n SER 732 Ca 0.07 -1.06 -0.42 0.00 1.01 0.00 0.00 58.87 58.46 3i4n n SER 732 Cb 0.53 -0.08 0.01 0.00 -1.01 0.00 0.00 64.21 63.66 3i4n n SER 732 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i4n n HIS 733 N -1.92 2.55 -2.57 1.43 1.44 -1.26 -4.95 115.22 109.93 3i4n n HIS 733 Ca 0.01 -2.67 -0.43 0.00 -2.01 0.00 0.00 57.72 52.63 3i4n n HIS 733 Cb 0.05 -1.56 -0.02 0.00 0.12 0.00 0.00 29.99 28.58 3i4n n HIS 733 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 3i4n s HIS 734 N -1.57 3.04 0.00 -1.40 3.76 -1.26 -4.85 115.29 113.01 3i4n s HIS 734 Ca 0.36 1.13 0.00 0.00 -0.15 0.00 0.00 55.06 56.41 3i4n s HIS 734 Cb 0.09 -3.69 0.00 0.00 1.11 0.00 0.00 32.58 30.09 3i4n s HIS 734 CO 0.04 -1.03 0.00 0.00 -0.85 0.00 0.00 174.74 172.90 3i4n n ALA 735 N 6.96 0.00 -0.85 -1.40 0.00 -1.26 -4.83 120.51 119.13 3i4n n ALA 735 Ca 0.13 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.57 3i4n n ALA 735 Cb 0.47 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.93 3i4n n ALA 735 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3i4n n THR 736 N -1.85 0.40 0.23 0.00 -1.04 -1.26 -4.73 114.28 106.03 3i4n n THR 736 Ca 0.00 -0.43 0.11 0.00 -2.04 0.00 0.00 64.05 61.69 3i4n n THR 736 Cb 0.00 0.72 0.55 0.00 -1.82 0.00 0.00 70.33 69.78 3i4n n THR 736 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 3i4n n THR 737 N -0.23 1.00 -0.65 12.58 -2.24 -1.26 -4.84 114.28 118.64 3i4n n THR 737 Ca 0.01 0.59 -0.31 0.00 -2.27 0.00 0.00 64.05 62.07 3i4n n THR 737 Cb 0.46 -1.57 -0.06 0.00 -2.10 0.00 0.00 70.33 67.06 3i4n n THR 737 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3i4n n PHE 738 N -2.23 0.59 -0.09 4.78 0.99 -1.26 -4.72 117.46 115.51 3i4n n PHE 738 Ca -0.00 0.39 -0.19 0.00 -0.00 0.00 0.00 57.45 57.65 3i4n n PHE 738 Cb 0.09 -1.19 -0.12 0.00 -1.00 0.00 0.00 39.48 37.26 3i4n n PHE 738 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.76 178.55 3i4n h THR 739 N 3.65 1.25 -4.40 4.37 1.35 -0.74 -3.44 112.91 114.95 3i4n h THR 739 Ca -0.05 -2.25 -0.40 0.00 -0.55 0.00 0.00 66.41 63.16 3i4n h THR 739 Cb 0.73 2.67 -0.09 0.00 -1.73 0.00 0.00 68.15 69.74 3i4n h THR 739 CO 0.57 0.43 -0.33 1.41 -0.25 0.00 0.00 175.52 177.35 3i4n n HIS 740 N -4.50 0.22 -3.79 4.73 8.25 -1.06 0.01 115.22 119.07 3i4n n HIS 740 Ca -0.24 -1.83 -0.10 0.00 -0.26 0.00 0.00 57.72 55.29 3i4n n HIS 740 Cb 0.61 -0.04 -0.07 0.00 1.12 0.00 0.00 29.99 31.60 3i4n n HIS 740 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3i4n s GLU 742 N -3.08 4.69 0.17 0.00 2.56 -1.13 -1.06 118.70 120.85 3i4n s GLU 742 Ca -0.01 1.61 -0.10 0.00 0.00 0.00 0.00 54.97 56.47 3i4n s GLU 742 Cb 0.01 -3.15 0.04 0.00 2.00 0.00 0.00 34.13 33.03 3i4n s GLU 742 CO -0.07 0.32 1.60 0.82 -0.56 0.00 0.00 175.26 177.38 3i4n h ILE 743 N 3.01 1.27 0.00 -3.70 1.08 -1.88 -3.42 117.51 113.87 3i4n h ILE 743 Ca -0.46 -1.22 0.00 0.00 -0.39 0.00 0.00 64.86 62.79 3i4n h ILE 743 Cb 1.21 0.93 0.00 0.00 -3.07 0.00 0.00 36.82 35.89 3i4n h ILE 743 CO 0.67 0.43 0.00 1.57 -0.69 0.00 0.00 178.15 180.13 3i4n n HIS 744 N -4.18 0.00 -0.33 1.37 -0.00 -1.26 -4.73 115.22 106.09 3i4n n HIS 744 Ca 0.02 0.00 0.14 0.00 0.46 0.00 0.00 57.72 58.34 3i4n n HIS 744 Cb 0.38 0.00 0.33 0.00 -0.12 0.00 0.00 29.99 30.58 3i4n n HIS 744 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3i4n h PRO 745 N 0.00 0.51 0.00 1.57 0.13 -1.89 -0.31 132.00 132.01 3i4n h PRO 745 Ca 0.00 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 3i4n h PRO 745 Cb 0.00 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.01 3i4n h PRO 745 CO 0.00 0.34 0.65 0.66 -0.23 0.00 0.00 178.00 179.42 3i4n h SER 746 N 0.53 0.00 0.39 1.44 4.64 -1.96 -0.26 113.55 118.32 3i4n h SER 746 Ca 0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.91 3i4n h SER 746 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3i4n h SER 746 CO -0.48 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 175.71 3i4n n MET 747 N -2.11 0.51 0.19 4.77 2.81 -0.13 -2.91 117.12 120.26 3i4n n MET 747 Ca -0.00 0.02 0.07 0.00 -1.81 0.00 0.00 57.70 55.98 3i4n n MET 747 Cb 0.66 -1.50 0.33 0.00 -0.71 0.00 0.00 33.22 32.00 3i4n n MET 747 CO 0.00 0.00 0.00 -0.84 1.51 0.00 0.00 175.97 176.64 3i4n h ILE 748 N 0.00 0.73 -4.10 2.02 3.07 -1.28 -3.31 117.51 114.64 3i4n h ILE 748 Ca 0.00 -1.47 -0.48 0.00 1.55 0.00 0.00 64.86 64.46 3i4n h ILE 748 Cb 0.20 1.95 0.14 0.00 -0.27 0.00 0.00 36.82 38.83 3i4n h ILE 748 CO 0.00 0.32 0.26 -0.76 -1.05 0.00 0.00 178.15 176.93 3i4n s LEU 749 N -6.84 2.25 0.38 0.16 1.43 -1.15 -3.73 118.68 111.18 3i4n s LEU 749 Ca 0.01 1.41 0.06 0.00 -1.03 0.00 0.00 54.13 54.57 3i4n s LEU 749 Cb 0.10 -3.83 -0.07 0.00 0.03 0.00 0.00 46.19 42.41 3i4n s LEU 749 CO 0.68 -2.57 0.03 -0.83 0.23 0.00 0.00 176.35 173.89 3i4n s GLY 750 N -3.53 2.35 0.00 -3.19 0.00 -1.26 -1.81 107.32 99.88 3i4n s GLY 750 Ca 0.63 -2.17 0.00 0.00 0.00 0.00 0.00 44.72 43.18 3i4n s GLY 750 CO 0.56 -1.99 0.13 -0.62 0.00 0.00 0.00 173.10 171.19 3i4n n VAL 751 N -0.87 0.00 0.00 1.40 0.31 -1.26 -1.54 118.33 116.37 3i4n n VAL 751 Ca -0.04 0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.54 3i4n n VAL 751 Cb 0.67 -0.38 0.00 0.00 -0.91 0.00 0.00 33.84 33.22 3i4n n VAL 751 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i4n n ALA 752 N -0.79 0.00 -0.28 3.52 0.00 -1.26 -1.11 120.51 120.59 3i4n n ALA 752 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 3i4n n ALA 752 Cb 0.00 0.14 -0.04 0.00 0.00 0.00 0.00 19.45 19.56 3i4n n ALA 752 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n n ALA 753 N -0.83 -0.32 0.12 0.00 0.00 -0.79 -0.92 120.51 117.77 3i4n n ALA 753 Ca 0.00 0.62 0.12 0.00 0.00 0.00 0.00 53.44 54.18 3i4n n ALA 753 Cb 0.00 -0.17 0.23 0.00 0.00 0.00 0.00 19.45 19.51 3i4n n ALA 753 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3i4n h SER 754 N 0.00 0.00 -0.01 0.00 0.02 -0.05 0.67 113.55 114.18 3i4n h SER 754 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 3i4n h SER 754 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 3i4n h SER 754 CO -0.66 0.00 -0.23 -0.38 -1.14 0.00 0.00 176.83 174.42 3i4n n ILE 755 N -2.83 0.00 -2.79 3.27 5.41 -0.10 -4.48 119.36 117.84 3i4n n ILE 755 Ca 0.09 -0.36 -0.43 0.00 1.00 0.00 0.00 62.75 63.05 3i4n n ILE 755 Cb 1.15 1.30 -0.04 0.00 -0.71 0.00 0.00 39.64 41.35 3i4n n ILE 755 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3i4n s ILE 756 N -2.24 4.59 0.29 1.39 1.01 0.23 -4.96 121.20 121.52 3i4n s ILE 756 Ca 0.24 1.28 -0.29 0.00 0.00 0.00 0.00 60.65 61.87 3i4n s ILE 756 Cb 0.19 -4.33 -0.10 0.00 0.01 0.00 0.00 42.46 38.23 3i4n s ILE 756 CO 0.44 -0.50 1.43 -2.16 0.00 0.00 0.00 174.94 174.14 3i4n s PRO 757 N 3.46 4.25 -1.49 2.79 0.04 -1.26 -3.35 135.00 139.44 3i4n s PRO 757 Ca 0.39 2.35 -0.01 0.00 0.04 0.00 0.00 61.00 63.76 3i4n s PRO 757 Cb -0.12 -3.07 0.01 0.00 0.04 0.00 0.00 34.50 31.36 3i4n s PRO 757 CO 0.18 -0.40 0.25 1.19 0.04 0.00 0.00 177.00 178.26 3i4n n PHE 758 N 1.64 -1.47 0.32 0.56 3.01 -1.18 -4.78 117.46 115.56 3i4n n PHE 758 Ca 0.04 0.69 0.15 0.00 1.01 0.00 0.00 57.45 59.34 3i4n n PHE 758 Cb 0.40 -3.27 0.79 0.00 -0.01 0.00 0.00 39.48 37.39 3i4n n PHE 758 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 3i4n h PRO 759 N -1.79 0.00 -1.58 -1.08 0.13 -1.85 0.79 132.00 126.63 3i4n h PRO 759 Ca -0.64 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.00 3i4n h PRO 759 Cb 1.39 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.32 3i4n h PRO 759 CO 0.67 0.00 0.57 -0.40 -0.23 0.00 0.00 178.00 178.61 3i4n n ASP 760 N -2.82 6.84 0.00 1.44 5.75 -1.26 -3.72 116.55 122.77 3i4n n ASP 760 Ca -0.02 -3.33 0.00 0.00 -0.01 0.00 0.00 54.79 51.43 3i4n n ASP 760 Cb 0.37 -1.09 0.00 0.00 -1.03 0.00 0.00 41.12 39.37 3i4n n ASP 760 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 3i4n n HIS 761 N 0.13 0.00 -4.69 2.11 8.25 0.27 -5.06 115.22 116.24 3i4n n HIS 761 Ca 0.44 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.60 3i4n n HIS 761 Cb 0.56 0.11 -0.09 0.00 1.12 0.00 0.00 29.99 31.69 3i4n n HIS 761 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 3i4n s ASN 762 N 0.00 4.01 0.50 0.41 0.01 -1.24 -3.08 114.94 115.55 3i4n s ASN 762 Ca 0.00 -1.51 -0.21 0.00 -0.71 0.00 0.00 52.86 50.43 3i4n s ASN 762 Cb 0.00 0.07 -0.07 0.00 0.41 0.00 0.00 41.25 41.66 3i4n s ASN 762 CO 0.00 -0.66 1.11 -1.58 -1.51 0.00 0.00 177.10 174.46 3i4n s GLN 763 N -3.80 3.63 0.15 -0.60 0.74 -1.08 -4.95 119.66 113.75 3i4n s GLN 763 Ca 0.20 1.58 -0.23 0.00 0.05 0.00 0.00 55.36 56.97 3i4n s GLN 763 Cb 0.06 -2.17 0.02 0.00 1.10 0.00 0.00 33.01 32.02 3i4n s GLN 763 CO 0.10 -0.62 1.63 1.03 -0.55 0.00 0.00 175.29 176.89 3i4n h SER 764 N 1.61 -0.79 -0.65 6.67 0.87 -1.94 -2.85 113.55 116.47 3i4n h SER 764 Ca -0.50 0.14 -0.03 0.00 -1.23 0.00 0.00 61.79 60.17 3i4n h SER 764 Cb 1.24 0.37 -0.03 0.00 -0.44 0.00 0.00 62.40 63.54 3i4n h SER 764 CO 0.59 -0.28 0.29 1.55 -0.53 0.00 0.00 176.83 178.44 3i4n h PRO 765 N -0.26 0.98 -1.01 2.24 0.13 -1.97 -3.06 132.00 129.06 3i4n h PRO 765 Ca 0.13 -0.15 0.23 0.00 -0.87 0.00 0.00 66.00 65.34 3i4n h PRO 765 Cb 0.46 -0.17 -0.11 0.00 0.13 0.00 0.00 31.00 31.31 3i4n h PRO 765 CO -0.38 0.78 0.62 0.00 -0.23 0.00 0.00 178.00 178.79 3i4n h ARG 766 N 0.97 0.57 0.00 0.86 2.47 -1.85 0.67 114.38 118.06 3i4n h ARG 766 Ca 0.23 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.92 3i4n h ARG 766 Cb 0.15 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.34 3i4n h ARG 766 CO -0.02 0.38 0.00 0.09 0.56 0.00 0.00 179.97 180.97 3i4n n ASN 767 N -4.77 0.36 0.02 7.04 3.02 -1.15 -2.40 115.26 117.38 3i4n n ASN 767 Ca 0.25 0.58 -0.12 0.00 -0.03 0.00 0.00 54.58 55.26 3i4n n ASN 767 Cb 0.72 -0.66 -0.14 0.00 -0.61 0.00 0.00 39.78 39.09 3i4n n ASN 767 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3i4n h THR 768 N 0.00 1.05 -0.09 3.41 2.02 0.23 -3.23 112.91 116.30 3i4n h THR 768 Ca 0.00 -2.81 -0.00 0.00 0.77 0.00 0.00 66.41 64.37 3i4n h THR 768 Cb 0.35 2.59 -0.00 0.00 -1.74 0.00 0.00 68.15 69.34 3i4n h THR 768 CO 0.00 0.70 0.04 1.88 0.37 0.00 0.00 175.52 178.51 3i4n h TYR 769 N 0.03 0.14 0.00 3.16 0.05 -1.11 -1.53 116.97 117.71 3i4n h TYR 769 Ca -0.24 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.53 3i4n h TYR 769 Cb 1.97 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 39.67 3i4n h TYR 769 CO 0.02 0.24 0.00 0.37 -1.05 0.00 0.00 178.16 177.74 3i4n h GLN 770 N 0.00 0.00 -0.00 4.88 5.75 -1.66 0.24 115.11 124.32 3i4n h GLN 770 Ca 0.03 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 3i4n h GLN 770 Cb 0.15 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.70 3i4n h GLN 770 CO -0.00 0.00 -0.00 0.43 -2.65 0.00 0.00 178.83 176.60 3i4n n SER 771 N -2.83 0.02 -0.02 -0.69 7.64 -0.58 -2.93 113.62 114.23 3i4n n SER 771 Ca -0.02 -0.52 -0.02 0.00 1.01 0.00 0.00 58.87 59.31 3i4n n SER 771 Cb 0.11 -0.16 -0.02 0.00 -1.01 0.00 0.00 64.21 63.13 3i4n n SER 771 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i4n n ALA 772 N -1.15 1.91 0.09 -0.43 0.00 0.78 -4.73 120.51 116.99 3i4n n ALA 772 Ca 0.18 -0.19 -0.03 0.00 0.00 0.00 0.00 53.44 53.40 3i4n n ALA 772 Cb 0.19 0.31 -0.06 0.00 0.00 0.00 0.00 19.45 19.89 3i4n n ALA 772 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3i4n h MET 773 N 0.00 0.00 -0.06 0.00 2.86 -1.52 -2.98 114.93 113.24 3i4n h MET 773 Ca -0.09 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.57 3i4n h MET 773 Cb 1.17 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.82 3i4n h MET 773 CO -0.01 0.80 0.13 0.78 1.06 0.00 0.00 176.91 179.67 3i4n h GLY 774 N 3.18 0.00 -1.99 8.32 0.00 -1.80 1.39 103.07 112.16 3i4n h GLY 774 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3i4n h GLY 774 CO 0.10 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.92 3i4n n LYS 775 N -3.38 2.27 -0.01 4.80 5.02 -1.13 -3.88 118.16 121.86 3i4n n LYS 775 Ca -0.01 -1.97 0.00 0.00 -2.02 0.00 0.00 58.31 54.30 3i4n n LYS 775 Cb 0.21 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 3i4n n LYS 775 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3i4n n GLN 776 N 1.11 1.59 -2.22 1.97 6.02 0.47 -4.96 117.38 121.37 3i4n n GLN 776 Ca 0.19 -1.06 -0.15 0.00 -0.01 0.00 0.00 57.00 55.97 3i4n n GLN 776 Cb 0.47 -0.78 0.06 0.00 1.02 0.00 0.00 30.24 31.02 3i4n n GLN 776 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3i4n n ALA 777 N -0.28 0.56 -2.22 -1.58 0.00 -0.65 -1.96 120.51 114.37 3i4n n ALA 777 Ca 0.00 -1.43 -0.22 0.00 0.00 0.00 0.00 53.44 51.79 3i4n n ALA 777 Cb 0.37 0.33 -0.00 0.00 0.00 0.00 0.00 19.45 20.15 3i4n n ALA 777 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3i4n s MET 778 N -4.04 2.43 0.00 0.00 -1.94 -0.95 -4.54 119.30 110.25 3i4n s MET 778 Ca 0.44 -1.68 0.00 0.00 -1.71 0.00 0.00 55.69 52.74 3i4n s MET 778 Cb -0.03 -2.38 0.00 0.00 2.01 0.00 0.00 34.83 34.43 3i4n s MET 778 CO 0.29 -0.46 0.00 0.41 -0.01 0.00 0.00 175.02 175.25 3i4n n GLY 779 N -1.78 -0.57 2.46 -0.03 0.00 -1.25 -4.53 105.19 99.50 3i4n n GLY 779 Ca 0.05 0.09 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 3i4n n GLY 779 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3i4n n VAL 780 N 0.00 -0.36 -0.32 1.61 0.31 -1.26 -2.34 118.33 115.97 3i4n n VAL 780 Ca 0.00 -2.78 0.35 0.00 -0.01 0.00 0.00 64.34 61.90 3i4n n VAL 780 Cb 0.00 -0.28 0.75 0.00 -0.91 0.00 0.00 33.84 33.39 3i4n n VAL 780 CO 0.00 0.00 0.00 2.19 -1.32 0.00 0.00 176.83 177.70 3i4n h PHE 781 N 4.02 0.02 -1.73 3.52 -5.15 -1.87 -3.41 116.94 112.35 3i4n h PHE 781 Ca -0.03 0.00 0.06 0.00 -0.20 0.00 0.00 57.97 57.79 3i4n h PHE 781 Cb 0.95 -0.01 -0.25 0.00 0.22 0.00 0.00 35.95 36.87 3i4n h PHE 781 CO 0.20 0.00 0.28 -0.51 -2.00 0.00 0.00 178.31 176.27 3i4n s LEU 782 N -8.39 -0.63 0.00 2.10 1.43 -1.26 -4.39 118.68 107.54 3i4n s LEU 782 Ca -0.05 1.08 0.00 0.00 -1.03 0.00 0.00 54.13 54.13 3i4n s LEU 782 Cb 0.23 2.03 0.00 0.00 0.03 0.00 0.00 46.19 48.48 3i4n s LEU 782 CO 0.81 -0.18 0.35 0.35 0.23 0.00 0.00 176.35 177.91 3i4n n THR 783 N 3.36 0.00 -0.05 5.49 -2.24 -1.26 -2.73 114.28 116.84 3i4n n THR 783 Ca -0.17 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.65 3i4n n THR 783 Cb 0.57 -0.27 0.09 0.00 -2.10 0.00 0.00 70.33 68.62 3i4n n THR 783 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3i4n n ASN 784 N 0.05 2.45 0.20 3.42 6.94 -1.26 -4.67 115.26 122.39 3i4n n ASN 784 Ca 0.00 -1.90 0.10 0.00 -0.02 0.00 0.00 54.58 52.76 3i4n n ASN 784 Cb 0.11 -0.13 0.51 0.00 -2.36 0.00 0.00 39.78 37.92 3i4n n ASN 784 CO 0.00 0.00 0.00 0.10 -1.03 0.00 0.00 177.26 176.33 3i4n h TYR 785 N 1.30 0.00 0.00 -2.53 -0.00 -1.89 0.32 116.97 114.17 3i4n h TYR 785 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 58.73 58.69 3i4n h TYR 785 Cb 0.60 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.32 3i4n h TYR 785 CO 0.13 0.00 -0.21 -0.91 -0.00 0.00 0.00 178.16 177.16 3i4n h ASN 786 N 0.00 0.00 -0.49 0.10 2.35 -1.89 -2.38 115.58 113.27 3i4n h ASN 786 Ca 0.00 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.44 3i4n h ASN 786 Cb 0.45 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 38.62 3i4n h ASN 786 CO 0.00 0.21 -0.23 0.52 -1.65 0.00 0.00 177.43 176.28 3i4n n VAL 787 N -4.18 2.63 -3.97 2.81 0.31 0.11 -4.96 118.33 111.07 3i4n n VAL 787 Ca -0.02 -3.24 -0.34 0.00 -0.01 0.00 0.00 64.34 60.73 3i4n n VAL 787 Cb 0.28 -0.62 -0.14 0.00 -0.91 0.00 0.00 33.84 32.44 3i4n n VAL 787 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3i4n s ARG 788 N -3.41 2.58 -0.67 5.55 0.52 -0.90 -4.99 118.95 117.63 3i4n s ARG 788 Ca 0.48 -1.15 -0.02 0.00 -0.52 0.00 0.00 55.73 54.52 3i4n s ARG 788 Cb 0.42 -3.01 0.28 0.00 0.52 0.00 0.00 34.95 33.15 3i4n s ARG 788 CO -0.00 -0.50 2.24 -1.33 0.02 0.00 0.00 175.30 175.72 3i4n n MET 789 N 4.60 2.57 -3.07 3.54 2.81 -1.26 -4.95 117.12 121.37 3i4n n MET 789 Ca -0.15 -3.01 -0.40 0.00 -1.81 0.00 0.00 57.70 52.33 3i4n n MET 789 Cb 0.45 -2.19 -0.05 0.00 -0.71 0.00 0.00 33.22 30.72 3i4n n MET 789 CO 0.00 0.00 0.00 0.16 1.51 0.00 0.00 175.97 177.64 3i4n s ASP 790 N -0.71 6.89 -0.26 7.83 3.84 -1.26 -4.91 116.67 128.09 3i4n s ASP 790 Ca 0.54 1.07 -0.28 0.00 -0.00 0.00 0.00 52.55 53.89 3i4n s ASP 790 Cb 0.42 -2.39 -0.04 0.00 -1.38 0.00 0.00 42.92 39.52 3i4n s ASP 790 CO -0.27 -0.18 2.16 0.42 -0.00 0.00 0.00 175.17 177.30 3i4n s THR 791 N 1.21 3.09 0.07 2.11 -4.23 -1.26 -4.42 115.64 112.21 3i4n s THR 791 Ca 0.35 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.95 3i4n s THR 791 Cb -0.17 -3.13 0.00 0.00 1.34 0.00 0.00 72.50 70.54 3i4n s THR 791 CO 0.15 -0.09 0.00 0.80 -0.54 0.00 0.00 174.62 174.94 3i4n n MET 792 N 8.73 -0.79 0.00 3.99 0.00 -0.90 -4.80 117.12 123.35 3i4n n MET 792 Ca 0.29 0.58 0.00 0.00 -0.00 0.00 0.00 57.70 58.56 3i4n n MET 792 Cb 0.46 -0.64 0.00 0.00 0.00 0.00 0.00 33.22 33.04 3i4n n MET 792 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3i4n n ALA 793 N -0.57 0.00 -2.40 -5.12 0.00 -0.98 -4.94 120.51 106.50 3i4n n ALA 793 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 3i4n n ALA 793 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 3i4n n ALA 793 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3i4n s ASN 794 N 0.00 3.26 -0.01 0.00 0.01 -1.26 -1.51 114.94 115.43 3i4n s ASN 794 Ca 0.00 -0.74 -0.00 0.00 -0.71 0.00 0.00 52.86 51.41 3i4n s ASN 794 Cb 0.00 -0.22 0.01 0.00 0.41 0.00 0.00 41.25 41.45 3i4n s ASN 794 CO 0.00 0.18 0.01 -0.63 -1.51 0.00 0.00 177.10 175.15 3i4n s ILE 795 N -1.05 -0.01 0.14 0.60 1.09 -1.26 -3.98 121.20 116.73 3i4n s ILE 795 Ca 0.13 0.05 -0.28 0.00 -1.10 0.00 0.00 60.65 59.45 3i4n s ILE 795 Cb -0.10 -0.03 -0.07 0.00 -1.06 0.00 0.00 42.46 41.20 3i4n s ILE 795 CO 0.06 0.02 0.88 -0.22 -0.10 0.00 0.00 174.94 175.57 3i4n s LEU 796 N 0.24 4.55 0.13 2.97 2.96 -0.99 0.16 118.68 128.70 3i4n s LEU 796 Ca -0.02 1.73 -0.26 0.00 -0.22 0.00 0.00 54.13 55.37 3i4n s LEU 796 Cb -0.03 -3.46 -0.02 0.00 0.50 0.00 0.00 46.19 43.18 3i4n s LEU 796 CO -0.01 0.07 1.62 1.88 -1.32 0.00 0.00 176.35 178.59 3i4n h TYR 797 N 4.94 -0.83 -3.08 5.38 -1.99 -1.25 -3.34 116.97 116.79 3i4n h TYR 797 Ca -0.45 0.03 -0.62 0.00 2.00 0.00 0.00 58.73 59.70 3i4n h TYR 797 Cb 1.21 0.38 -0.40 0.00 2.00 0.00 0.00 36.73 39.91 3i4n h TYR 797 CO 0.64 -0.38 -0.71 0.71 -0.00 0.00 0.00 178.16 178.42 3i4n s TYR 798 N -6.02 2.35 -0.09 4.88 2.02 -1.26 -5.08 117.35 114.15 3i4n s TYR 798 Ca -0.15 -2.66 -0.30 0.00 -0.37 0.00 0.00 57.07 53.59 3i4n s TYR 798 Cb 0.10 -2.15 -0.04 0.00 -0.40 0.00 0.00 41.96 39.47 3i4n s TYR 798 CO 0.66 -0.76 1.56 -2.14 -1.57 0.00 0.00 175.55 173.30 3i4n s PRO 799 N 0.10 4.18 -0.12 -1.71 0.02 -1.26 -4.90 135.00 131.31 3i4n s PRO 799 Ca 0.18 2.05 -0.09 0.00 0.02 0.00 0.00 61.00 63.16 3i4n s PRO 799 Cb -0.23 -3.94 -0.04 0.00 0.02 0.00 0.00 34.50 30.30 3i4n s PRO 799 CO -0.01 -0.83 0.18 -0.65 -0.33 0.00 0.00 177.00 175.36 3i4n s GLN 800 N 3.94 3.67 0.49 5.54 -0.21 -0.52 -4.97 119.66 127.61 3i4n s GLN 800 Ca 0.69 -0.06 -0.18 0.00 0.02 0.00 0.00 55.36 55.83 3i4n s GLN 800 Cb -0.30 -3.25 -0.09 0.00 1.00 0.00 0.00 33.01 30.37 3i4n s GLN 800 CO 0.26 0.66 0.97 -1.59 -2.12 0.00 0.00 175.29 173.47 3i4n s LYS 801 N -0.71 4.02 0.61 2.91 -2.85 -1.26 -4.37 119.74 118.09 3i4n s LYS 801 Ca 0.15 0.99 -0.18 0.00 -1.00 0.00 0.00 55.97 55.92 3i4n s LYS 801 Cb -0.12 -2.16 -0.03 0.00 -2.06 0.00 0.00 37.83 33.46 3i4n s LYS 801 CO 0.04 -0.19 1.22 -1.25 0.10 0.00 0.00 175.35 175.27 3i4n s PRO 802 N -3.81 2.85 -0.14 1.78 0.04 -1.26 -4.74 135.00 129.73 3i4n s PRO 802 Ca 0.60 1.87 -0.21 0.00 0.04 0.00 0.00 61.00 63.29 3i4n s PRO 802 Cb -0.10 -1.91 -0.19 0.00 0.04 0.00 0.00 34.50 32.35 3i4n s PRO 802 CO 0.26 -1.31 0.52 -0.07 0.04 0.00 0.00 177.00 176.44 3i4n h LEU 803 N 0.77 0.00 -9.15 -3.56 3.38 -1.95 -3.43 115.31 101.37 3i4n h LEU 803 Ca -0.50 -0.70 -0.58 0.00 0.09 0.00 0.00 57.88 56.18 3i4n h LEU 803 Cb 1.31 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.98 3i4n h LEU 803 CO 0.54 0.94 0.29 -0.83 0.09 0.00 0.00 178.44 179.48 3i4n s GLY 804 N -4.15 2.08 0.40 0.83 0.00 -1.26 -3.14 107.32 102.08 3i4n s GLY 804 Ca -0.16 -0.08 0.04 0.00 0.00 0.00 0.00 44.72 44.52 3i4n s GLY 804 CO 0.52 1.54 0.10 -0.51 0.00 0.00 0.00 173.10 174.75 3i4n s THR 805 N 2.07 0.77 0.15 0.90 -4.23 0.01 -4.86 115.64 110.44 3i4n s THR 805 Ca 0.35 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.94 3i4n s THR 805 Cb -0.16 -2.43 -0.04 0.00 1.34 0.00 0.00 72.50 71.21 3i4n s THR 805 CO 0.12 0.00 -0.18 -0.89 -0.54 0.00 0.00 174.62 173.12 3i4n s THR 806 N -3.20 1.73 0.16 3.99 2.01 -1.26 0.13 115.64 119.20 3i4n s THR 806 Ca 0.25 -1.81 0.21 0.00 0.31 0.00 0.00 61.69 60.65 3i4n s THR 806 Cb 0.04 -1.74 0.17 0.00 0.01 0.00 0.00 72.50 70.98 3i4n s THR 806 CO 0.14 -0.27 1.77 0.03 -0.69 0.00 0.00 174.62 175.60 3i4n h ARG 807 N 3.47 0.00 -0.06 4.92 2.47 -1.95 -2.39 114.38 120.83 3i4n h ARG 807 Ca -0.43 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.28 3i4n h ARG 807 Cb 1.20 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.52 3i4n h ARG 807 CO 0.48 0.32 -0.00 0.00 0.56 0.00 0.00 179.97 181.33 3i4n h ALA 808 N 1.68 1.89 -0.26 0.04 0.00 -1.94 -2.62 119.26 118.04 3i4n h ALA 808 Ca -0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3i4n h ALA 808 Cb 0.83 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3i4n h ALA 808 CO 0.04 0.09 -0.00 0.52 0.00 0.00 0.00 179.25 179.90 3i4n h MET 809 N 0.08 0.47 -1.59 0.00 2.86 -1.65 -2.78 114.93 112.32 3i4n h MET 809 Ca 0.02 -0.15 0.46 0.00 -2.06 0.00 0.00 59.70 57.97 3i4n h MET 809 Cb 0.06 -0.04 -0.06 0.00 0.06 0.00 0.00 31.60 31.62 3i4n h MET 809 CO 0.00 0.64 1.32 1.49 1.06 0.00 0.00 176.91 181.42 3i4n h GLU 810 N 0.25 0.00 0.00 1.72 4.81 -1.56 1.13 114.58 120.92 3i4n h GLU 810 Ca 0.07 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 59.01 3i4n h GLU 810 Cb 0.43 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.75 3i4n h GLU 810 CO 0.01 0.00 -2.30 0.66 -0.73 0.00 0.00 179.01 176.65 3i4n n TYR 811 N -3.69 0.00 1.79 0.92 4.02 -1.11 -4.12 117.16 114.97 3i4n n TYR 811 Ca 0.36 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.25 3i4n n TYR 811 Cb 1.80 -0.90 0.00 0.00 -0.02 0.00 0.00 39.34 40.22 3i4n n TYR 811 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3i4n n LEU 812 N -2.65 0.03 -3.55 7.72 4.77 0.38 -4.89 117.00 118.82 3i4n n LEU 812 Ca -0.27 -0.02 -0.20 0.00 -0.03 0.00 0.00 56.01 55.49 3i4n n LEU 812 Cb 1.04 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 42.12 3i4n n LEU 812 CO 0.43 0.01 -0.10 0.29 -1.33 0.00 0.00 177.39 176.69 3i4n n LYS 813 N -0.48 -1.57 -0.02 3.23 4.76 -0.54 -4.71 118.16 118.84 3i4n n LYS 813 Ca 0.00 1.06 -0.02 0.00 -2.87 0.00 0.00 58.31 56.48 3i4n n LYS 813 Cb 0.01 -3.22 -0.01 0.00 -1.84 0.00 0.00 35.03 29.97 3i4n n LYS 813 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3i4n n PHE 814 N -2.06 0.00 0.24 2.13 7.35 -1.20 -4.12 117.46 119.80 3i4n n PHE 814 Ca -0.20 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.52 3i4n n PHE 814 Cb 0.64 -0.12 0.16 0.00 0.35 0.00 0.00 39.48 40.51 3i4n n PHE 814 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3i4n h ARG 815 N -0.23 0.00 0.00 -4.13 3.08 -1.93 1.77 114.38 112.94 3i4n h ARG 815 Ca 0.00 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.80 3i4n h ARG 815 Cb 0.23 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.24 3i4n h ARG 815 CO 0.00 0.00 -1.90 0.39 -1.07 0.00 0.00 179.97 177.39 3i4n n GLU 816 N -2.18 0.65 -3.15 0.04 4.71 -1.26 -4.55 120.64 114.90 3i4n n GLU 816 Ca -0.00 0.11 -0.20 0.00 -0.01 0.00 0.00 57.16 57.05 3i4n n GLU 816 Cb 0.72 -1.67 -0.03 0.00 -1.01 0.00 0.00 31.44 29.45 3i4n n GLU 816 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3i4n n LEU 817 N -2.80 1.52 -4.19 -4.62 4.77 0.59 -5.09 117.00 107.17 3i4n n LEU 817 Ca -0.19 -5.13 -0.27 0.00 -0.03 0.00 0.00 56.01 50.39 3i4n n LEU 817 Cb 0.97 0.46 0.26 0.00 -2.33 0.00 0.00 43.42 42.77 3i4n n LEU 817 CO 0.44 2.29 0.28 -0.81 -1.33 0.00 0.00 177.39 178.25 3i4n n PRO 818 N 0.25 -4.00 -1.41 3.23 -0.04 -0.20 -4.63 135.00 128.19 3i4n n PRO 818 Ca 0.26 -1.18 0.04 0.00 -0.04 0.00 0.00 63.50 62.57 3i4n n PRO 818 Cb 0.60 -1.83 0.05 0.00 -0.04 0.00 0.00 33.50 32.28 3i4n n PRO 818 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3i4n n ALA 819 N -5.41 2.62 0.00 0.55 0.00 -1.26 -4.03 120.51 112.99 3i4n n ALA 819 Ca 0.10 -2.55 0.00 0.00 0.00 0.00 0.00 53.44 51.00 3i4n n ALA 819 Cb 0.53 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.31 3i4n n ALA 819 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i4n n GLY 820 N 0.16 -0.71 3.24 0.00 0.00 -1.26 -4.37 105.19 102.25 3i4n n GLY 820 Ca 0.09 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.60 3i4n n GLY 820 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i4n s GLN 821 N -0.22 0.92 -0.73 1.61 -0.21 -0.90 -1.44 119.66 118.68 3i4n s GLN 821 Ca 0.00 -0.99 -0.15 0.00 0.02 0.00 0.00 55.36 54.24 3i4n s GLN 821 Cb 0.00 0.36 0.18 0.00 1.00 0.00 0.00 33.01 34.54 3i4n s GLN 821 CO 0.00 -0.31 0.71 -0.80 -2.12 0.00 0.00 175.29 172.78 3i4n s ASN 822 N -2.88 6.54 0.15 5.90 0.01 -1.26 0.20 114.94 123.60 3i4n s ASN 822 Ca 0.07 -2.27 -0.07 0.00 -0.71 0.00 0.00 52.86 49.89 3i4n s ASN 822 Cb 0.04 -2.23 -0.06 0.00 0.41 0.00 0.00 41.25 39.41 3i4n s ASN 822 CO -0.09 -0.74 0.42 0.00 -1.51 0.00 0.00 177.10 175.18 3i4n s ALA 823 N 0.99 3.73 -0.82 0.60 0.00 -0.65 -4.83 121.76 120.79 3i4n s ALA 823 Ca 0.14 -0.47 -0.25 0.00 0.00 0.00 0.00 51.96 51.39 3i4n s ALA 823 Cb -0.17 -2.22 0.05 0.00 0.00 0.00 0.00 23.12 20.79 3i4n s ALA 823 CO -0.04 0.62 1.26 0.42 0.00 0.00 0.00 175.76 178.02 3i4n s ILE 824 N -1.66 3.96 0.34 0.00 -1.09 -1.26 -1.53 121.20 119.95 3i4n s ILE 824 Ca 0.41 -0.19 -0.28 0.00 -2.23 0.00 0.00 60.65 58.36 3i4n s ILE 824 Cb -0.12 -4.91 -0.10 0.00 -1.58 0.00 0.00 42.46 35.76 3i4n s ILE 824 CO 0.23 -1.78 1.20 -0.69 -1.23 0.00 0.00 174.94 172.67 3i4n s VAL 825 N 5.01 3.08 -0.25 2.92 1.01 -1.11 -1.21 120.40 129.85 3i4n s VAL 825 Ca 0.35 1.03 -0.02 0.00 0.00 0.00 0.00 61.98 63.35 3i4n s VAL 825 Cb -0.07 -3.64 0.08 0.00 0.00 0.00 0.00 36.38 32.75 3i4n s VAL 825 CO 0.06 0.20 0.07 0.00 0.00 0.00 0.00 175.10 175.43 3i4n s ALA 826 N -1.23 1.11 -0.72 5.51 0.00 0.06 -1.38 121.76 125.12 3i4n s ALA 826 Ca 0.50 -1.07 -0.24 0.00 0.00 0.00 0.00 51.96 51.14 3i4n s ALA 826 Cb -0.35 -1.36 0.05 0.00 0.00 0.00 0.00 23.12 21.47 3i4n s ALA 826 CO 0.45 -1.41 1.13 0.42 0.00 0.00 0.00 175.76 176.35 3i4n s ILE 827 N 1.82 4.05 -0.07 0.00 1.01 -1.24 -2.18 121.20 124.58 3i4n s ILE 827 Ca 0.04 -0.07 -0.31 0.00 0.00 0.00 0.00 60.65 60.30 3i4n s ILE 827 Cb -0.17 -4.81 0.12 0.00 0.01 0.00 0.00 42.46 37.61 3i4n s ILE 827 CO -0.18 -1.66 1.08 0.00 0.00 0.00 0.00 174.94 174.18 3i4n s ALA 828 N 4.80 -1.97 -0.08 9.38 0.00 -0.65 -3.99 121.76 129.26 3i4n s ALA 828 Ca 0.29 1.14 -0.26 0.00 0.00 0.00 0.00 51.96 53.14 3i4n s ALA 828 Cb -0.12 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 3i4n s ALA 828 CO 0.11 -0.73 0.82 0.00 0.00 0.00 0.00 175.76 175.96 3i4n n TYR 830 N 4.22 0.00 -0.01 0.00 9.36 -1.26 -4.95 117.16 124.52 3i4n n TYR 830 Ca 0.02 0.00 -0.17 0.00 3.32 0.00 0.00 57.90 61.07 3i4n n TYR 830 Cb 0.51 0.00 -0.09 0.00 -0.63 0.00 0.00 39.34 39.13 3i4n n TYR 830 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 3i4n h SER 831 N 0.00 0.73 0.00 2.98 4.64 -1.99 -3.47 113.55 116.43 3i4n h SER 831 Ca 0.00 -0.67 0.00 0.00 -0.47 0.00 0.00 61.79 60.65 3i4n h SER 831 Cb 0.00 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 61.87 3i4n h SER 831 CO 0.00 1.29 0.00 0.61 -0.87 0.00 0.00 176.83 177.86 3i4n n GLY 832 N 0.80 1.52 0.02 -0.77 0.00 -1.26 -5.00 105.19 100.51 3i4n n GLY 832 Ca -0.09 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.94 3i4n n GLY 832 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3i4n n TYR 833 N -0.29 0.00 0.73 1.61 4.02 -1.26 -4.22 117.16 117.74 3i4n n TYR 833 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.99 3i4n n TYR 833 Cb 0.00 -0.35 0.46 0.00 -0.02 0.00 0.00 39.34 39.43 3i4n n TYR 833 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 3i4n n ASN 834 N -2.08 0.04 -4.70 7.72 6.94 -1.26 -4.46 115.26 117.45 3i4n n ASN 834 Ca -0.08 0.51 -0.43 0.00 -0.02 0.00 0.00 54.58 54.55 3i4n n ASN 834 Cb 0.51 -0.52 -0.02 0.00 -2.36 0.00 0.00 39.78 37.40 3i4n n ASN 834 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 3i4n n GLN 835 N -1.54 2.24 -2.57 -3.83 7.27 -1.26 -3.30 117.38 114.39 3i4n n GLN 835 Ca 0.05 0.79 -0.08 0.00 0.07 0.00 0.00 57.00 57.83 3i4n n GLN 835 Cb 0.26 -2.45 0.04 0.00 2.41 0.00 0.00 30.24 30.49 3i4n n GLN 835 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 3i4n n GLU 836 N 1.49 -2.13 -3.51 3.69 -0.58 -1.26 -4.27 120.64 114.07 3i4n n GLU 836 Ca 0.08 0.46 -0.19 0.00 -0.42 0.00 0.00 57.16 57.09 3i4n n GLU 836 Cb 0.34 -4.01 0.06 0.00 -0.57 0.00 0.00 31.44 27.26 3i4n n GLU 836 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3i4n n ASP 837 N -2.31 -2.73 -3.62 1.62 8.00 -1.25 -4.99 116.55 111.26 3i4n n ASP 837 Ca -0.08 -0.73 -0.10 0.00 0.71 0.00 0.00 54.79 54.58 3i4n n ASP 837 Cb 0.57 -4.64 -0.03 0.00 -0.02 0.00 0.00 41.12 37.00 3i4n n ASP 837 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3i4n s SER 838 N -4.14 -0.37 0.24 -2.24 1.04 -1.21 -3.42 113.70 103.61 3i4n s SER 838 Ca 0.11 -0.30 0.05 0.00 0.48 0.00 0.00 55.95 56.29 3i4n s SER 838 Cb -0.02 0.59 -0.02 0.00 0.10 0.00 0.00 66.02 66.67 3i4n s SER 838 CO 0.77 -1.03 0.18 1.15 0.98 0.00 0.00 173.24 175.29 3i4n n MET 839 N -0.35 0.34 -4.51 4.02 0.00 -0.56 -4.17 117.12 111.89 3i4n n MET 839 Ca -0.13 -2.30 -0.34 0.00 0.00 0.00 0.00 57.70 54.93 3i4n n MET 839 Cb 0.63 1.79 -0.12 0.00 0.00 0.00 0.00 33.22 35.53 3i4n n MET 839 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 3i4n s ILE 840 N -2.88 3.78 -0.13 3.17 1.01 -1.22 -0.04 121.20 124.88 3i4n s ILE 840 Ca 0.25 -0.42 0.03 0.00 0.00 0.00 0.00 60.65 60.51 3i4n s ILE 840 Cb 0.01 -2.61 0.01 0.00 0.01 0.00 0.00 42.46 39.88 3i4n s ILE 840 CO 0.18 0.54 -0.21 -0.32 0.00 0.00 0.00 174.94 175.12 3i4n s MET 841 N -0.08 2.92 -0.37 2.79 1.75 -1.13 -0.97 119.30 124.22 3i4n s MET 841 Ca 0.01 -0.82 -0.35 0.00 -1.25 0.00 0.00 55.69 53.28 3i4n s MET 841 Cb -0.13 -2.35 -0.12 0.00 2.84 0.00 0.00 34.83 35.07 3i4n s MET 841 CO 0.03 0.00 2.21 -1.71 -0.65 0.00 0.00 175.02 174.90 3i4n n ASN 842 N 4.02 2.02 0.39 1.11 5.15 -0.64 -2.77 115.26 124.54 3i4n n ASN 842 Ca -0.20 0.39 -0.18 0.00 -0.60 0.00 0.00 54.58 53.99 3i4n n ASN 842 Cb 0.52 -1.24 -0.09 0.00 -0.53 0.00 0.00 39.78 38.43 3i4n n ASN 842 CO 0.00 0.00 0.00 -0.61 1.40 0.00 0.00 177.26 178.05 3i4n h GLN 843 N 12.41 -0.93 -0.83 1.20 5.75 0.71 -2.39 115.11 131.03 3i4n h GLN 843 Ca -0.26 0.06 0.10 0.00 -0.15 0.00 0.00 58.65 58.40 3i4n h GLN 843 Cb 1.32 0.21 -0.11 0.00 1.07 0.00 0.00 27.48 29.97 3i4n h GLN 843 CO 1.04 -0.61 -0.42 0.43 -2.65 0.00 0.00 178.83 176.61 3i4n n SER 844 N -5.50 -0.74 -0.36 -0.69 7.64 -1.25 0.91 113.62 113.64 3i4n n SER 844 Ca -0.14 1.47 0.06 0.00 1.01 0.00 0.00 58.87 61.27 3i4n n SER 844 Cb 0.39 -0.25 0.22 0.00 -1.01 0.00 0.00 64.21 63.56 3i4n n SER 844 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3i4n h SER 845 N 0.00 0.96 -0.95 6.43 4.64 -1.85 -0.17 113.55 122.60 3i4n h SER 845 Ca 0.20 0.03 0.11 0.00 -0.47 0.00 0.00 61.79 61.66 3i4n h SER 845 Cb 0.41 -0.17 -0.07 0.00 -0.31 0.00 0.00 62.40 62.26 3i4n h SER 845 CO -0.80 0.55 0.61 0.40 -0.87 0.00 0.00 176.83 176.72 3i4n h ILE 846 N 1.05 0.94 0.56 0.95 2.04 0.10 0.16 117.51 123.33 3i4n h ILE 846 Ca 0.47 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.98 3i4n h ILE 846 Cb 0.37 -0.08 0.01 0.00 -0.74 0.00 0.00 36.82 36.37 3i4n h ILE 846 CO -0.23 0.17 -0.27 0.44 0.00 0.00 0.00 178.15 178.27 3i4n h ASP 847 N 0.95 -0.64 0.00 1.72 5.19 -0.26 -1.94 116.42 121.44 3i4n h ASP 847 Ca 0.46 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.84 3i4n h ASP 847 Cb 0.45 0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.13 3i4n h ASP 847 CO -0.22 -0.37 0.00 0.54 -3.12 0.00 0.00 179.24 176.07 3i4n n ARG 848 N -5.37 0.00 0.00 3.56 1.74 -0.87 -4.63 116.66 111.09 3i4n n ARG 848 Ca -0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 3i4n n ARG 848 Cb 0.33 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.45 3i4n n ARG 848 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i4n n GLY 849 N -0.75 1.07 3.72 -0.13 0.00 -0.76 -5.07 105.19 103.27 3i4n n GLY 849 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3i4n n GLY 849 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3i4n s LEU 850 N 0.00 4.37 0.00 0.99 2.96 0.53 -2.91 118.68 124.61 3i4n s LEU 850 Ca 0.00 2.69 0.00 0.00 -0.22 0.00 0.00 54.13 56.60 3i4n s LEU 850 Cb 0.00 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 43.09 3i4n s LEU 850 CO 0.00 -0.86 0.00 0.49 -1.32 0.00 0.00 176.35 174.66 3i4n n PHE 851 N 3.85 0.00 -1.72 5.38 3.01 -1.26 -4.56 117.46 122.16 3i4n n PHE 851 Ca 0.14 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.20 3i4n n PHE 851 Cb 0.38 -1.65 0.02 0.00 -0.01 0.00 0.00 39.48 38.22 3i4n n PHE 851 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3i4n n ARG 852 N -0.84 1.86 -1.02 -1.08 1.74 -1.15 -4.70 116.66 111.48 3i4n n ARG 852 Ca 0.00 0.67 0.00 0.00 -0.77 0.00 0.00 57.85 57.75 3i4n n ARG 852 Cb 0.18 -2.46 0.00 0.00 -1.02 0.00 0.00 32.46 29.16 3i4n n ARG 852 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3i4n n SER 853 N -0.21 1.43 0.00 0.55 3.41 -1.13 -0.84 113.62 116.83 3i4n n SER 853 Ca 0.08 -0.51 0.00 0.00 -0.26 0.00 0.00 58.87 58.18 3i4n n SER 853 Cb 0.42 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 3i4n n SER 853 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3i4n n LEU 854 N 0.00 0.00 0.00 1.04 4.77 0.12 -3.38 117.00 119.56 3i4n n LEU 854 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3i4n n LEU 854 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3i4n n LEU 854 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.39 176.39 3i4n n PHE 855 N 0.00 0.00 -4.45 -1.77 7.35 -0.94 -4.37 117.46 113.28 3i4n n PHE 855 Ca 0.00 0.00 -0.21 0.00 -0.76 0.00 0.00 57.45 56.48 3i4n n PHE 855 Cb 0.00 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 39.69 3i4n n PHE 855 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 3i4n s PHE 856 N 0.00 1.31 0.14 -5.13 0.40 -0.57 -1.72 117.98 112.41 3i4n s PHE 856 Ca 0.00 -0.33 0.06 0.00 -0.60 0.00 0.00 56.93 56.06 3i4n s PHE 856 Cb 0.00 -0.79 -0.04 0.00 0.51 0.00 0.00 43.02 42.70 3i4n s PHE 856 CO 0.00 0.03 -0.13 0.50 0.70 0.00 0.00 175.22 176.32 3i4n s ARG 857 N -0.98 1.07 -0.47 0.44 3.52 -1.06 -2.13 118.95 119.34 3i4n s ARG 857 Ca 0.03 -1.32 0.06 0.00 -0.13 0.00 0.00 55.73 54.37 3i4n s ARG 857 Cb -0.07 -0.89 0.21 0.00 -1.56 0.00 0.00 34.95 32.64 3i4n s ARG 857 CO 0.01 0.16 0.48 0.43 -0.81 0.00 0.00 175.30 175.57 3i4n n SER 858 N 0.29 0.78 -4.56 -2.12 7.64 -1.25 -1.68 113.62 112.72 3i4n n SER 858 Ca -0.14 -2.74 -0.34 0.00 1.01 0.00 0.00 58.87 56.66 3i4n n SER 858 Cb 0.58 -0.63 0.11 0.00 -1.01 0.00 0.00 64.21 63.26 3i4n n SER 858 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3i4n n TYR 859 N 1.93 0.02 -3.51 1.43 4.02 -0.47 -4.64 117.16 115.94 3i4n n TYR 859 Ca 0.25 0.35 -0.12 0.00 -0.01 0.00 0.00 57.90 58.37 3i4n n TYR 859 Cb 0.47 -1.98 -0.03 0.00 -0.02 0.00 0.00 39.34 37.78 3i4n n TYR 859 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 176.86 177.26 3i4n s MET 860 N -3.57 1.18 -0.03 -0.72 1.75 -1.26 -0.88 119.30 115.77 3i4n s MET 860 Ca 0.67 -0.47 -0.30 0.00 -1.25 0.00 0.00 55.69 54.34 3i4n s MET 860 Cb -0.29 0.54 0.11 0.00 2.84 0.00 0.00 34.83 38.02 3i4n s MET 860 CO 0.57 -0.48 0.93 0.34 -0.65 0.00 0.00 175.02 175.72 3i4n s ASP 861 N -2.59 -0.33 0.40 1.11 -1.08 -0.30 -5.02 116.67 108.85 3i4n s ASP 861 Ca 0.00 -0.00 0.05 0.00 -0.52 0.00 0.00 52.55 52.07 3i4n s ASP 861 Cb -0.00 0.35 -0.02 0.00 -1.46 0.00 0.00 42.92 41.79 3i4n s ASP 861 CO -0.10 -0.57 0.17 0.00 0.52 0.00 0.00 175.17 175.19 3i4n n GLN 862 N -0.23 0.55 -3.63 4.34 6.02 -1.26 -1.16 117.38 122.01 3i4n n GLN 862 Ca -0.07 -3.45 -0.40 0.00 -0.01 0.00 0.00 57.00 53.07 3i4n n GLN 862 Cb 0.61 2.03 -0.11 0.00 1.02 0.00 0.00 30.24 33.80 3i4n n GLN 862 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3i4n s GLU 863 N -3.53 2.75 0.65 -1.09 2.02 -1.12 -4.98 118.70 113.40 3i4n s GLU 863 Ca 0.24 -1.15 -0.17 0.00 0.02 0.00 0.00 54.97 53.91 3i4n s GLU 863 Cb 0.01 -3.69 -0.00 0.00 0.10 0.00 0.00 34.13 30.55 3i4n s GLU 863 CO 0.17 -0.73 1.19 0.15 0.02 0.00 0.00 175.26 176.06 3i4n s LYS 864 N 1.51 2.64 0.42 1.61 1.02 -1.26 -4.71 119.74 120.96 3i4n s LYS 864 Ca 0.01 1.73 0.03 0.00 0.02 0.00 0.00 55.97 57.77 3i4n s LYS 864 Cb -0.20 -1.90 -0.03 0.00 -0.52 0.00 0.00 37.83 35.19 3i4n s LYS 864 CO 0.05 -1.44 0.09 0.15 -0.92 0.00 0.00 175.35 173.28 3i4n s LYS 865 N -3.66 1.95 -0.48 1.68 1.02 -1.26 -1.31 119.74 117.67 3i4n s LYS 865 Ca 0.75 -2.18 0.06 0.00 0.02 0.00 0.00 55.97 54.62 3i4n s LYS 865 Cb -0.28 -0.88 0.18 0.00 -0.52 0.00 0.00 37.83 36.33 3i4n s LYS 865 CO 0.39 -0.39 0.63 0.71 -0.92 0.00 0.00 175.35 175.76 3i4n s TYR 866 N -3.13 -1.03 0.00 3.18 1.51 -0.09 -4.92 117.35 112.86 3i4n s TYR 866 Ca 0.22 -0.87 0.00 0.00 -1.01 0.00 0.00 57.07 55.41 3i4n s TYR 866 Cb 0.04 0.04 0.00 0.00 -0.11 0.00 0.00 41.96 41.93 3i4n s TYR 866 CO 0.12 -1.17 0.00 0.41 -1.11 0.00 0.00 175.55 173.80 3i4n n GLY 867 N 3.09 0.00 2.23 0.71 0.00 -1.26 -2.81 105.19 107.14 3i4n n GLY 867 Ca 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 3i4n n GLY 867 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3i4n n MET 868 N 0.00 0.61 -4.16 1.61 2.81 -1.26 -4.63 117.12 112.10 3i4n n MET 868 Ca 0.00 -0.27 -0.35 0.00 -1.81 0.00 0.00 57.70 55.27 3i4n n MET 868 Cb 0.00 -1.60 -0.07 0.00 -0.71 0.00 0.00 33.22 30.83 3i4n n MET 868 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3i4n n SER 869 N 2.64 -1.02 -4.33 7.83 7.64 -1.12 -4.91 113.62 120.34 3i4n n SER 869 Ca 0.12 -1.11 -0.43 0.00 1.01 0.00 0.00 58.87 58.46 3i4n n SER 869 Cb 0.28 -1.41 -0.09 0.00 -1.01 0.00 0.00 64.21 61.99 3i4n n SER 869 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3i4n s ILE 870 N -3.28 4.79 0.28 0.44 1.01 -1.20 -4.95 121.20 118.29 3i4n s ILE 870 Ca 0.56 -1.22 0.12 0.00 0.00 0.00 0.00 60.65 60.11 3i4n s ILE 870 Cb -0.33 -3.89 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 3i4n s ILE 870 CO 0.90 -0.55 -0.20 -0.89 0.00 0.00 0.00 174.94 174.20 3i4n s THR 871 N 1.54 2.48 0.69 2.92 2.01 -1.26 -0.92 115.64 123.11 3i4n s THR 871 Ca 0.04 -2.40 -0.05 0.00 0.31 0.00 0.00 61.69 59.59 3i4n s THR 871 Cb -0.24 -2.30 0.15 0.00 0.01 0.00 0.00 72.50 70.12 3i4n s THR 871 CO 0.05 -0.40 0.95 -0.62 -0.69 0.00 0.00 174.62 173.91 3i4n n GLU 872 N -0.61 -0.36 -3.76 4.92 1.02 -0.43 -4.53 120.64 116.90 3i4n n GLU 872 Ca -0.05 -2.17 -0.13 0.00 -0.02 0.00 0.00 57.16 54.80 3i4n n GLU 872 Cb 0.60 -0.76 -0.08 0.00 -0.02 0.00 0.00 31.44 31.18 3i4n n GLU 872 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3i4n s THR 873 N -2.90 0.07 -0.97 2.62 2.01 -1.17 -4.85 115.64 110.44 3i4n s THR 873 Ca 0.60 -0.57 -0.06 0.00 0.31 0.00 0.00 61.69 61.96 3i4n s THR 873 Cb -0.03 -0.76 0.24 0.00 0.01 0.00 0.00 72.50 71.97 3i4n s THR 873 CO 0.40 -0.31 0.91 -0.36 -0.69 0.00 0.00 174.62 174.57 3i4n s PHE 874 N -1.87 4.03 0.07 4.92 2.99 -1.26 -1.14 117.98 125.71 3i4n s PHE 874 Ca -0.10 -2.75 0.00 0.00 0.00 0.00 0.00 56.93 54.09 3i4n s PHE 874 Cb -0.03 -3.57 -0.00 0.00 0.00 0.00 0.00 43.02 39.41 3i4n s PHE 874 CO 0.01 -0.87 0.01 -0.85 -0.00 0.00 0.00 175.22 173.52 3i4n n GLU 875 N 2.75 1.37 -3.81 0.44 0.28 -0.74 -3.66 120.64 117.26 3i4n n GLU 875 Ca 0.21 -0.54 -0.29 0.00 -0.16 0.00 0.00 57.16 56.37 3i4n n GLU 875 Cb 0.39 0.21 -0.11 0.00 1.43 0.00 0.00 31.44 33.37 3i4n n GLU 875 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 3i4n n LYS 876 N -0.17 2.06 -1.13 3.44 4.81 -1.26 -4.02 118.16 121.89 3i4n n LYS 876 Ca -0.02 -4.51 -0.29 0.00 -0.87 0.00 0.00 58.31 52.62 3i4n n LYS 876 Cb 0.10 -2.31 0.21 0.00 0.02 0.00 0.00 35.03 33.04 3i4n n LYS 876 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 3i4n s PRO 877 N -1.56 -0.39 0.00 1.64 0.04 -1.26 -5.08 135.00 128.39 3i4n s PRO 877 Ca 0.27 0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.53 3i4n s PRO 877 Cb -0.03 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.84 3i4n s PRO 877 CO -0.15 -3.22 0.00 0.00 0.04 0.00 0.00 177.00 173.68 3i4n n GLN 878 N -4.46 0.00 0.00 4.56 -0.00 -1.26 -5.07 117.38 111.14 3i4n n GLN 878 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.09 3i4n n GLN 878 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.82 3i4n n GLN 878 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3i4n n ARG 879 N 0.00 0.00 -3.77 2.61 5.12 -1.26 -4.72 116.66 114.65 3i4n n ARG 879 Ca 0.00 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.59 3i4n n ARG 879 Cb 0.00 -0.25 0.03 0.00 -1.16 0.00 0.00 32.46 31.08 3i4n n ARG 879 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 3i4n n THR 880 N 0.00 -4.94 0.00 0.55 -1.04 -1.26 -3.94 114.28 103.64 3i4n n THR 880 Ca 0.00 -0.69 0.00 0.00 -2.04 0.00 0.00 64.05 61.32 3i4n n THR 880 Cb 0.00 -3.76 0.00 0.00 -1.82 0.00 0.00 70.33 64.75 3i4n n THR 880 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3i4n n ASN 881 N -2.46 0.00 0.00 8.00 3.02 -1.26 -4.27 115.26 118.29 3i4n n ASN 881 Ca -0.12 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.43 3i4n n ASN 881 Cb 0.59 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.76 3i4n n ASN 881 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3i4n n THR 882 N 0.00 0.00 0.00 3.41 -1.04 -1.25 -4.81 114.28 110.59 3i4n n THR 882 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3i4n n THR 882 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3i4n n THR 882 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3i4n n LEU 883 N -0.71 0.00 -4.57 -4.42 4.77 -1.26 -4.86 117.00 105.95 3i4n n LEU 883 Ca 0.00 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.74 3i4n n LEU 883 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 3i4n n LEU 883 CO 0.00 0.00 1.34 -0.13 -1.33 0.00 0.00 177.39 177.27 3i4n s ARG 884 N 0.00 2.22 0.00 3.23 1.81 -1.26 -4.74 118.95 120.21 3i4n s ARG 884 Ca 0.00 -0.42 0.00 0.00 -1.72 0.00 0.00 55.73 53.59 3i4n s ARG 884 Cb 0.00 -5.06 0.00 0.00 -0.45 0.00 0.00 34.95 29.44 3i4n s ARG 884 CO 0.00 -3.97 0.00 -1.33 -0.68 0.00 0.00 175.30 169.32 3i4n n MET 885 N 8.61 0.68 0.00 3.54 2.81 -1.26 -0.76 117.12 130.75 3i4n n MET 885 Ca 0.43 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.32 3i4n n MET 885 Cb 0.46 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.97 3i4n n MET 885 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3i4n n LYS 886 N 0.00 0.00 0.00 0.03 4.76 -1.26 -4.87 118.16 116.82 3i4n n LYS 886 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3i4n n LYS 886 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 3i4n n LYS 886 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 3i4n n HIS 887 N 0.00 0.00 -2.74 2.13 8.25 -1.26 -5.07 115.22 116.53 3i4n n HIS 887 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 3i4n n HIS 887 Cb 0.00 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.07 3i4n n HIS 887 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3i4n s GLY 888 N -1.60 2.92 -0.41 -1.41 0.00 -1.25 -4.91 107.32 100.65 3i4n s GLY 888 Ca 0.00 0.52 -0.37 0.00 0.00 0.00 0.00 44.72 44.88 3i4n s GLY 888 CO 0.00 1.58 1.69 2.41 0.00 0.00 0.00 173.10 178.78 3i4n n THR 889 N 3.52 0.00 0.02 0.90 -1.04 -1.26 -3.89 114.28 112.53 3i4n n THR 889 Ca 0.04 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.98 3i4n n THR 889 Cb 0.50 -0.41 0.09 0.00 -1.82 0.00 0.00 70.33 68.69 3i4n n THR 889 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 3i4n h TYR 890 N 6.90 0.59 -0.04 -1.42 -1.99 -1.92 -3.26 116.97 115.83 3i4n h TYR 890 Ca -0.13 -0.20 0.00 0.00 2.00 0.00 0.00 58.73 60.41 3i4n h TYR 890 Cb 1.16 -0.11 -0.00 0.00 2.00 0.00 0.00 36.73 39.78 3i4n h TYR 890 CO 0.77 0.90 -0.02 -0.25 -0.00 0.00 0.00 178.16 179.55 3i4n n ASP 891 N -3.96 -0.04 0.00 3.88 8.00 -1.26 0.12 116.55 123.28 3i4n n ASP 891 Ca -0.03 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.55 3i4n n ASP 891 Cb 0.58 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 3i4n n ASP 891 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3i4n n LYS 892 N -3.84 0.00 -3.03 -1.24 5.02 -1.26 -4.24 118.16 109.57 3i4n n LYS 892 Ca 0.00 0.13 -0.43 0.00 -2.02 0.00 0.00 58.31 55.99 3i4n n LYS 892 Cb 0.01 -1.66 -0.06 0.00 -0.02 0.00 0.00 35.03 33.30 3i4n n LYS 892 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3i4n s LEU 893 N -2.01 4.45 0.00 -0.35 1.43 0.31 -4.34 118.68 118.17 3i4n s LEU 893 Ca 0.00 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 3i4n s LEU 893 Cb 0.00 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.47 3i4n s LEU 893 CO 0.00 -0.93 0.00 0.47 0.23 0.00 0.00 176.35 176.12 3i4n n ASP 894 N 6.60 -1.62 0.06 2.29 9.92 0.55 -4.82 116.55 129.53 3i4n n ASP 894 Ca -0.01 -0.06 -0.11 0.00 -0.53 0.00 0.00 54.79 54.08 3i4n n ASP 894 Cb 0.47 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.94 3i4n n ASP 894 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 3i4n h ASP 895 N -1.62 0.46 0.00 -2.24 3.58 -1.95 -2.97 116.42 111.67 3i4n h ASP 895 Ca 0.00 -0.35 0.00 0.00 0.42 0.00 0.00 57.03 57.10 3i4n h ASP 895 Cb 0.00 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 40.91 3i4n h ASP 895 CO 0.00 1.12 0.00 -0.90 -2.88 0.00 0.00 179.24 176.58 3i4n n ASP 896 N -3.77 0.00 0.00 2.28 5.68 -1.26 -4.16 116.55 115.33 3i4n n ASP 896 Ca -0.05 -0.13 0.00 0.00 -0.50 0.00 0.00 54.79 54.11 3i4n n ASP 896 Cb 0.78 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.76 3i4n n ASP 896 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3i4n n GLY 897 N -0.71 0.69 3.63 6.12 0.00 -1.12 -4.47 105.19 109.33 3i4n n GLY 897 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 3i4n n GLY 897 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i4n s LEU 898 N 0.00 2.90 -0.11 0.99 1.43 -1.26 -0.76 118.68 121.86 3i4n s LEU 898 Ca 0.00 -1.32 -0.08 0.00 -1.03 0.00 0.00 54.13 51.71 3i4n s LEU 898 Cb 0.00 -0.98 -0.04 0.00 0.03 0.00 0.00 46.19 45.20 3i4n s LEU 898 CO 0.00 -0.44 0.16 -0.63 0.23 0.00 0.00 176.35 175.67 3i4n s ILE 899 N -2.69 5.48 0.41 -0.59 1.01 -1.25 -0.33 121.20 123.24 3i4n s ILE 899 Ca 0.36 0.25 -0.23 0.00 0.00 0.00 0.00 60.65 61.02 3i4n s ILE 899 Cb 0.09 -3.42 -0.09 0.00 0.01 0.00 0.00 42.46 39.04 3i4n s ILE 899 CO 0.18 0.61 1.02 0.00 0.00 0.00 0.00 174.94 176.76 3i4n s ALA 900 N -1.00 3.05 0.30 9.38 0.00 -1.26 -4.76 121.76 127.47 3i4n s ALA 900 Ca 0.15 0.62 0.03 0.00 0.00 0.00 0.00 51.96 52.76 3i4n s ALA 900 Cb -0.12 -3.24 0.77 0.00 0.00 0.00 0.00 23.12 20.52 3i4n s ALA 900 CO 0.04 -0.14 1.60 -1.35 0.00 0.00 0.00 175.76 175.91 3i4n h PRO 901 N 2.29 0.07 -0.34 0.00 0.11 -1.92 -2.81 132.00 129.40 3i4n h PRO 901 Ca -0.48 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 3i4n h PRO 901 Cb 1.21 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 3i4n h PRO 901 CO 0.62 0.04 0.05 0.78 -0.21 0.00 0.00 178.00 179.28 3i4n h GLY 902 N 0.07 0.55 -3.68 -0.55 0.00 -1.92 -3.24 103.07 94.30 3i4n h GLY 902 Ca 0.59 -0.29 -0.54 0.00 0.00 0.00 0.00 47.33 47.09 3i4n h GLY 902 CO -0.82 0.28 -0.94 -0.62 0.00 0.00 0.00 176.54 174.44 3i4n n VAL 903 N -4.32 0.25 -3.66 4.60 0.31 -1.06 -4.57 118.33 109.87 3i4n n VAL 903 Ca 0.02 -0.44 -0.39 0.00 -0.01 0.00 0.00 64.34 63.51 3i4n n VAL 903 Cb 0.20 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.03 3i4n n VAL 903 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 3i4n s ARG 904 N -0.89 2.43 0.37 5.55 3.52 -1.26 -1.36 118.95 127.31 3i4n s ARG 904 Ca 0.51 -1.57 -0.09 0.00 -0.13 0.00 0.00 55.73 54.45 3i4n s ARG 904 Cb -0.50 -3.70 -0.06 0.00 -1.56 0.00 0.00 34.95 29.13 3i4n s ARG 904 CO 0.57 -0.99 0.70 0.14 -0.81 0.00 0.00 175.30 174.92 3i4n s VAL 905 N 1.33 4.86 0.00 7.11 -7.23 -0.89 -4.98 120.40 120.60 3i4n s VAL 905 Ca 0.04 0.45 0.00 0.00 -1.81 0.00 0.00 61.98 60.66 3i4n s VAL 905 Cb -0.23 -3.73 0.00 0.00 0.56 0.00 0.00 36.38 32.98 3i4n s VAL 905 CO -0.00 -0.46 0.00 -1.54 -0.31 0.00 0.00 175.10 172.79 3i4n n SER 906 N -1.18 0.00 0.00 4.85 3.41 -1.26 -2.34 113.62 117.10 3i4n n SER 906 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 3i4n n SER 906 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 3i4n n SER 906 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i4n n GLY 907 N 0.00 0.00 0.62 5.00 0.00 -1.26 -4.45 105.19 105.09 3i4n n GLY 907 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3i4n n GLY 907 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i4n n GLU 908 N 0.00 2.55 -0.99 1.61 1.02 -1.26 -4.01 120.64 119.56 3i4n n GLU 908 Ca 0.00 -2.60 -0.36 0.00 -0.02 0.00 0.00 57.16 54.18 3i4n n GLU 908 Cb 0.00 -1.64 0.05 0.00 -0.02 0.00 0.00 31.44 29.83 3i4n n GLU 908 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3i4n n ASP 909 N -0.58 -5.64 -4.85 1.62 9.92 -1.26 -3.73 116.55 112.02 3i4n n ASP 909 Ca 0.18 0.21 -0.35 0.00 -0.53 0.00 0.00 54.79 54.29 3i4n n ASP 909 Cb 0.74 -0.80 -0.06 0.00 -0.64 0.00 0.00 41.12 40.36 3i4n n ASP 909 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3i4n s VAL 910 N -2.03 4.92 -0.08 2.53 1.01 -1.23 -1.58 120.40 123.94 3i4n s VAL 910 Ca 0.42 0.75 0.09 0.00 0.00 0.00 0.00 61.98 63.23 3i4n s VAL 910 Cb -0.19 -3.72 -0.13 0.00 0.00 0.00 0.00 36.38 32.34 3i4n s VAL 910 CO 0.81 0.28 0.22 -0.38 0.00 0.00 0.00 175.10 176.03 3i4n n ILE 911 N 0.91 0.00 -3.46 2.22 5.41 0.11 -4.71 119.36 119.84 3i4n n ILE 911 Ca -0.07 -0.22 -0.12 0.00 1.00 0.00 0.00 62.75 63.35 3i4n n ILE 911 Cb 0.52 0.43 -0.10 0.00 -0.71 0.00 0.00 39.64 39.77 3i4n n ILE 911 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3i4n s ILE 912 N -2.46 -0.51 -0.27 1.39 1.01 -1.19 -3.96 121.20 115.21 3i4n s ILE 912 Ca -0.02 -0.01 -0.22 0.00 0.00 0.00 0.00 60.65 60.40 3i4n s ILE 912 Cb 0.06 -0.71 -0.01 0.00 0.01 0.00 0.00 42.46 41.80 3i4n s ILE 912 CO 0.36 -0.09 0.72 -0.83 0.00 0.00 0.00 174.94 175.09 3i4n s GLY 913 N 2.48 1.77 0.05 6.18 0.00 0.06 -1.12 107.32 116.73 3i4n s GLY 913 Ca 0.08 -0.39 -0.00 0.00 0.00 0.00 0.00 44.72 44.41 3i4n s GLY 913 CO -0.14 1.61 -0.04 1.25 0.00 0.00 0.00 173.10 175.79 3i4n s LYS 914 N 2.71 0.58 0.30 2.90 2.20 -1.26 -1.79 119.74 125.39 3i4n s LYS 914 Ca 0.30 -1.10 0.04 0.00 -0.36 0.00 0.00 55.97 54.85 3i4n s LYS 914 Cb -0.15 0.10 -0.04 0.00 -1.51 0.00 0.00 37.83 36.23 3i4n s LYS 914 CO 0.10 -0.08 0.18 0.95 -0.36 0.00 0.00 175.35 176.15 3i4n s THR 915 N -3.27 0.21 -0.14 3.43 -4.23 -0.29 -2.42 115.64 108.93 3i4n s THR 915 Ca 0.02 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.41 3i4n s THR 915 Cb 0.03 -2.50 0.04 0.00 1.34 0.00 0.00 72.50 71.41 3i4n s THR 915 CO -0.07 0.00 0.37 -0.89 -0.54 0.00 0.00 174.62 173.49 3i4n s THR 916 N -3.62 -0.00 -0.22 3.99 2.01 -0.50 -3.06 115.64 114.23 3i4n s THR 916 Ca 0.37 0.01 -0.17 0.00 0.31 0.00 0.00 61.69 62.20 3i4n s THR 916 Cb 0.04 -0.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.99 3i4n s THR 916 CO 0.19 0.00 0.47 -2.16 -0.69 0.00 0.00 174.62 172.44 3i4n s PRO 917 N 0.30 4.14 -0.03 4.92 0.04 -1.26 -3.40 135.00 139.71 3i4n s PRO 917 Ca -0.01 0.30 -0.01 0.00 0.04 0.00 0.00 61.00 61.32 3i4n s PRO 917 Cb -0.03 -3.59 0.03 0.00 0.04 0.00 0.00 34.50 30.95 3i4n s PRO 917 CO -0.01 -0.19 0.05 0.42 0.04 0.00 0.00 177.00 177.32 3i4n s ILE 918 N 1.79 -0.08 -0.38 0.56 -1.09 -1.26 -5.00 121.20 115.73 3i4n s ILE 918 Ca 0.21 0.28 0.01 0.00 -2.23 0.00 0.00 60.65 58.92 3i4n s ILE 918 Cb -0.15 -0.12 0.12 0.00 -1.58 0.00 0.00 42.46 40.73 3i4n s ILE 918 CO 0.09 0.11 0.18 -0.94 -1.23 0.00 0.00 174.94 173.16 3i4n s SER 919 N 1.42 3.72 0.00 3.58 1.04 -1.26 -5.00 113.70 117.21 3i4n s SER 919 Ca -0.05 -2.24 0.00 0.00 0.48 0.00 0.00 55.95 54.14 3i4n s SER 919 Cb -0.13 -0.92 0.00 0.00 0.10 0.00 0.00 66.02 65.08 3i4n s SER 919 CO -0.03 -0.32 0.00 -1.54 0.98 0.00 0.00 173.24 172.32 3i4n n SER 933 N 4.05 0.00 -2.56 7.02 3.41 -1.26 -5.37 113.62 118.91 3i4n n SER 933 Ca 0.05 -0.80 -0.23 0.00 -0.26 0.00 0.00 58.87 57.64 3i4n n SER 933 Cb 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 3i4n n SER 933 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3i4n n LYS 934 N 0.00 2.83 -1.80 4.33 4.81 -1.26 -4.54 118.16 122.53 3i4n n LYS 934 Ca 0.00 -4.20 -0.41 0.00 -0.87 0.00 0.00 58.31 52.83 3i4n n LYS 934 Cb 0.20 -2.00 -0.00 0.00 0.02 0.00 0.00 35.03 33.25 3i4n n LYS 934 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 3i4n s ARG 935 N -3.42 4.11 0.58 1.64 1.70 -1.22 -4.77 118.95 117.57 3i4n s ARG 935 Ca 0.43 2.57 -0.12 0.00 -0.47 0.00 0.00 55.73 58.14 3i4n s ARG 935 Cb 0.41 -2.97 -0.05 0.00 -0.57 0.00 0.00 34.95 31.77 3i4n s ARG 935 CO -0.13 -0.54 1.00 0.34 -1.08 0.00 0.00 175.30 174.89 3i4n s ASP 936 N -0.11 6.35 0.00 -2.89 -1.08 0.07 -1.41 116.67 117.60 3i4n s ASP 936 Ca 0.53 1.43 0.00 0.00 -0.52 0.00 0.00 52.55 53.99 3i4n s ASP 936 Cb -0.47 -2.47 0.00 0.00 -1.46 0.00 0.00 42.92 38.53 3i4n s ASP 936 CO 0.62 -0.76 0.81 0.00 0.52 0.00 0.00 175.17 176.36 3i4n n ALA 937 N -2.36 3.10 -0.50 3.66 0.00 -1.01 -4.83 120.51 118.57 3i4n n ALA 937 Ca 0.06 -0.44 -0.14 0.00 0.00 0.00 0.00 53.44 52.93 3i4n n ALA 937 Cb 0.54 -0.21 0.22 0.00 0.00 0.00 0.00 19.45 20.00 3i4n n ALA 937 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3i4n n SER 938 N 0.00 -3.45 -3.61 0.00 7.64 -1.25 -4.56 113.62 108.40 3i4n n SER 938 Ca -0.17 -0.71 -0.28 0.00 1.01 0.00 0.00 58.87 58.72 3i4n n SER 938 Cb 0.63 -0.75 -0.16 0.00 -1.01 0.00 0.00 64.21 62.92 3i4n n SER 938 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3i4n s THR 939 N -1.91 0.13 0.73 0.44 2.01 -0.28 -4.92 115.64 111.84 3i4n s THR 939 Ca 0.51 -0.67 -0.12 0.00 0.31 0.00 0.00 61.69 61.73 3i4n s THR 939 Cb -0.08 -0.98 0.03 0.00 0.01 0.00 0.00 72.50 71.48 3i4n s THR 939 CO 0.42 -0.54 1.11 -2.16 -0.69 0.00 0.00 174.62 172.76 3i4n s PRO 940 N 2.01 2.64 0.83 4.92 0.04 -1.26 0.06 135.00 144.24 3i4n s PRO 940 Ca 0.06 0.41 -0.12 0.00 0.04 0.00 0.00 61.00 61.39 3i4n s PRO 940 Cb -0.16 -2.00 0.09 0.00 0.04 0.00 0.00 34.50 32.47 3i4n s PRO 940 CO -0.25 -1.18 1.13 -1.17 0.04 0.00 0.00 177.00 175.58 3i4n s LEU 941 N -5.43 2.40 -0.82 -3.56 2.96 -0.61 -4.81 118.68 108.81 3i4n s LEU 941 Ca 0.59 1.02 -0.25 0.00 -0.22 0.00 0.00 54.13 55.27 3i4n s LEU 941 Cb -0.11 -3.52 0.00 0.00 0.50 0.00 0.00 46.19 43.06 3i4n s LEU 941 CO 0.51 -2.08 1.64 -0.13 -1.32 0.00 0.00 176.35 174.98 3i4n s ARG 942 N -5.34 2.99 0.02 1.98 0.52 -1.26 -4.75 118.95 113.11 3i4n s ARG 942 Ca 0.62 -0.26 -0.00 0.00 -0.52 0.00 0.00 55.73 55.57 3i4n s ARG 942 Cb -0.13 -4.75 0.04 0.00 0.52 0.00 0.00 34.95 30.63 3i4n s ARG 942 CO 0.52 -2.62 0.10 -1.13 0.02 0.00 0.00 175.30 172.19 3i4n n SER 943 N 11.26 -0.01 0.21 0.23 3.41 -1.26 0.12 113.62 127.59 3i4n n SER 943 Ca 0.24 0.10 -0.14 0.00 -0.26 0.00 0.00 58.87 58.81 3i4n n SER 943 Cb 0.50 -0.04 -0.08 0.00 -0.26 0.00 0.00 64.21 64.33 3i4n n SER 943 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3i4n h THR 944 N 0.00 0.57 -4.15 6.66 2.02 -1.89 -3.45 112.91 112.67 3i4n h THR 944 Ca 0.04 -0.40 -0.48 0.00 0.77 0.00 0.00 66.41 66.34 3i4n h THR 944 Cb 0.07 0.75 0.13 0.00 -1.74 0.00 0.00 68.15 67.37 3i4n h THR 944 CO -0.06 0.07 0.28 -1.61 0.37 0.00 0.00 175.52 174.57 3i4n s GLU 945 N -5.05 1.42 0.00 6.66 2.02 0.32 -5.05 118.70 119.02 3i4n s GLU 945 Ca -0.15 0.62 0.00 0.00 0.02 0.00 0.00 54.97 55.46 3i4n s GLU 945 Cb 0.03 -1.84 0.00 0.00 0.10 0.00 0.00 34.13 32.41 3i4n s GLU 945 CO 0.55 -2.08 0.00 0.27 0.02 0.00 0.00 175.26 174.02 3i4n n ASN 946 N -3.74 0.00 0.00 -0.19 0.23 -1.26 -4.60 115.26 105.70 3i4n n ASN 946 Ca 0.07 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.12 3i4n n ASN 946 Cb 0.57 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.27 3i4n n ASN 946 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3i4n n GLY 947 N -0.17 0.37 2.99 4.83 0.00 -0.99 -4.90 105.19 107.32 3i4n n GLY 947 Ca 0.00 0.50 -0.19 0.00 0.00 0.00 0.00 46.02 46.33 3i4n n GLY 947 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i4n s ILE 948 N 2.42 0.68 0.73 -0.61 1.01 -0.55 -2.10 121.20 122.79 3i4n s ILE 948 Ca 0.00 -0.33 -0.16 0.00 0.00 0.00 0.00 60.65 60.17 3i4n s ILE 948 Cb 0.00 -0.60 0.02 0.00 0.01 0.00 0.00 42.46 41.90 3i4n s ILE 948 CO 0.00 0.21 1.10 0.52 0.00 0.00 0.00 174.94 176.77 3i4n n VAL 949 N 3.16 3.06 0.00 2.92 0.31 -0.46 -0.18 118.33 127.13 3i4n n VAL 949 Ca -0.16 -0.35 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 3i4n n VAL 949 Cb 0.55 -1.21 0.00 0.00 -0.91 0.00 0.00 33.84 32.27 3i4n n VAL 949 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3i4n n ASP 950 N -2.18 3.01 0.00 4.52 2.03 0.65 -4.50 116.55 120.07 3i4n n ASP 950 Ca 0.14 -0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.44 3i4n n ASP 950 Cb 0.49 0.62 0.00 0.00 -0.72 0.00 0.00 41.12 41.51 3i4n n ASP 950 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 3i4n n GLN 951 N -0.92 0.00 -4.23 -0.67 7.27 -1.22 -4.94 117.38 112.66 3i4n n GLN 951 Ca 0.00 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.76 3i4n n GLN 951 Cb 0.00 0.00 -0.09 0.00 2.41 0.00 0.00 30.24 32.56 3i4n n GLN 951 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 3i4n s VAL 952 N 0.00 3.97 -0.07 1.69 1.01 -1.26 -1.91 120.40 123.83 3i4n s VAL 952 Ca 0.00 -0.85 -0.06 0.00 0.00 0.00 0.00 61.98 61.07 3i4n s VAL 952 Cb 0.00 -2.83 0.02 0.00 0.00 0.00 0.00 36.38 33.57 3i4n s VAL 952 CO 0.00 0.24 0.17 -1.48 0.00 0.00 0.00 175.10 174.04 3i4n s LEU 953 N -1.93 1.33 -0.21 3.92 2.34 -0.77 -5.02 118.68 118.34 3i4n s LEU 953 Ca 0.22 0.35 0.00 0.00 0.06 0.00 0.00 54.13 54.77 3i4n s LEU 953 Cb -0.12 0.60 0.05 0.00 -0.56 0.00 0.00 46.19 46.16 3i4n s LEU 953 CO 0.14 -0.06 -0.06 -0.69 -1.06 0.00 0.00 176.35 174.62 3i4n s VAL 954 N 0.10 1.41 0.38 1.48 1.01 -1.26 -2.14 120.40 121.37 3i4n s VAL 954 Ca -0.00 -0.99 0.08 0.00 0.00 0.00 0.00 61.98 61.07 3i4n s VAL 954 Cb -0.01 -1.62 -0.07 0.00 0.00 0.00 0.00 36.38 34.69 3i4n s VAL 954 CO 0.00 0.02 0.01 -0.89 0.00 0.00 0.00 175.10 174.24 3i4n s THR 955 N 1.48 2.26 0.00 3.92 2.01 0.44 -4.94 115.64 120.80 3i4n s THR 955 Ca -0.03 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 59.97 3i4n s THR 955 Cb -0.17 -2.86 0.00 0.00 0.01 0.00 0.00 72.50 69.48 3i4n s THR 955 CO -0.07 -0.10 0.00 0.41 -0.69 0.00 0.00 174.62 174.17 3i4n n THR 956 N -0.96 0.00 0.00 -0.82 -1.04 -1.26 0.20 114.28 110.39 3i4n n THR 956 Ca -0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 3i4n n THR 956 Cb 0.65 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.16 3i4n n THR 956 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 3i4n n ASN 957 N 0.00 0.00 0.00 8.00 5.15 -1.19 -3.55 115.26 123.67 3i4n n ASN 957 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 3i4n n ASN 957 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 3i4n n ASN 957 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3i4n n GLN 958 N -0.16 0.00 0.00 1.20 6.02 -1.26 0.87 117.38 124.05 3i4n n GLN 958 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3i4n n GLN 958 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 3i4n n GLN 958 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3i4n n ASP 959 N -3.20 0.00 0.00 1.08 8.00 -1.26 -3.43 116.55 117.75 3i4n n ASP 959 Ca 0.00 0.71 0.00 0.00 0.71 0.00 0.00 54.79 56.21 3i4n n ASP 959 Cb 0.00 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 40.65 3i4n n ASP 959 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3i4n n GLY 960 N 0.45 0.09 3.28 0.44 0.00 0.25 -4.41 105.19 105.29 3i4n n GLY 960 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3i4n n GLY 960 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i4n n LEU 961 N 0.00 -3.13 -4.66 0.99 4.77 -1.26 -4.30 117.00 109.42 3i4n n LEU 961 Ca 0.00 0.67 -0.43 0.00 -0.03 0.00 0.00 56.01 56.22 3i4n n LEU 961 Cb 0.00 -0.89 -0.02 0.00 -2.33 0.00 0.00 43.42 40.18 3i4n n LEU 961 CO 0.00 -4.58 0.98 -0.54 -1.33 0.00 0.00 177.39 171.92 3i4n s LYS 962 N -1.13 4.24 -0.18 3.23 1.02 -1.26 -3.18 119.74 122.48 3i4n s LYS 962 Ca 0.58 1.44 -0.04 0.00 0.02 0.00 0.00 55.97 57.97 3i4n s LYS 962 Cb -0.49 -3.69 -0.03 0.00 -0.52 0.00 0.00 37.83 33.11 3i4n s LYS 962 CO 0.65 -0.67 -0.02 0.12 -0.92 0.00 0.00 175.35 174.50 3i4n s PHE 963 N 3.33 3.03 -0.04 3.18 5.36 0.13 -2.80 117.98 130.18 3i4n s PHE 963 Ca 0.48 -0.38 0.02 0.00 -0.96 0.00 0.00 56.93 56.08 3i4n s PHE 963 Cb -0.17 -2.02 0.01 0.00 -0.34 0.00 0.00 43.02 40.51 3i4n s PHE 963 CO 0.09 -0.14 -0.07 0.08 -1.46 0.00 0.00 175.22 173.73 3i4n s VAL 964 N 0.67 0.67 0.00 3.12 1.01 -0.31 -0.42 120.40 125.14 3i4n s VAL 964 Ca -0.01 -0.24 0.08 0.00 0.00 0.00 0.00 61.98 61.81 3i4n s VAL 964 Cb -0.14 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.58 3i4n s VAL 964 CO 0.02 0.24 -0.26 -0.54 0.00 0.00 0.00 175.10 174.56 3i4n s LYS 965 N 0.58 1.95 -0.06 2.72 1.02 -0.91 -1.15 119.74 123.87 3i4n s LYS 965 Ca -0.09 -0.98 0.03 0.00 0.02 0.00 0.00 55.97 54.95 3i4n s LYS 965 Cb -0.12 -1.97 0.01 0.00 -0.52 0.00 0.00 37.83 35.23 3i4n s LYS 965 CO 0.01 0.53 -0.14 0.08 -0.92 0.00 0.00 175.35 174.90 3i4n s VAL 966 N -0.67 1.29 0.00 3.17 1.01 -0.06 -1.85 120.40 123.29 3i4n s VAL 966 Ca 0.10 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.54 3i4n s VAL 966 Cb -0.10 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 3i4n s VAL 966 CO 0.00 0.39 -0.08 -0.60 0.00 0.00 0.00 175.10 174.81 3i4n s ARG 967 N 0.50 2.52 -0.09 2.72 3.52 -0.80 -1.36 118.95 125.95 3i4n s ARG 967 Ca -0.13 -0.74 0.02 0.00 -0.13 0.00 0.00 55.73 54.75 3i4n s ARG 967 Cb -0.15 -2.48 0.01 0.00 -1.56 0.00 0.00 34.95 30.78 3i4n s ARG 967 CO 0.04 0.60 -0.14 0.08 -0.81 0.00 0.00 175.30 175.07 3i4n s VAL 968 N -0.98 1.35 0.12 7.11 1.01 -0.68 -0.26 120.40 128.07 3i4n s VAL 968 Ca 0.17 -0.57 -0.06 0.00 0.00 0.00 0.00 61.98 61.51 3i4n s VAL 968 Cb -0.11 -1.24 -0.06 0.00 0.00 0.00 0.00 36.38 34.98 3i4n s VAL 968 CO 0.07 0.41 0.38 -0.60 0.00 0.00 0.00 175.10 175.36 3i4n s ARG 969 N 0.89 3.66 -0.20 2.72 3.52 0.75 -2.55 118.95 127.73 3i4n s ARG 969 Ca -0.09 -0.00 -0.14 0.00 -0.13 0.00 0.00 55.73 55.36 3i4n s ARG 969 Cb -0.15 -2.89 0.06 0.00 -1.56 0.00 0.00 34.95 30.40 3i4n s ARG 969 CO 0.01 0.50 0.52 0.99 -0.81 0.00 0.00 175.30 176.50 3i4n s THR 970 N -1.57 -0.01 -0.18 4.11 2.01 -0.70 -1.48 115.64 117.82 3i4n s THR 970 Ca 0.38 0.04 -0.12 0.00 0.31 0.00 0.00 61.69 62.30 3i4n s THR 970 Cb -0.13 -0.74 -0.05 0.00 0.01 0.00 0.00 72.50 71.59 3i4n s THR 970 CO 0.22 0.01 0.21 -0.89 -0.69 0.00 0.00 174.62 173.48 3i4n s THR 971 N 1.00 5.36 -0.33 -0.82 2.01 -1.26 -2.20 115.64 119.40 3i4n s THR 971 Ca -0.06 0.36 -0.03 0.00 0.31 0.00 0.00 61.69 62.28 3i4n s THR 971 Cb -0.06 -3.55 0.06 0.00 0.01 0.00 0.00 72.50 68.97 3i4n s THR 971 CO -0.09 0.42 0.06 -0.54 -0.69 0.00 0.00 174.62 173.78 3i4n s LYS 972 N 0.37 2.35 0.25 4.92 1.02 -1.22 -5.00 119.74 122.43 3i4n s LYS 972 Ca 0.12 -1.38 -0.24 0.00 0.02 0.00 0.00 55.97 54.49 3i4n s LYS 972 Cb -0.12 -3.31 -0.09 0.00 -0.52 0.00 0.00 37.83 33.79 3i4n s LYS 972 CO 0.01 -0.73 0.83 0.42 -0.92 0.00 0.00 175.35 174.96 3i4n s ILE 973 N 1.24 4.35 0.23 2.17 1.01 -1.26 -2.86 121.20 126.09 3i4n s ILE 973 Ca -0.02 1.64 -0.31 0.00 0.00 0.00 0.00 60.65 61.96 3i4n s ILE 973 Cb -0.20 -4.01 -0.12 0.00 0.01 0.00 0.00 42.46 38.14 3i4n s ILE 973 CO -0.01 0.28 1.66 -2.16 0.00 0.00 0.00 174.94 174.70 3i4n s PRO 974 N -1.76 4.13 0.48 2.79 0.04 -1.26 -5.00 135.00 134.43 3i4n s PRO 974 Ca 0.44 2.57 0.04 0.00 0.04 0.00 0.00 61.00 64.08 3i4n s PRO 974 Cb -0.20 -3.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.25 3i4n s PRO 974 CO 0.24 -0.69 0.06 -1.14 0.04 0.00 0.00 177.00 175.51 3i4n s GLN 975 N 0.57 2.15 0.54 4.56 0.74 -1.26 -5.04 119.66 121.92 3i4n s GLN 975 Ca 0.70 -2.23 0.22 0.00 0.05 0.00 0.00 55.36 54.10 3i4n s GLN 975 Cb -0.48 -1.66 1.41 0.00 1.10 0.00 0.00 33.01 33.38 3i4n s GLN 975 CO 0.38 -0.29 2.10 0.82 -0.55 0.00 0.00 175.29 177.75 3i4n h ILE 976 N 1.40 0.80 0.00 -2.34 2.04 -1.93 -2.86 117.51 114.62 3i4n h ILE 976 Ca -0.43 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.43 3i4n h ILE 976 Cb 1.29 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 3i4n h ILE 976 CO 0.74 0.00 -1.26 0.61 0.00 0.00 0.00 178.15 178.24 3i4n n GLY 977 N -1.53 -1.14 3.41 5.37 0.00 -1.26 -3.57 105.19 106.47 3i4n n GLY 977 Ca 0.02 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.20 3i4n n GLY 977 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3i4n n ASP 978 N -2.01 -1.67 -4.92 1.61 9.92 -1.08 -4.20 116.55 114.20 3i4n n ASP 978 Ca 0.01 0.73 -0.31 0.00 -0.53 0.00 0.00 54.79 54.69 3i4n n ASP 978 Cb 0.46 -1.09 -0.04 0.00 -0.64 0.00 0.00 41.12 39.81 3i4n n ASP 978 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 3i4n s LYS 979 N -1.79 3.44 0.20 -1.24 2.20 -1.24 -1.75 119.74 119.57 3i4n s LYS 979 Ca 0.66 -0.44 -0.10 0.00 -0.36 0.00 0.00 55.97 55.72 3i4n s LYS 979 Cb -0.47 -3.03 -0.01 0.00 -1.51 0.00 0.00 37.83 32.81 3i4n s LYS 979 CO 0.57 0.60 0.36 -0.06 -0.36 0.00 0.00 175.35 176.47 3i4n s PHE 980 N -1.52 0.42 -0.12 4.03 2.99 -0.64 -3.95 117.98 119.20 3i4n s PHE 980 Ca 0.35 -0.77 -0.31 0.00 0.00 0.00 0.00 56.93 56.21 3i4n s PHE 980 Cb -0.13 0.02 0.12 0.00 0.00 0.00 0.00 43.02 43.04 3i4n s PHE 980 CO 0.28 -0.83 1.02 0.00 -0.00 0.00 0.00 175.22 175.69 3i4n s ALA 981 N -4.00 -1.93 0.32 5.36 0.00 -0.42 -1.96 121.76 119.13 3i4n s ALA 981 Ca 0.21 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.57 3i4n s ALA 981 Cb 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.90 3i4n s ALA 981 CO 0.05 -0.50 0.00 -1.13 0.00 0.00 0.00 175.76 174.18 3i4n n SER 982 N 0.21 0.00 -0.49 0.00 3.41 -1.25 -0.06 113.62 115.43 3i4n n SER 982 Ca -0.07 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.60 3i4n n SER 982 Cb 0.59 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.70 3i4n n SER 982 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3i4n n ARG 983 N 0.00 2.65 -1.47 4.33 1.74 -1.26 -4.54 116.66 118.10 3i4n n ARG 983 Ca 0.00 -2.27 -0.05 0.00 -0.77 0.00 0.00 57.85 54.76 3i4n n ARG 983 Cb 0.00 -1.43 0.10 0.00 -1.02 0.00 0.00 32.46 30.11 3i4n n ARG 983 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3i4n n HIS 984 N -0.33 1.04 -3.67 -1.55 8.25 -1.26 -4.72 115.22 112.98 3i4n n HIS 984 Ca 0.13 -1.65 -0.23 0.00 -0.26 0.00 0.00 57.72 55.71 3i4n n HIS 984 Cb 0.57 -0.26 0.05 0.00 1.12 0.00 0.00 29.99 31.47 3i4n n HIS 984 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i4n n GLY 985 N -0.67 -0.40 2.78 -1.41 0.00 -1.25 -4.82 105.19 99.41 3i4n n GLY 985 Ca 0.23 0.16 -0.37 0.00 0.00 0.00 0.00 46.02 46.04 3i4n n GLY 985 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3i4n n GLN 986 N -4.47 3.58 -0.75 1.61 -0.06 -1.26 -4.95 117.38 111.07 3i4n n GLN 986 Ca -0.16 -4.08 -0.33 0.00 -2.00 0.00 0.00 57.00 50.42 3i4n n GLN 986 Cb 0.62 -2.31 0.14 0.00 -4.06 0.00 0.00 30.24 24.63 3i4n n GLN 986 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 3i4n n LYS 987 N -0.39 -1.03 0.00 3.69 5.02 -1.26 -3.83 118.16 120.36 3i4n n LYS 987 Ca 0.48 -0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.49 3i4n n LYS 987 Cb 0.32 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 3i4n n LYS 987 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i4n n GLY 988 N 2.05 3.28 3.92 0.72 0.00 -0.83 -4.65 105.19 109.69 3i4n n GLY 988 Ca 0.02 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 3i4n n GLY 988 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3i4n s THR 989 N 0.00 5.18 1.10 2.61 -4.23 -1.22 -1.62 115.64 117.47 3i4n s THR 989 Ca 0.00 -0.27 -0.15 0.00 -1.18 0.00 0.00 61.69 60.09 3i4n s THR 989 Cb 0.00 -3.72 0.17 0.00 1.34 0.00 0.00 72.50 70.29 3i4n s THR 989 CO 0.00 -0.17 0.54 -0.38 -0.54 0.00 0.00 174.62 174.07 3i4n n ILE 990 N -0.61 0.00 0.00 2.99 5.41 -0.72 -1.50 119.36 124.93 3i4n n ILE 990 Ca -0.04 -0.32 0.00 0.00 1.00 0.00 0.00 62.75 63.39 3i4n n ILE 990 Cb 0.54 -0.79 0.00 0.00 -0.71 0.00 0.00 39.64 38.68 3i4n n ILE 990 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3i4n n GLY 991 N 1.42 0.00 3.57 7.39 0.00 0.95 -4.55 105.19 113.97 3i4n n GLY 991 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.98 3i4n n GLY 991 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3i4n s ILE 992 N -1.55 0.00 -0.08 -0.61 2.07 -1.25 -4.97 121.20 114.81 3i4n s ILE 992 Ca 0.00 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.26 3i4n s ILE 992 Cb 0.00 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.57 3i4n s ILE 992 CO 0.00 0.00 -0.13 0.42 -1.91 0.00 0.00 174.94 173.32 3i4n s THR 993 N -2.17 3.18 0.27 4.00 -4.23 -1.26 -2.82 115.64 112.61 3i4n s THR 993 Ca 0.05 -0.66 0.08 0.00 -1.18 0.00 0.00 61.69 59.99 3i4n s THR 993 Cb -0.01 -2.28 -0.05 0.00 1.34 0.00 0.00 72.50 71.49 3i4n s THR 993 CO -0.05 0.57 -0.11 -0.31 -0.54 0.00 0.00 174.62 174.18 3i4n s TYR 994 N -0.38 2.03 0.37 3.99 1.51 -1.11 -4.79 117.35 118.97 3i4n s TYR 994 Ca 0.04 -0.56 0.08 0.00 -1.01 0.00 0.00 57.07 55.62 3i4n s TYR 994 Cb -0.12 -1.06 -0.03 0.00 -0.11 0.00 0.00 41.96 40.64 3i4n s TYR 994 CO 0.02 0.44 0.26 1.03 -1.11 0.00 0.00 175.55 176.19 3i4n s ARG 995 N -3.65 2.52 0.50 -0.62 0.52 -1.26 0.39 118.95 117.35 3i4n s ARG 995 Ca 0.28 -1.50 0.32 0.00 -0.52 0.00 0.00 55.73 54.32 3i4n s ARG 995 Cb 0.01 -2.31 1.43 0.00 0.52 0.00 0.00 34.95 34.60 3i4n s ARG 995 CO 0.12 -0.01 1.78 0.00 0.02 0.00 0.00 175.30 177.21 3i4n h ARG 996 N 1.29 0.11 -0.58 3.54 3.08 -1.97 -0.21 114.38 119.64 3i4n h ARG 996 Ca -0.43 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.62 3i4n h ARG 996 Cb 1.26 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.25 3i4n h ARG 996 CO 0.61 0.07 0.38 0.93 -1.07 0.00 0.00 179.97 180.89 3i4n h GLU 997 N 0.11 0.76 0.00 0.04 3.07 -1.94 -2.39 114.58 114.24 3i4n h GLU 997 Ca 0.60 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 59.38 3i4n h GLU 997 Cb 2.13 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 29.86 3i4n h GLU 997 CO -0.11 0.51 -1.78 -0.25 -1.40 0.00 0.00 179.01 175.98 3i4n n ASP 998 N -4.44 0.23 -4.73 1.42 8.00 -0.37 -4.20 116.55 112.45 3i4n n ASP 998 Ca 0.06 0.09 -0.35 0.00 0.71 0.00 0.00 54.79 55.30 3i4n n ASP 998 Cb 0.05 1.50 0.07 0.00 -0.02 0.00 0.00 41.12 42.73 3i4n n ASP 998 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3i4n s MET 999 N -3.39 2.46 0.10 -1.24 1.75 -0.23 -4.09 119.30 114.65 3i4n s MET 999 Ca -0.06 1.81 -0.25 0.00 -1.25 0.00 0.00 55.69 55.93 3i4n s MET 999 Cb 0.12 -1.87 -0.07 0.00 2.84 0.00 0.00 34.83 35.86 3i4n s MET 999 CO 0.87 -1.60 0.78 -1.25 -0.65 0.00 0.00 175.02 173.17 3i4n s PRO 1000N -3.69 4.54 0.14 4.11 0.04 -1.26 -3.45 135.00 135.44 3i4n s PRO 1000Ca 0.76 1.12 0.06 0.00 0.04 0.00 0.00 61.00 62.99 3i4n s PRO 1000Cb -0.30 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 30.88 3i4n s PRO 1000CO 0.41 0.42 -0.14 -0.59 0.04 0.00 0.00 177.00 177.13 3i4n s PHE 1001N -0.56 1.49 -0.11 0.56 -0.12 -1.08 -4.26 117.98 113.89 3i4n s PHE 1001Ca 0.38 -0.57 -0.03 0.00 -0.05 0.00 0.00 56.93 56.65 3i4n s PHE 1001Cb -0.22 -0.75 -0.03 0.00 -0.63 0.00 0.00 43.02 41.39 3i4n s PHE 1001CO 0.25 0.20 0.01 -0.08 -0.05 0.00 0.00 175.22 175.54 3i4n s THR 1002N -2.42 4.33 0.11 -4.49 -1.32 -1.03 -0.12 115.64 110.70 3i4n s THR 1002Ca 0.13 -0.23 0.03 0.00 -1.21 0.00 0.00 61.69 60.41 3i4n s THR 1002Cb -0.03 -2.85 0.13 0.00 -1.51 0.00 0.00 72.50 68.24 3i4n s THR 1002CO 0.04 0.58 0.53 0.00 -2.21 0.00 0.00 174.62 173.55 3i4n n ALA 1003N 2.47 0.24 -0.20 11.08 0.00 -1.26 0.30 120.51 133.14 3i4n n ALA 1003Ca -0.18 0.35 0.30 0.00 0.00 0.00 0.00 53.44 53.92 3i4n n ALA 1003Cb 0.53 -0.29 0.72 0.00 0.00 0.00 0.00 19.45 20.41 3i4n n ALA 1003CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3i4n h GLU 1004N 0.00 0.00 0.00 0.00 4.39 -1.94 -3.44 114.58 113.58 3i4n h GLU 1004Ca 0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.94 3i4n h GLU 1004Cb 0.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 3i4n h GLU 1004CO -0.30 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 177.96 3i4n n GLY 1005N -1.70 3.14 3.32 -3.84 0.00 0.89 -5.07 105.19 101.93 3i4n n GLY 1005Ca 0.20 -1.02 -0.39 0.00 0.00 0.00 0.00 46.02 44.81 3i4n n GLY 1005CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3i4n n ILE 1006N 0.00 0.69 -3.85 -0.61 -5.35 -1.25 -4.49 119.36 104.50 3i4n n ILE 1006Ca 0.00 -0.50 -0.12 0.00 -0.27 0.00 0.00 62.75 61.86 3i4n n ILE 1006Cb 0.00 -0.18 -0.10 0.00 -1.74 0.00 0.00 39.64 37.62 3i4n n ILE 1006CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3i4n s VAL 1007N -1.85 0.07 0.52 7.28 0.11 -1.26 -2.47 120.40 122.80 3i4n s VAL 1007Ca 0.60 -0.61 -0.21 0.00 -2.93 0.00 0.00 61.98 58.83 3i4n s VAL 1007Cb -0.52 -0.46 -0.06 0.00 -1.53 0.00 0.00 36.38 33.81 3i4n s VAL 1007CO 0.63 -0.34 1.19 -2.16 -3.33 0.00 0.00 175.10 171.09 3i4n s PRO 1008N -1.29 3.42 -0.00 1.54 0.04 -1.26 -4.90 135.00 132.54 3i4n s PRO 1008Ca -0.14 1.80 0.22 0.00 0.04 0.00 0.00 61.00 62.92 3i4n s PRO 1008Cb -0.07 -2.19 -0.30 0.00 0.04 0.00 0.00 34.50 31.98 3i4n s PRO 1008CO 0.02 -0.83 0.54 -0.25 0.04 0.00 0.00 177.00 176.52 3i4n n ASP 1009N -0.98 0.09 -3.91 6.66 8.00 -0.35 -4.35 116.55 121.71 3i4n n ASP 1009Ca 0.10 0.04 -0.12 0.00 0.71 0.00 0.00 54.79 55.52 3i4n n ASP 1009Cb 0.49 1.83 -0.13 0.00 -0.02 0.00 0.00 41.12 43.28 3i4n n ASP 1009CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3i4n s LEU 1010N -4.61 2.06 -0.48 0.64 2.96 -1.18 -1.62 118.68 116.45 3i4n s LEU 1010Ca -0.07 -0.13 0.04 0.00 -0.22 0.00 0.00 54.13 53.74 3i4n s LEU 1010Cb 0.14 -0.02 0.16 0.00 0.50 0.00 0.00 46.19 46.97 3i4n s LEU 1010CO 0.90 -0.06 0.36 -0.63 -1.32 0.00 0.00 176.35 175.59 3i4n s ILE 1011N -0.36 1.09 0.16 6.68 1.01 -0.14 -0.76 121.20 128.88 3i4n s ILE 1011Ca -0.03 -2.97 -0.27 0.00 0.00 0.00 0.00 60.65 57.38 3i4n s ILE 1011Cb -0.03 -1.74 -0.08 0.00 0.01 0.00 0.00 42.46 40.62 3i4n s ILE 1011CO -0.00 -1.12 0.84 0.27 0.00 0.00 0.00 174.94 174.93 3i4n s ILE 1012N -0.20 4.36 0.14 2.92 -4.36 -0.93 -3.46 121.20 119.68 3i4n s ILE 1012Ca 0.28 1.84 -0.31 0.00 -0.26 0.00 0.00 60.65 62.19 3i4n s ILE 1012Cb -0.04 -4.21 -0.10 0.00 1.25 0.00 0.00 42.46 39.37 3i4n s ILE 1012CO -0.15 0.47 1.59 0.21 0.24 0.00 0.00 174.94 177.30 3i4n s ASN 1013N -0.85 6.59 0.62 4.36 3.84 -1.26 -1.64 114.94 126.60 3i4n s ASN 1013Ca 0.39 2.58 0.28 0.00 0.21 0.00 0.00 52.86 56.33 3i4n s ASN 1013Cb -0.23 -2.59 1.48 0.00 -0.55 0.00 0.00 41.25 39.36 3i4n s ASN 1013CO 0.28 -0.84 1.88 1.55 -2.79 0.00 0.00 177.10 177.17 3i4n h PRO 1014N 7.20 0.00 0.00 0.43 0.13 -1.85 -2.98 132.00 134.92 3i4n h PRO 1014Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3i4n h PRO 1014Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3i4n h PRO 1014CO 0.92 0.00 0.00 0.45 -0.23 0.00 0.00 178.00 179.14 3i4n h HIS 1015N 0.00 0.00 -0.63 1.56 3.86 -1.98 -3.14 115.15 114.83 3i4n h HIS 1015Ca 0.14 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 59.02 3i4n h HIS 1015Cb 1.05 0.00 -0.19 0.00 1.06 0.00 0.00 27.41 29.32 3i4n h HIS 1015CO 0.00 0.00 0.42 0.00 0.86 0.00 0.00 177.93 179.21 3i4n n ALA 1016N -1.83 4.48 0.02 2.45 0.00 -1.13 -4.43 120.51 120.08 3i4n n ALA 1016Ca 0.01 -1.83 -0.01 0.00 0.00 0.00 0.00 53.44 51.60 3i4n n ALA 1016Cb 0.17 -1.29 -0.00 0.00 0.00 0.00 0.00 19.45 18.33 3i4n n ALA 1016CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3i4n n ILE 1017N -0.52 0.97 -0.20 0.00 2.08 -1.19 -4.60 119.36 115.90 3i4n n ILE 1017Ca 0.38 0.30 0.01 0.00 0.56 0.00 0.00 62.75 64.00 3i4n n ILE 1017Cb 1.22 -1.54 0.10 0.00 -0.75 0.00 0.00 39.64 38.67 3i4n n ILE 1017CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 3i4n h PRO 1018N -0.10 0.11 -0.08 0.38 0.11 -1.78 0.63 132.00 131.26 3i4n h PRO 1018Ca 0.00 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.91 3i4n h PRO 1018Cb 0.10 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.19 3i4n h PRO 1018CO 0.00 0.07 -0.77 0.66 -0.21 0.00 0.00 178.00 177.75 3i4n h SER 1019N 0.11 0.58 1.19 -2.05 4.64 -1.89 -3.24 113.55 112.89 3i4n h SER 1019Ca 0.32 -0.39 -0.16 0.00 -0.47 0.00 0.00 61.79 61.09 3i4n h SER 1019Cb 0.52 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 3i4n h SER 1019CO -0.53 1.15 -0.83 0.03 -0.87 0.00 0.00 176.83 175.78 3i4n h ARG 1020N 0.32 0.00 -6.08 4.77 3.08 -1.72 -3.48 114.38 111.27 3i4n h ARG 1020Ca -0.04 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.65 3i4n h ARG 1020Cb 1.36 0.00 0.08 0.00 0.08 0.00 0.00 29.97 31.49 3i4n h ARG 1020CO 0.14 0.65 -0.82 -1.33 -1.07 0.00 0.00 179.97 177.53 3i4n n MET 1021N -3.22 -1.37 -3.64 0.04 2.81 0.22 -4.48 117.12 107.47 3i4n n MET 1021Ca -0.01 0.67 -0.31 0.00 -1.81 0.00 0.00 57.70 56.24 3i4n n MET 1021Cb 0.83 -4.34 -0.08 0.00 -0.71 0.00 0.00 33.22 28.92 3i4n n MET 1021CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3i4n n THR 1022N -3.60 2.50 -0.17 2.03 -2.24 -1.25 -2.62 114.28 108.93 3i4n n THR 1022Ca -0.10 -5.11 -0.07 0.00 -2.27 0.00 0.00 64.05 56.50 3i4n n THR 1022Cb 0.59 -2.22 0.08 0.00 -2.10 0.00 0.00 70.33 66.68 3i4n n THR 1022CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 3i4n h VAL 1023N 3.91 1.26 0.00 2.28 2.07 -1.90 -2.40 116.25 121.47 3i4n h VAL 1023Ca 0.17 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.59 3i4n h VAL 1023Cb 0.74 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3i4n h VAL 1023CO 0.83 0.40 0.52 0.00 0.02 0.00 0.00 177.57 179.34 3i4n h ALA 1024N 1.10 1.41 0.03 1.67 0.00 -1.83 1.73 119.26 123.37 3i4n h ALA 1024Ca 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3i4n h ALA 1024Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3i4n h ALA 1024CO 0.03 -0.41 -0.01 1.25 0.00 0.00 0.00 179.25 180.10 3i4n h HIS 1025N 0.00 -0.04 -0.91 0.00 6.17 -1.76 -2.08 115.15 116.53 3i4n h HIS 1025Ca 0.00 -0.00 0.10 0.00 0.71 0.00 0.00 60.37 61.18 3i4n h HIS 1025Cb 1.04 0.01 -0.08 0.00 2.52 0.00 0.00 27.41 30.91 3i4n h HIS 1025CO 0.00 0.35 0.56 -0.07 0.71 0.00 0.00 177.93 179.48 3i4n h LEU 1026N -0.99 0.82 0.62 0.26 3.38 0.23 -1.94 115.31 117.68 3i4n h LEU 1026Ca -0.00 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3i4n h LEU 1026Cb 0.40 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.03 3i4n h LEU 1026CO 0.01 0.47 -0.30 0.40 0.09 0.00 0.00 178.44 179.11 3i4n h ILE 1027N 0.93 0.34 -0.97 1.22 2.04 -0.40 -2.22 117.51 118.45 3i4n h ILE 1027Ca 0.44 -0.17 0.21 0.00 1.00 0.00 0.00 64.86 66.33 3i4n h ILE 1027Cb 0.37 0.40 -0.09 0.00 -0.74 0.00 0.00 36.82 36.76 3i4n h ILE 1027CO -0.24 0.02 0.62 -0.08 0.00 0.00 0.00 178.15 178.47 3i4n h GLU 1028N -0.95 0.56 -0.65 2.37 4.81 -1.04 0.19 114.58 119.86 3i4n h GLU 1028Ca -0.08 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 3i4n h GLU 1028Cb 0.67 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.89 3i4n h GLU 1028CO 0.14 0.37 0.39 0.00 -0.73 0.00 0.00 179.01 179.17 3i4n h LEU 1030N 0.89 0.24 -0.64 0.00 5.85 -0.41 -2.47 115.31 118.76 3i4n h LEU 1030Ca 0.23 -0.71 0.03 0.00 0.84 0.00 0.00 57.88 58.28 3i4n h LEU 1030Cb -0.01 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 3i4n h LEU 1030CO -0.04 0.91 0.39 0.25 -0.34 0.00 0.00 178.44 179.61 3i4n h LEU 1031N -0.40 0.62 -0.84 2.25 5.85 -0.57 -2.43 115.31 119.79 3i4n h LEU 1031Ca -0.02 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.59 3i4n h LEU 1031Cb 0.93 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 3i4n h LEU 1031CO 0.05 0.43 -0.57 0.28 -0.34 0.00 0.00 178.44 178.29 3i4n h SER 1032N 0.75 0.00 0.85 1.25 0.02 -0.17 -2.44 113.55 113.81 3i4n h SER 1032Ca 0.27 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.21 3i4n h SER 1032Cb 0.06 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 3i4n h SER 1032CO -0.12 0.57 -0.04 0.50 -1.14 0.00 0.00 176.83 176.59 3i4n h LYS 1033N 0.00 0.00 0.00 3.45 3.64 -0.97 -2.00 116.57 120.69 3i4n h LYS 1033Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3i4n h LYS 1033Cb 1.03 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 3i4n h LYS 1033CO 0.07 0.04 0.00 0.28 -2.27 0.00 0.00 179.45 177.58 3i4n n VAL 1034N -3.18 0.00 0.00 2.00 0.31 -1.02 -3.42 118.33 113.02 3i4n n VAL 1034Ca -0.00 0.43 0.00 0.00 -0.01 0.00 0.00 64.34 64.76 3i4n n VAL 1034Cb 0.30 -1.31 0.00 0.00 -0.91 0.00 0.00 33.84 31.91 3i4n n VAL 1034CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i4n n ALA 1035N -1.85 0.91 -0.00 3.52 0.00 -0.95 0.22 120.51 122.36 3i4n n ALA 1035Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 3i4n n ALA 1035Cb 0.00 -0.66 -0.14 0.00 0.00 0.00 0.00 19.45 18.65 3i4n n ALA 1035CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n n ALA 1036N -0.95 2.57 -0.03 0.00 0.00 -0.75 -1.22 120.51 120.13 3i4n n ALA 1036Ca 0.00 -0.57 -0.16 0.00 0.00 0.00 0.00 53.44 52.72 3i4n n ALA 1036Cb 0.04 -0.75 -0.14 0.00 0.00 0.00 0.00 19.45 18.60 3i4n n ALA 1036CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3i4n n LEU 1037N -2.41 1.85 -0.03 0.00 4.77 0.61 -4.45 117.00 117.33 3i4n n LEU 1037Ca -0.07 0.22 0.03 0.00 -0.03 0.00 0.00 56.01 56.16 3i4n n LEU 1037Cb 0.65 -0.52 -0.13 0.00 -2.33 0.00 0.00 43.42 41.09 3i4n n LEU 1037CO 0.45 0.68 -0.82 -1.54 -1.33 0.00 0.00 177.39 174.82 3i4n n SER 1038N -3.24 1.07 -2.29 -1.43 3.41 -0.64 -5.06 113.62 105.44 3i4n n SER 1038Ca -0.29 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.30 3i4n n SER 1038Cb 1.05 1.46 0.01 0.00 -0.26 0.00 0.00 64.21 66.47 3i4n n SER 1038CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i4n n GLY 1039N 1.71 -0.52 2.46 5.00 0.00 -0.36 -5.03 105.19 108.45 3i4n n GLY 1039Ca -0.12 0.13 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 3i4n n GLY 1039CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i4n s ASN 1040N -2.73 1.19 0.00 1.61 0.01 -1.16 -5.03 114.94 108.82 3i4n s ASN 1040Ca 0.08 -2.75 0.00 0.00 -0.71 0.00 0.00 52.86 49.48 3i4n s ASN 1040Cb -0.01 -0.09 0.00 0.00 0.41 0.00 0.00 41.25 41.55 3i4n s ASN 1040CO 0.36 -0.17 0.00 1.21 -1.51 0.00 0.00 177.10 176.99 3i4n n GLU 1041N 3.04 0.00 -0.55 -0.60 2.13 -1.26 -4.58 120.64 118.82 3i4n n GLU 1041Ca 0.26 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.86 3i4n n GLU 1041Cb 0.48 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.16 3i4n n GLU 1041CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3i4n n GLY 1042N 0.00 0.03 3.72 8.31 0.00 -1.19 -4.57 105.19 111.50 3i4n n GLY 1042Ca 0.00 0.31 -0.40 0.00 0.00 0.00 0.00 46.02 45.93 3i4n n GLY 1042CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i4n s ASP 1043N 0.79 7.09 -0.01 1.61 2.15 -1.26 -0.81 116.67 126.23 3i4n s ASP 1043Ca 0.33 1.32 0.05 0.00 0.43 0.00 0.00 52.55 54.67 3i4n s ASP 1043Cb -0.47 -2.45 -0.07 0.00 -0.30 0.00 0.00 42.92 39.63 3i4n s ASP 1043CO 0.25 -0.12 0.09 0.00 -0.17 0.00 0.00 175.17 175.22 3i4n n ALA 1044N 3.66 2.14 0.00 3.66 0.00 0.36 -4.82 120.51 125.51 3i4n n ALA 1044Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.31 3i4n n ALA 1044Cb 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.84 3i4n n ALA 1044CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3i4n n SER 1045N -1.71 0.00 0.00 0.00 7.64 -0.58 -3.08 113.62 115.89 3i4n n SER 1045Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.87 3i4n n SER 1045Cb 0.17 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 3i4n n SER 1045CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3i4n n PRO 1046N 0.00 0.00 -3.67 1.43 -0.02 -1.26 -4.35 135.00 127.13 3i4n n PRO 1046Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.12 3i4n n PRO 1046Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 33.39 3i4n n PRO 1046CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3i4n s PHE 1047N 0.00 3.36 0.00 6.00 0.40 -1.26 -4.72 117.98 121.76 3i4n s PHE 1047Ca 0.00 0.29 0.00 0.00 -0.60 0.00 0.00 56.93 56.62 3i4n s PHE 1047Cb 0.00 -2.25 0.00 0.00 0.51 0.00 0.00 43.02 41.28 3i4n s PHE 1047CO 0.00 0.15 0.00 0.25 0.70 0.00 0.00 175.22 176.32 3i4n n THR 1048N 4.00 0.00 -1.89 0.64 -2.24 -1.26 -4.95 114.28 108.58 3i4n n THR 1048Ca -0.15 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.28 3i4n n THR 1048Cb 0.52 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.74 3i4n n THR 1048CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3i4n n ASP 1049N -1.12 7.21 -4.59 3.42 8.00 -1.26 -4.96 116.55 123.26 3i4n n ASP 1049Ca 0.00 -3.47 -0.26 0.00 0.71 0.00 0.00 54.79 51.78 3i4n n ASP 1049Cb 0.00 -1.19 -0.09 0.00 -0.02 0.00 0.00 41.12 39.82 3i4n n ASP 1049CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3i4n s ILE 1050N -3.27 3.24 0.05 0.53 1.09 -1.26 -5.10 121.20 116.48 3i4n s ILE 1050Ca 0.53 -1.75 -0.13 0.00 -1.10 0.00 0.00 60.65 58.20 3i4n s ILE 1050Cb 0.34 -2.64 0.02 0.00 -1.06 0.00 0.00 42.46 39.12 3i4n s ILE 1050CO -0.25 -0.19 0.29 0.42 -0.10 0.00 0.00 174.94 175.12 3i4n s THR 1051N -1.89 0.09 0.09 2.92 -4.23 -1.26 -4.93 115.64 106.42 3i4n s THR 1051Ca 0.27 -0.72 -0.19 0.00 -1.18 0.00 0.00 61.69 59.86 3i4n s THR 1051Cb -0.08 -0.98 -0.08 0.00 1.34 0.00 0.00 72.50 72.69 3i4n s THR 1051CO 0.16 -0.40 1.59 0.58 -0.54 0.00 0.00 174.62 176.01 3i4n h VAL 1052N 3.14 1.20 -0.90 2.29 2.07 -1.98 0.33 116.25 122.40 3i4n h VAL 1052Ca -0.32 -0.65 0.20 0.00 0.82 0.00 0.00 66.70 66.74 3i4n h VAL 1052Cb 1.20 1.21 -0.07 0.00 -1.52 0.00 0.00 31.29 32.11 3i4n h VAL 1052CO 0.47 0.21 0.59 -0.33 0.02 0.00 0.00 177.57 178.53 3i4n h GLU 1053N 0.18 0.43 0.21 1.57 4.39 -1.95 0.64 114.58 120.07 3i4n h GLU 1053Ca 0.07 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 3i4n h GLU 1053Cb 0.26 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 3i4n h GLU 1053CO -0.00 0.29 -0.10 0.78 -1.16 0.00 0.00 179.01 178.81 3i4n h GLY 1054N 0.44 -0.30 0.87 -3.84 0.00 -1.45 -3.29 103.07 95.50 3i4n h GLY 1054Ca 0.47 0.11 0.01 0.00 0.00 0.00 0.00 47.33 47.92 3i4n h GLY 1054CO -0.19 -0.11 -0.04 -2.22 0.00 0.00 0.00 176.54 173.99 3i4n h ILE 1055N -0.97 0.89 0.00 2.60 2.04 0.21 -1.81 117.51 120.46 3i4n h ILE 1055Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 3i4n h ILE 1055Cb 0.45 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 3i4n h ILE 1055CO 0.05 0.00 0.13 -1.20 0.00 0.00 0.00 178.15 177.12 3i4n n SER 1056N -5.15 0.00 -0.11 1.72 7.64 0.22 0.22 113.62 118.16 3i4n n SER 1056Ca -0.06 0.21 -0.14 0.00 1.01 0.00 0.00 58.87 59.88 3i4n n SER 1056Cb 0.08 -0.21 -0.14 0.00 -1.01 0.00 0.00 64.21 62.94 3i4n n SER 1056CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3i4n n LYS 1057N -1.14 0.67 0.04 1.43 5.02 -0.69 -3.64 118.16 119.84 3i4n n LYS 1057Ca 0.00 0.08 -0.13 0.00 -2.02 0.00 0.00 58.31 56.24 3i4n n LYS 1057Cb 0.13 -1.53 -0.01 0.00 -0.02 0.00 0.00 35.03 33.60 3i4n n LYS 1057CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3i4n h LEU 1058N 0.00 0.61 0.00 -0.35 3.38 -0.14 -2.07 115.31 116.74 3i4n h LEU 1058Ca -0.56 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 56.99 3i4n h LEU 1058Cb 2.06 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.63 3i4n h LEU 1058CO -0.03 1.19 0.00 -0.11 0.09 0.00 0.00 178.44 179.58 3i4n n LEU 1059N -3.84 0.00 -0.01 1.67 7.94 0.07 -1.75 117.00 121.08 3i4n n LEU 1059Ca -0.06 0.12 0.10 0.00 -1.11 0.00 0.00 56.01 55.06 3i4n n LEU 1059Cb 0.75 -0.12 -0.15 0.00 0.53 0.00 0.00 43.42 44.43 3i4n n LEU 1059CO 0.50 -0.02 -0.68 -1.14 -1.11 0.00 0.00 177.39 174.94 3i4n n ARG 1060N -1.12 0.60 0.20 1.96 3.00 -0.86 -3.37 116.66 117.08 3i4n n ARG 1060Ca 0.16 -0.17 0.09 0.00 -0.00 0.00 0.00 57.85 57.94 3i4n n ARG 1060Cb 0.13 -1.47 0.23 0.00 0.00 0.00 0.00 32.46 31.36 3i4n n ARG 1060CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 3i4n h GLU 1061N 0.00 0.00 -0.01 -0.14 5.08 -0.69 -2.98 114.58 115.84 3i4n h GLU 1061Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3i4n h GLU 1061Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 3i4n h GLU 1061CO 0.00 0.21 -0.13 0.72 -1.00 0.00 0.00 179.01 178.81 3i4n n HIS 1062N -3.20 0.00 0.00 4.33 8.25 -1.13 -4.97 115.22 118.51 3i4n n HIS 1062Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 3i4n n HIS 1062Cb 0.55 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.59 3i4n n HIS 1062CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i4n n GLY 1063N 1.26 2.49 3.90 -1.41 0.00 -1.13 -5.06 105.19 105.24 3i4n n GLY 1063Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3i4n n GLY 1063CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i4n s TYR 1064N -2.35 3.48 0.29 1.61 1.51 -1.22 -4.98 117.35 115.69 3i4n s TYR 1064Ca 0.00 0.94 -0.24 0.00 -1.01 0.00 0.00 57.07 56.76 3i4n s TYR 1064Cb 0.00 -2.62 -0.16 0.00 -0.11 0.00 0.00 41.96 39.07 3i4n s TYR 1064CO 0.00 -0.64 0.30 0.94 -1.11 0.00 0.00 175.55 175.04 3i4n n GLN 1065N -2.57 0.00 0.12 -0.62 -0.06 -1.26 -4.33 117.38 108.67 3i4n n GLN 1065Ca 0.04 0.00 0.12 0.00 -2.00 0.00 0.00 57.00 55.16 3i4n n GLN 1065Cb 0.56 -0.97 0.47 0.00 -4.06 0.00 0.00 30.24 26.24 3i4n n GLN 1065CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 3i4n n SER 1066N 2.10 0.68 -0.43 1.69 3.41 -1.26 -2.92 113.62 116.89 3i4n n SER 1066Ca 0.14 0.64 0.05 0.00 -0.26 0.00 0.00 58.87 59.44 3i4n n SER 1066Cb 0.31 -0.80 0.07 0.00 -0.26 0.00 0.00 64.21 63.54 3i4n n SER 1066CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3i4n n ARG 1067N -2.22 1.35 0.00 4.33 5.12 -1.26 -4.24 116.66 119.73 3i4n n ARG 1067Ca 0.03 -1.42 0.00 0.00 -1.93 0.00 0.00 57.85 54.53 3i4n n ARG 1067Cb 0.27 -1.19 0.00 0.00 -1.16 0.00 0.00 32.46 30.38 3i4n n ARG 1067CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3i4n n GLY 1068N 0.44 3.03 2.95 -0.13 0.00 -1.15 -4.98 105.19 105.34 3i4n n GLY 1068Ca 0.07 -0.83 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 3i4n n GLY 1068CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i4n n PHE 1069N 0.00 -2.63 -3.44 1.61 3.01 -1.25 -4.30 117.46 110.47 3i4n n PHE 1069Ca 0.00 0.42 -0.12 0.00 1.01 0.00 0.00 57.45 58.76 3i4n n PHE 1069Cb 0.00 -1.37 -0.02 0.00 -0.01 0.00 0.00 39.48 38.07 3i4n n PHE 1069CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3i4n s GLU 1070N -1.97 1.19 0.40 -1.08 2.02 -0.80 -4.14 118.70 114.32 3i4n s GLU 1070Ca 0.37 -0.38 -0.18 0.00 0.02 0.00 0.00 54.97 54.79 3i4n s GLU 1070Cb 0.01 0.55 -0.10 0.00 0.10 0.00 0.00 34.13 34.69 3i4n s GLU 1070CO 0.71 -0.51 0.87 0.08 0.02 0.00 0.00 175.26 176.43 3i4n s VAL 1071N -3.42 4.51 0.01 2.63 1.01 -1.26 -2.29 120.40 121.59 3i4n s VAL 1071Ca 0.01 1.26 -0.07 0.00 0.00 0.00 0.00 61.98 63.17 3i4n s VAL 1071Cb -0.01 -3.61 -0.00 0.00 0.00 0.00 0.00 36.38 32.75 3i4n s VAL 1071CO -0.10 -0.30 0.12 -0.04 0.00 0.00 0.00 175.10 174.78 3i4n s MET 1072N -3.19 0.50 -0.15 2.72 -1.94 -1.26 -4.44 119.30 111.54 3i4n s MET 1072Ca 0.59 -0.48 -0.04 0.00 -1.71 0.00 0.00 55.69 54.05 3i4n s MET 1072Cb -0.10 0.20 -0.03 0.00 2.01 0.00 0.00 34.83 36.92 3i4n s MET 1072CO 0.16 -0.12 -0.01 0.71 -0.01 0.00 0.00 175.02 175.75 3i4n s TYR 1073N -1.63 3.08 -0.55 -0.03 1.51 0.82 0.15 117.35 120.70 3i4n s TYR 1073Ca -0.13 -0.17 -0.26 0.00 -1.01 0.00 0.00 57.07 55.50 3i4n s TYR 1073Cb -0.07 -1.96 -0.08 0.00 -0.11 0.00 0.00 41.96 39.74 3i4n s TYR 1073CO 0.00 0.06 2.42 -1.71 -1.11 0.00 0.00 175.55 175.21 3i4n n ASN 1074N 3.38 2.22 -0.34 2.29 2.85 -0.28 -2.65 115.26 122.73 3i4n n ASN 1074Ca -0.17 -0.72 0.27 0.00 -0.11 0.00 0.00 54.58 53.85 3i4n n ASN 1074Cb 0.52 -1.61 0.41 0.00 1.24 0.00 0.00 39.78 40.35 3i4n n ASN 1074CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3i4n n GLY 1075N 6.17 -0.52 0.13 8.20 0.00 -1.22 -0.66 105.19 117.29 3i4n n GLY 1075Ca 0.39 0.35 -0.10 0.00 0.00 0.00 0.00 46.02 46.66 3i4n n GLY 1075CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3i4n h HIS 1076N 0.00 -0.21 0.03 1.61 3.86 -1.77 -3.41 115.15 115.26 3i4n h HIS 1076Ca 0.47 -0.00 -0.36 0.00 -1.16 0.00 0.00 60.37 59.31 3i4n h HIS 1076Cb 2.00 0.07 -0.06 0.00 1.06 0.00 0.00 27.41 30.48 3i4n h HIS 1076CO 0.00 0.21 -2.23 0.25 0.86 0.00 0.00 177.93 177.01 3i4n n THR 1077N -4.92 1.54 0.00 2.45 -2.24 -0.49 -4.98 114.28 105.64 3i4n n THR 1077Ca -0.07 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 3i4n n THR 1077Cb 0.25 -1.15 0.00 0.00 -2.10 0.00 0.00 70.33 67.33 3i4n n THR 1077CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i4n n GLY 1078N 1.95 0.27 3.69 3.38 0.00 0.16 -5.03 105.19 109.62 3i4n n GLY 1078Ca -0.35 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 3i4n n GLY 1078CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3i4n s LYS 1079N -0.84 4.20 0.99 1.61 2.20 -1.26 -4.44 119.74 122.20 3i4n s LYS 1079Ca 0.00 2.33 -0.16 0.00 -0.36 0.00 0.00 55.97 57.78 3i4n s LYS 1079Cb 0.00 -3.52 -0.06 0.00 -1.51 0.00 0.00 37.83 32.73 3i4n s LYS 1079CO 0.00 -0.71 -0.33 1.63 -0.36 0.00 0.00 175.35 175.58 3i4n n LYS 1080N 5.32 -0.24 -3.28 4.03 5.02 -1.26 -1.13 118.16 126.62 3i4n n LYS 1080Ca 0.15 -0.05 -0.41 0.00 -2.02 0.00 0.00 58.31 55.98 3i4n n LYS 1080Cb 0.40 -1.39 -0.08 0.00 -0.02 0.00 0.00 35.03 33.94 3i4n n LYS 1080CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3i4n s LEU 1081N 3.71 4.45 0.62 -0.35 1.43 0.40 -4.52 118.68 124.41 3i4n s LEU 1081Ca 0.48 -0.18 0.07 0.00 -1.03 0.00 0.00 54.13 53.47 3i4n s LEU 1081Cb -0.16 -2.51 0.40 0.00 0.03 0.00 0.00 46.19 43.95 3i4n s LEU 1081CO 0.74 -0.48 1.20 -0.03 0.23 0.00 0.00 176.35 178.02 3i4n h MET 1082N 8.52 0.00 -5.74 1.70 1.85 -1.91 -3.39 114.93 115.96 3i4n h MET 1082Ca -0.28 0.00 -0.60 0.00 -0.61 0.00 0.00 59.70 58.21 3i4n h MET 1082Cb 1.13 0.00 -0.10 0.00 0.43 0.00 0.00 31.60 33.06 3i4n h MET 1082CO 0.76 0.00 -0.51 0.00 -0.40 0.00 0.00 176.91 176.76 3i4n s ALA 1083N -3.90 3.63 0.17 0.39 0.00 -1.26 -5.15 121.76 115.64 3i4n s ALA 1083Ca -0.01 -1.84 0.09 0.00 0.00 0.00 0.00 51.96 50.20 3i4n s ALA 1083Cb 0.02 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 3i4n s ALA 1083CO 0.07 -0.16 -0.11 -0.65 0.00 0.00 0.00 175.76 174.90 3i4n s GLN 1084N -3.88 2.00 0.10 0.00 1.11 -1.26 -4.43 119.66 113.29 3i4n s GLN 1084Ca 0.34 -1.27 0.10 0.00 0.01 0.00 0.00 55.36 54.54 3i4n s GLN 1084Cb 0.05 -2.14 -0.04 0.00 -1.01 0.00 0.00 33.01 29.87 3i4n s GLN 1084CO 0.18 0.44 -0.27 0.42 0.01 0.00 0.00 175.29 176.08 3i4n s ILE 1085N -1.63 2.21 -1.47 1.08 1.09 -0.97 -4.86 121.20 116.65 3i4n s ILE 1085Ca 0.24 -1.63 -0.11 0.00 -1.10 0.00 0.00 60.65 58.05 3i4n s ILE 1085Cb -0.09 -1.94 -0.06 0.00 -1.06 0.00 0.00 42.46 39.32 3i4n s ILE 1085CO 0.14 0.18 2.65 0.33 -0.10 0.00 0.00 174.94 178.15 3i4n n PHE 1086N 1.20 2.51 -2.65 3.97 7.35 -1.26 -1.90 117.46 126.69 3i4n n PHE 1086Ca -0.18 -2.88 -0.42 0.00 -0.76 0.00 0.00 57.45 53.22 3i4n n PHE 1086Cb 0.53 -2.37 -0.03 0.00 0.35 0.00 0.00 39.48 37.95 3i4n n PHE 1086CO 0.00 0.00 0.00 0.12 -0.76 0.00 0.00 176.76 176.12 3i4n s PHE 1087N 2.67 2.48 0.01 -5.13 5.99 -1.26 -3.71 117.98 119.02 3i4n s PHE 1087Ca 0.61 -0.42 -0.28 0.00 0.00 0.00 0.00 56.93 56.84 3i4n s PHE 1087Cb 0.16 -4.55 0.07 0.00 0.00 0.00 0.00 43.02 38.70 3i4n s PHE 1087CO -0.06 -1.92 0.64 0.20 -0.00 0.00 0.00 175.22 174.09 3i4n s GLY 1088N 3.98 -0.57 0.50 13.12 0.00 -0.48 -4.85 107.32 119.02 3i4n s GLY 1088Ca 0.34 1.05 -0.24 0.00 0.00 0.00 0.00 44.72 45.87 3i4n s GLY 1088CO 0.07 0.70 1.40 2.56 0.00 0.00 0.00 173.10 177.83 3i4n s PRO 1089N -1.90 3.42 -0.01 2.90 0.04 -1.26 -2.77 135.00 135.43 3i4n s PRO 1089Ca -0.08 2.35 -0.07 0.00 0.04 0.00 0.00 61.00 63.24 3i4n s PRO 1089Cb -0.00 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 32.07 3i4n s PRO 1089CO 0.04 -1.00 0.14 0.99 0.04 0.00 0.00 177.00 177.20 3i4n s THR 1090N -1.24 0.07 -0.03 1.26 2.01 -0.58 -4.15 115.64 112.96 3i4n s THR 1090Ca 0.66 -0.57 -0.27 0.00 0.31 0.00 0.00 61.69 61.82 3i4n s THR 1090Cb -0.43 -0.39 -0.03 0.00 0.01 0.00 0.00 72.50 71.66 3i4n s THR 1090CO 0.53 -0.31 0.88 -0.47 -0.69 0.00 0.00 174.62 174.55 3i4n s TYR 1091N -1.11 3.62 -0.06 4.92 5.04 -1.26 -1.64 117.35 126.86 3i4n s TYR 1091Ca -0.12 1.52 0.03 0.00 -2.44 0.00 0.00 57.07 56.06 3i4n s TYR 1091Cb -0.06 -3.01 0.01 0.00 0.35 0.00 0.00 41.96 39.25 3i4n s TYR 1091CO 0.01 0.01 -0.13 0.71 -1.34 0.00 0.00 175.55 174.81 3i4n s TYR 1092N 1.02 1.48 0.07 4.97 1.51 0.13 -4.43 117.35 122.10 3i4n s TYR 1092Ca 0.46 -0.52 -0.06 0.00 -1.01 0.00 0.00 57.07 55.94 3i4n s TYR 1092Cb -0.20 -1.07 -0.05 0.00 -0.11 0.00 0.00 41.96 40.54 3i4n s TYR 1092CO 0.23 -0.25 0.33 -0.65 -1.11 0.00 0.00 175.55 174.10 3i4n s GLN 1093N 0.55 3.63 -0.38 -0.62 -0.21 0.91 -2.13 119.66 121.42 3i4n s GLN 1093Ca -0.13 -0.04 -0.04 0.00 0.02 0.00 0.00 55.36 55.18 3i4n s GLN 1093Cb -0.15 -2.98 0.08 0.00 1.00 0.00 0.00 33.01 30.96 3i4n s GLN 1093CO 0.03 0.56 0.16 0.50 -2.12 0.00 0.00 175.29 174.42 3i4n s ARG 1094N -2.13 2.29 0.54 2.91 3.52 -1.26 -1.31 118.95 123.51 3i4n s ARG 1094Ca 0.34 -1.55 -0.16 0.00 -0.13 0.00 0.00 55.73 54.23 3i4n s ARG 1094Cb -0.13 -3.51 -0.07 0.00 -1.56 0.00 0.00 34.95 29.68 3i4n s ARG 1094CO 0.20 -0.90 1.01 -0.51 -0.81 0.00 0.00 175.30 174.29 3i4n s LEU 1095N 1.25 3.58 0.00 -0.88 1.02 -1.25 -2.25 118.68 120.15 3i4n s LEU 1095Ca 0.03 1.63 -0.03 0.00 0.02 0.00 0.00 54.13 55.78 3i4n s LEU 1095Cb -0.22 -4.51 0.04 0.00 0.02 0.00 0.00 46.19 41.52 3i4n s LEU 1095CO -0.01 -0.75 0.12 -2.11 0.02 0.00 0.00 176.35 173.62 3i4n n ARG 1096N -1.73 -1.85 -0.38 1.70 1.85 -0.83 -4.65 116.66 110.77 3i4n n ARG 1096Ca 0.07 -0.20 0.00 0.00 -1.00 0.00 0.00 57.85 56.72 3i4n n ARG 1096Cb 0.54 -0.22 0.00 0.00 -1.05 0.00 0.00 32.46 31.72 3i4n n ARG 1096CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3i4n n HIS 1097N -3.09 0.00 -3.31 2.89 8.25 -1.26 -4.79 115.22 113.91 3i4n n HIS 1097Ca 0.02 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.10 3i4n n HIS 1097Cb 0.07 -0.29 -0.06 0.00 1.12 0.00 0.00 29.99 30.83 3i4n n HIS 1097CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3i4n s MET 1098N -0.22 4.13 0.00 -0.41 -1.94 -1.26 -3.61 119.30 115.99 3i4n s MET 1098Ca 0.00 0.66 0.00 0.00 -1.71 0.00 0.00 55.69 54.64 3i4n s MET 1098Cb 0.00 -3.18 0.00 0.00 2.01 0.00 0.00 34.83 33.66 3i4n s MET 1098CO 0.00 0.62 0.38 1.55 -0.01 0.00 0.00 175.02 177.55 3i4n n VAL 1099N 1.58 0.00 0.00 -6.03 3.14 -1.26 -0.53 118.33 115.23 3i4n n VAL 1099Ca -0.10 0.60 0.00 0.00 -2.96 0.00 0.00 64.34 61.88 3i4n n VAL 1099Cb 0.51 -0.82 0.00 0.00 -1.06 0.00 0.00 33.84 32.47 3i4n n VAL 1099CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3i4n n ASP 1100N -1.90 0.00 -0.93 6.55 8.00 -1.26 0.19 116.55 127.19 3i4n n ASP 1100Ca 0.00 0.06 0.08 0.00 0.71 0.00 0.00 54.79 55.64 3i4n n ASP 1100Cb 0.00 -0.06 0.22 0.00 -0.02 0.00 0.00 41.12 41.27 3i4n n ASP 1100CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3i4n n ASP 1101N -0.84 3.43 0.00 -2.24 8.00 0.31 -4.61 116.55 120.60 3i4n n ASP 1101Ca 0.00 -2.11 0.00 0.00 0.71 0.00 0.00 54.79 53.39 3i4n n ASP 1101Cb 0.11 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 3i4n n ASP 1101CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3i4n n LYS 1102N 0.81 0.96 -1.65 -1.24 5.02 0.50 -5.00 118.16 117.57 3i4n n LYS 1102Ca 0.17 0.00 -0.52 0.00 -2.02 0.00 0.00 58.31 55.94 3i4n n LYS 1102Cb 0.55 -0.64 -0.06 0.00 -0.02 0.00 0.00 35.03 34.87 3i4n n LYS 1102CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3i4n n ILE 1103N -1.03 0.15 -3.72 -0.18 -0.00 -1.10 -4.92 119.36 108.56 3i4n n ILE 1103Ca 0.00 -0.03 -0.13 0.00 -0.00 0.00 0.00 62.75 62.59 3i4n n ILE 1103Cb 0.14 -1.20 -0.13 0.00 -0.00 0.00 0.00 39.64 38.45 3i4n n ILE 1103CO 0.00 0.00 0.00 -2.28 -0.00 0.00 0.00 176.55 174.27 3i4n s HIS 1104N 1.75 -0.30 0.01 1.39 2.46 -1.26 -5.03 115.29 114.31 3i4n s HIS 1104Ca 0.88 0.75 0.01 0.00 0.47 0.00 0.00 55.06 57.16 3i4n s HIS 1104Cb -0.89 -0.00 -0.01 0.00 -0.13 0.00 0.00 32.58 31.55 3i4n s HIS 1104CO 0.50 -0.24 -0.04 0.00 -2.47 0.00 0.00 174.74 172.49 3i4n s ALA 1105N 1.44 0.30 -0.11 1.58 0.00 -1.26 -5.07 121.76 118.65 3i4n s ALA 1105Ca -0.07 -0.30 -0.05 0.00 0.00 0.00 0.00 51.96 51.54 3i4n s ALA 1105Cb -0.11 -0.02 0.05 0.00 0.00 0.00 0.00 23.12 23.04 3i4n s ALA 1105CO -0.08 0.02 0.25 0.50 0.00 0.00 0.00 175.76 176.45 3i4n s ARG 1106N -0.49 0.19 -0.60 0.00 3.52 -1.26 -5.04 118.95 115.27 3i4n s ARG 1106Ca -0.03 0.56 0.04 0.00 -0.13 0.00 0.00 55.73 56.18 3i4n s ARG 1106Cb -0.04 -0.11 0.16 0.00 -1.56 0.00 0.00 34.95 33.40 3i4n s ARG 1106CO -0.00 -0.18 0.41 0.00 -0.81 0.00 0.00 175.30 174.71 3i4n s ALA 1107N 1.44 3.16 0.39 6.12 0.00 -1.26 -4.99 121.76 126.62 3i4n s ALA 1107Ca -0.08 -3.39 0.00 0.00 0.00 0.00 0.00 51.96 48.49 3i4n s ALA 1107Cb -0.11 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 20.97 3i4n s ALA 1107CO -0.08 -2.06 0.00 -2.13 0.00 0.00 0.00 175.76 171.48 3i4n n ARG 1108N 2.45 -2.64 0.00 0.00 0.63 -1.26 -5.09 116.66 110.74 3i4n n ARG 1108Ca 0.18 2.06 0.00 0.00 -0.92 0.00 0.00 57.85 59.17 3i4n n ARG 1108Cb 0.37 -2.62 0.00 0.00 0.45 0.00 0.00 32.46 30.66 3i4n n ARG 1108CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3i4n n GLY 1109N -2.38 -0.67 3.67 5.14 0.00 -1.26 -5.12 105.19 104.57 3i4n n GLY 1109Ca -0.01 -0.31 -0.48 0.00 0.00 0.00 0.00 46.02 45.23 3i4n n GLY 1109CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3i4n n PRO 1110N 0.00 2.01 -5.08 1.61 -0.04 -1.26 -4.97 135.00 127.27 3i4n n PRO 1110Ca 0.00 0.73 -0.32 0.00 -0.04 0.00 0.00 63.50 63.87 3i4n n PRO 1110Cb 0.00 -2.51 -0.16 0.00 -0.04 0.00 0.00 33.50 30.79 3i4n n PRO 1110CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 3i4n s MET 1111N 2.16 3.07 1.12 0.54 -1.94 -1.26 -2.37 119.30 120.61 3i4n s MET 1111Ca 0.85 -0.82 -0.16 0.00 -1.71 0.00 0.00 55.69 53.86 3i4n s MET 1111Cb -0.73 -2.39 0.16 0.00 2.01 0.00 0.00 34.83 33.88 3i4n s MET 1111CO 0.45 0.24 0.38 0.94 -0.01 0.00 0.00 175.02 177.01 3i4n n GLN 1112N 3.39 -1.77 -0.11 2.03 7.27 0.29 -4.78 117.38 123.71 3i4n n GLN 1112Ca -0.18 -0.49 -0.24 0.00 0.07 0.00 0.00 57.00 56.16 3i4n n GLN 1112Cb 0.53 -1.87 -0.11 0.00 2.41 0.00 0.00 30.24 31.19 3i4n n GLN 1112CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 3i4n n VAL 1113N -4.55 1.53 0.01 1.69 0.31 -1.26 -1.90 118.33 114.17 3i4n n VAL 1113Ca 0.02 -0.11 -0.01 0.00 -0.01 0.00 0.00 64.34 64.24 3i4n n VAL 1113Cb 0.59 -2.01 0.28 0.00 -0.91 0.00 0.00 33.84 31.80 3i4n n VAL 1113CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3i4n h LEU 1114N -1.00 0.47 0.00 7.52 5.85 -1.98 -3.34 115.31 122.83 3i4n h LEU 1114Ca -0.43 -0.10 -0.33 0.00 0.84 0.00 0.00 57.88 57.86 3i4n h LEU 1114Cb 1.38 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.22 3i4n h LEU 1114CO -0.26 0.58 -2.24 0.41 -0.34 0.00 0.00 178.44 176.59 3i4n n THR 1115N -4.25 1.24 -1.05 1.05 -1.04 -1.26 -4.99 114.28 103.98 3i4n n THR 1115Ca 0.01 -0.56 -0.02 0.00 -2.04 0.00 0.00 64.05 61.44 3i4n n THR 1115Cb 0.28 -1.06 -0.01 0.00 -1.82 0.00 0.00 70.33 67.72 3i4n n THR 1115CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3i4n n ARG 1116N -2.99 -0.51 -3.53 -2.82 1.74 -0.80 -4.53 116.66 103.23 3i4n n ARG 1116Ca -0.36 0.31 -0.25 0.00 -0.77 0.00 0.00 57.85 56.77 3i4n n ARG 1116Cb 0.96 -3.82 -0.02 0.00 -1.02 0.00 0.00 32.46 28.56 3i4n n ARG 1116CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3i4n s GLN 1117N -1.12 3.51 0.61 5.56 -0.21 -1.26 -4.53 119.66 122.22 3i4n s GLN 1117Ca 0.00 -0.33 -0.18 0.00 0.02 0.00 0.00 55.36 54.87 3i4n s GLN 1117Cb 0.00 -2.73 -0.07 0.00 1.00 0.00 0.00 33.01 31.21 3i4n s GLN 1117CO 0.00 0.26 0.64 -2.30 -2.12 0.00 0.00 175.29 171.77 3i4n n PRO 1118N -1.29 0.55 -2.66 2.91 -0.02 -1.26 -0.54 135.00 132.69 3i4n n PRO 1118Ca -0.05 0.22 -0.27 0.00 -2.02 0.00 0.00 63.50 61.39 3i4n n PRO 1118Cb 0.55 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 3i4n n PRO 1118CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3i4n s VAL 1119N -1.71 4.76 0.29 -1.45 -7.23 -1.00 -4.57 120.40 109.49 3i4n s VAL 1119Ca 0.70 0.12 -0.21 0.00 -1.81 0.00 0.00 61.98 60.79 3i4n s VAL 1119Cb -0.42 -3.81 -0.09 0.00 0.56 0.00 0.00 36.38 32.62 3i4n s VAL 1119CO 0.53 -0.78 0.81 -0.70 -0.31 0.00 0.00 175.10 174.65 3i4n s GLU 1120N -4.74 4.29 0.00 4.82 2.12 -1.26 -1.35 118.70 122.58 3i4n s GLU 1120Ca 0.48 0.98 0.00 0.00 0.36 0.00 0.00 54.97 56.79 3i4n s GLU 1120Cb -0.10 -2.71 0.00 0.00 0.26 0.00 0.00 34.13 31.58 3i4n s GLU 1120CO 0.44 0.28 0.00 0.41 -0.54 0.00 0.00 175.26 175.85 3i4n n GLY 1121N 0.35 -1.42 0.27 -1.50 0.00 -1.26 -4.57 105.19 97.07 3i4n n GLY 1121Ca 0.01 -1.01 0.05 0.00 0.00 0.00 0.00 46.02 45.08 3i4n n GLY 1121CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3i4n h ARG 1122N 0.00 0.24 -0.79 1.61 0.11 -1.92 -0.41 114.38 113.23 3i4n h ARG 1122Ca 0.00 -0.02 0.19 0.00 0.10 0.00 0.00 59.98 60.24 3i4n h ARG 1122Cb 0.00 -0.05 -0.13 0.00 1.11 0.00 0.00 29.97 30.90 3i4n h ARG 1122CO 0.00 0.20 0.14 0.66 0.10 0.00 0.00 179.97 181.07 3i4n h SER 1123N 0.24 -0.11 -0.92 0.08 4.64 -1.97 0.19 113.55 115.71 3i4n h SER 1123Ca 0.06 0.18 -0.50 0.00 -0.47 0.00 0.00 61.79 61.06 3i4n h SER 1123Cb 0.05 0.26 -0.28 0.00 -0.31 0.00 0.00 62.40 62.12 3i4n h SER 1123CO -0.01 -0.12 0.58 0.54 -0.87 0.00 0.00 176.83 176.95 3i4n n ARG 1124N -5.24 2.27 -1.10 4.77 1.74 -0.58 -4.90 116.66 113.62 3i4n n ARG 1124Ca 0.16 -3.08 -0.03 0.00 -0.77 0.00 0.00 57.85 54.13 3i4n n ARG 1124Cb 0.53 -2.15 -0.01 0.00 -1.02 0.00 0.00 32.46 29.81 3i4n n ARG 1124CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3i4n n ASP 1125N -1.11 -5.07 -3.22 0.55 -0.08 0.05 -4.83 116.55 102.84 3i4n n ASP 1125Ca 0.57 0.08 -0.08 0.00 -1.51 0.00 0.00 54.79 53.85 3i4n n ASP 1125Cb 1.47 -2.87 0.08 0.00 2.34 0.00 0.00 41.12 42.14 3i4n n ASP 1125CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3i4n n GLY 1126N -0.36 -2.13 3.39 0.27 0.00 -0.27 -4.70 105.19 101.40 3i4n n GLY 1126Ca -0.03 -0.69 -0.22 0.00 0.00 0.00 0.00 46.02 45.07 3i4n n GLY 1126CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3i4n s GLY 1127N -1.61 1.61 0.63 -0.02 0.00 -0.46 -4.66 107.32 102.81 3i4n s GLY 1127Ca 0.18 -1.70 -0.12 0.00 0.00 0.00 0.00 44.72 43.08 3i4n s GLY 1127CO 0.15 -1.78 1.04 1.08 0.00 0.00 0.00 173.10 173.59 3i4n s LEU 1128N -3.18 3.25 -0.08 0.66 1.43 -1.26 -4.71 118.68 114.79 3i4n s LEU 1128Ca 0.24 1.52 -0.12 0.00 -1.03 0.00 0.00 54.13 54.73 3i4n s LEU 1128Cb -0.04 -4.49 -0.05 0.00 0.03 0.00 0.00 46.19 41.65 3i4n s LEU 1128CO 0.10 -1.04 0.29 -0.60 0.23 0.00 0.00 176.35 175.33 3i4n s ARG 1129N -4.97 3.85 -0.62 1.70 3.52 -1.26 -4.98 118.95 116.19 3i4n s ARG 1129Ca 0.57 0.15 0.01 0.00 -0.13 0.00 0.00 55.73 56.33 3i4n s ARG 1129Cb -0.12 -3.26 0.40 0.00 -1.56 0.00 0.00 34.95 30.41 3i4n s ARG 1129CO 0.51 0.61 1.64 0.34 -0.81 0.00 0.00 175.30 177.59 3i4n n PHE 1130N 2.32 3.13 0.00 5.12 7.35 -1.26 -5.05 117.46 129.07 3i4n n PHE 1130Ca -0.15 -2.67 0.00 0.00 -0.76 0.00 0.00 57.45 53.86 3i4n n PHE 1130Cb 0.53 -0.79 0.00 0.00 0.35 0.00 0.00 39.48 39.57 3i4n n PHE 1130CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3i4n n GLY 1131N -0.61 -1.94 0.04 7.13 0.00 -1.26 -4.30 105.19 104.25 3i4n n GLY 1131Ca 0.50 -0.64 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 3i4n n GLY 1131CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3i4n h GLU 1132N 0.00 -0.04 -0.65 1.61 5.08 -1.99 -1.78 114.58 116.80 3i4n h GLU 1132Ca 0.00 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.51 3i4n h GLU 1132Cb 0.00 0.01 -0.12 0.00 0.50 0.00 0.00 28.75 29.14 3i4n h GLU 1132CO 0.00 -0.03 -0.10 -1.33 -1.00 0.00 0.00 179.01 176.55 3i4n n MET 1133N -2.88 -0.06 -0.16 2.33 2.81 -1.26 0.10 117.12 118.01 3i4n n MET 1133Ca -0.00 1.00 -0.11 0.00 -1.81 0.00 0.00 57.70 56.77 3i4n n MET 1133Cb 0.03 -1.53 -0.00 0.00 -0.71 0.00 0.00 33.22 31.01 3i4n n MET 1133CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 3i4n h GLU 1134N 0.00 0.95 0.12 0.03 3.07 -1.76 -2.77 114.58 114.22 3i4n h GLU 1134Ca 0.34 -0.40 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 3i4n h GLU 1134Cb 0.60 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.46 3i4n h GLU 1134CO -0.65 1.07 -0.26 -0.09 -1.40 0.00 0.00 179.01 177.68 3i4n h ARG 1135N 0.80 -0.41 -0.67 2.33 2.43 0.16 -2.49 114.38 116.53 3i4n h ARG 1135Ca 0.11 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.39 3i4n h ARG 1135Cb 0.76 0.09 -0.09 0.00 -0.42 0.00 0.00 29.97 30.31 3i4n h ARG 1135CO 0.06 -0.27 -0.33 -0.25 -1.51 0.00 0.00 179.97 177.67 3i4n n ASP 1136N -3.94 -0.58 -0.21 -3.80 9.92 -0.81 0.22 116.55 117.36 3i4n n ASP 1136Ca -0.05 1.18 0.01 0.00 -0.53 0.00 0.00 54.79 55.40 3i4n n ASP 1136Cb 0.22 -0.21 0.11 0.00 -0.64 0.00 0.00 41.12 40.60 3i4n n ASP 1136CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3i4n h MET 1138N 0.18 1.03 -0.78 0.00 2.86 0.04 -0.65 114.93 117.62 3i4n h MET 1138Ca 0.33 -0.29 0.01 0.00 -2.06 0.00 0.00 59.70 57.70 3i4n h MET 1138Cb 0.53 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 32.03 3i4n h MET 1138CO -0.48 0.97 0.51 0.82 1.06 0.00 0.00 176.91 179.79 3i4n h ILE 1139N 0.94 1.18 0.32 -1.22 2.04 -0.01 0.89 117.51 121.65 3i4n h ILE 1139Ca 0.19 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 3i4n h ILE 1139Cb 0.45 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 3i4n h ILE 1139CO 0.02 0.19 -0.23 0.00 0.00 0.00 0.00 178.15 178.13 3i4n h ALA 1140N 1.30 -0.53 -0.82 1.87 0.00 -0.42 -2.23 119.26 118.42 3i4n h ALA 1140Ca 0.29 -0.10 0.20 0.00 0.00 0.00 0.00 54.91 55.30 3i4n h ALA 1140Cb -0.09 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 3i4n h ALA 1140CO -0.07 -0.82 0.56 0.45 0.00 0.00 0.00 179.25 179.37 3i4n h HIS 1141N -0.54 0.34 0.00 0.00 3.86 -0.51 -3.45 115.15 114.84 3i4n h HIS 1141Ca -0.03 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 3i4n h HIS 1141Cb 0.47 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.83 3i4n h HIS 1141CO -0.11 0.10 0.00 0.41 0.86 0.00 0.00 177.93 179.19 3i4n n GLY 1142N -1.58 0.65 2.72 2.45 0.00 0.25 -4.97 105.19 104.72 3i4n n GLY 1142Ca 0.17 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 3i4n n GLY 1142CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4n n ALA 1143N -0.28 5.95 -0.06 4.61 0.00 -0.98 -4.83 120.51 124.92 3i4n n ALA 1143Ca 0.00 -4.35 -0.08 0.00 0.00 0.00 0.00 53.44 49.01 3i4n n ALA 1143Cb 0.14 -2.70 -0.01 0.00 0.00 0.00 0.00 19.45 16.88 3i4n n ALA 1143CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4n h ALA 1144N 5.08 0.25 -0.15 0.00 0.00 -1.93 -1.86 119.26 120.64 3i4n h ALA 1144Ca 0.49 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.50 3i4n h ALA 1144Cb 0.47 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 3i4n h ALA 1144CO 1.47 -0.38 -0.35 0.77 0.00 0.00 0.00 179.25 180.75 3i4n h SER 1145N 0.12 -1.11 0.02 0.00 0.02 -2.00 -1.82 113.55 108.80 3i4n h SER 1145Ca 0.12 0.16 0.02 0.00 -0.84 0.00 0.00 61.79 61.24 3i4n h SER 1145Cb 0.13 0.47 -0.03 0.00 0.14 0.00 0.00 62.40 63.11 3i4n h SER 1145CO -0.17 -0.38 -0.13 0.15 -1.14 0.00 0.00 176.83 175.16 3i4n h PHE 1146N -0.42 -0.34 -0.36 3.45 3.57 -1.95 -1.24 116.94 119.65 3i4n h PHE 1146Ca 0.10 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.66 3i4n h PHE 1146Cb 0.57 0.15 -0.08 0.00 2.79 0.00 0.00 35.95 39.38 3i4n h PHE 1146CO -0.44 -0.20 -0.50 1.25 -2.23 0.00 0.00 178.31 176.19 3i4n h LEU 1147N -0.24 -1.64 -0.38 0.59 6.46 -0.98 -0.55 115.31 118.58 3i4n h LEU 1147Ca 0.04 0.23 0.08 0.00 -0.12 0.00 0.00 57.88 58.10 3i4n h LEU 1147Cb 0.28 0.68 -0.09 0.00 -0.73 0.00 0.00 40.66 40.81 3i4n h LEU 1147CO -0.11 -0.40 -0.24 0.50 -0.62 0.00 0.00 178.44 177.57 3i4n h LYS 1148N -0.40 -0.17 -0.70 1.25 3.64 -1.07 -1.90 116.57 117.23 3i4n h LYS 1148Ca 0.10 0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.64 3i4n h LYS 1148Cb 0.61 0.04 -0.12 0.00 -0.41 0.00 0.00 32.23 32.35 3i4n h LYS 1148CO -0.56 -0.11 0.02 1.49 -2.27 0.00 0.00 179.45 178.02 3i4n h GLU 1149N -0.18 0.12 0.00 1.90 4.81 0.07 0.77 114.58 122.07 3i4n h GLU 1149Ca 0.18 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 3i4n h GLU 1149Cb 0.46 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.82 3i4n h GLU 1149CO -0.48 0.08 0.00 0.54 -0.73 0.00 0.00 179.01 178.42 3i4n n ARG 1150N -5.30 0.07 -0.05 1.92 5.12 -0.40 -0.57 116.66 117.45 3i4n n ARG 1150Ca 0.12 0.13 0.01 0.00 -1.93 0.00 0.00 57.85 56.17 3i4n n ARG 1150Cb 0.42 -1.50 -0.16 0.00 -1.16 0.00 0.00 32.46 30.06 3i4n n ARG 1150CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3i4n n LEU 1151N -1.45 0.00 0.00 0.55 4.32 0.22 -4.32 117.00 116.32 3i4n n LEU 1151Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.05 3i4n n LEU 1151Cb 0.23 0.24 0.00 0.00 -1.62 0.00 0.00 43.42 42.27 3i4n n LEU 1151CO 0.19 0.24 0.00 0.23 -1.22 0.00 0.00 177.39 176.82 3i4n n MET 1152N -2.48 0.00 0.09 3.23 2.81 0.14 -3.85 117.12 117.05 3i4n n MET 1152Ca -0.18 0.00 0.19 0.00 -1.81 0.00 0.00 57.70 55.90 3i4n n MET 1152Cb 0.84 -0.01 0.74 0.00 -0.71 0.00 0.00 33.22 34.09 3i4n n MET 1152CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 3i4n h GLU 1153N 0.00 0.00 -0.56 0.03 3.07 -1.65 -0.00 114.58 115.47 3i4n h GLU 1153Ca 0.00 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.79 3i4n h GLU 1153Cb 0.00 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 27.87 3i4n h GLU 1153CO 0.00 0.00 0.08 0.00 -1.40 0.00 0.00 179.01 177.69 3i4n n ALA 1154N -2.47 3.95 -2.00 3.43 0.00 0.26 -4.94 120.51 118.75 3i4n n ALA 1154Ca 0.07 -2.19 0.00 0.00 0.00 0.00 0.00 53.44 51.32 3i4n n ALA 1154Cb 0.52 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.91 3i4n n ALA 1154CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3i4n n SER 1155N 0.08 0.00 0.00 0.00 2.88 -0.02 -4.83 113.62 111.73 3i4n n SER 1155Ca 0.31 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.85 3i4n n SER 1155Cb 1.20 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.66 3i4n n SER 1155CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3i4n n ASP 1156N 0.00 0.00 -1.38 -3.46 8.00 -1.22 -4.83 116.55 113.66 3i4n n ASP 1156Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3i4n n ASP 1156Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3i4n n ASP 1156CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i4n n ALA 1157N -3.00 -2.38 -3.48 2.24 0.00 -1.23 -4.78 120.51 107.88 3i4n n ALA 1157Ca 0.00 0.31 -0.10 0.00 0.00 0.00 0.00 53.44 53.64 3i4n n ALA 1157Cb 0.00 -1.12 -0.02 0.00 0.00 0.00 0.00 19.45 18.31 3i4n n ALA 1157CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3i4n s PHE 1158N -0.90 -0.44 -0.18 0.00 5.36 -0.77 -4.52 117.98 116.53 3i4n s PHE 1158Ca 0.00 0.34 0.01 0.00 -0.96 0.00 0.00 56.93 56.32 3i4n s PHE 1158Cb 0.00 0.53 0.02 0.00 -0.34 0.00 0.00 43.02 43.24 3i4n s PHE 1158CO 0.00 -0.65 -0.19 0.50 -1.46 0.00 0.00 175.22 173.42 3i4n s ARG 1159N -3.13 2.89 0.39 10.12 3.00 -1.26 -2.34 118.95 128.62 3i4n s ARG 1159Ca 0.02 -0.83 0.01 0.00 -1.00 0.00 0.00 55.73 53.93 3i4n s ARG 1159Cb -0.01 -2.55 0.01 0.00 0.00 0.00 0.00 34.95 32.40 3i4n s ARG 1159CO -0.09 -0.23 0.10 1.33 0.00 0.00 0.00 175.30 176.41 3i4n n VAL 1160N 4.62 0.00 -4.47 7.11 0.24 -0.95 -4.96 118.33 119.92 3i4n n VAL 1160Ca -0.20 -1.74 -0.20 0.00 -2.04 0.00 0.00 64.34 60.16 3i4n n VAL 1160Cb 0.50 0.20 -0.14 0.00 -1.47 0.00 0.00 33.84 32.92 3i4n n VAL 1160CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 3i4n s HIS 1161N -2.26 1.14 0.27 6.34 3.76 -1.26 -2.47 115.29 120.80 3i4n s HIS 1161Ca 0.07 -0.26 0.11 0.00 -0.15 0.00 0.00 55.06 54.83 3i4n s HIS 1161Cb -0.01 -0.71 -0.05 0.00 1.11 0.00 0.00 32.58 32.93 3i4n s HIS 1161CO 0.05 -0.00 -0.16 0.42 -0.85 0.00 0.00 174.74 174.19 3i4n s ILE 1162N -0.51 2.69 -0.18 0.60 1.01 0.23 -4.35 121.20 120.69 3i4n s ILE 1162Ca 0.03 -2.26 -0.18 0.00 0.00 0.00 0.00 60.65 58.24 3i4n s ILE 1162Cb -0.06 -2.40 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 3i4n s ILE 1162CO 0.00 -0.37 0.50 0.00 0.00 0.00 0.00 174.94 175.07 3i4n h GLY 1164N 7.57 0.00 0.00 0.00 0.00 -1.68 -3.34 103.07 105.63 3i4n h GLY 1164Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.97 3i4n h GLY 1164CO 0.74 0.00 0.00 1.39 0.00 0.00 0.00 176.54 178.67 3i4n n ILE 1165N -2.41 0.00 -2.23 2.60 5.41 -1.26 -4.86 119.36 116.61 3i4n n ILE 1165Ca -0.01 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.32 3i4n n ILE 1165Cb 0.26 -0.68 -0.03 0.00 -0.71 0.00 0.00 39.64 38.48 3i4n n ILE 1165CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4n n GLY 1167N 5.31 1.07 3.53 0.00 0.00 -1.26 -4.01 105.19 109.83 3i4n n GLY 1167Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 3i4n n GLY 1167CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i4n s LEU 1168N 0.00 2.71 0.00 0.99 1.43 -1.26 -0.96 118.68 121.59 3i4n s LEU 1168Ca 0.00 -1.18 0.09 0.00 -1.03 0.00 0.00 54.13 52.01 3i4n s LEU 1168Cb 0.00 -1.00 0.38 0.00 0.03 0.00 0.00 46.19 45.60 3i4n s LEU 1168CO 0.00 -0.18 1.27 0.23 0.23 0.00 0.00 176.35 177.89 3i4n n MET 1169N -0.77 1.32 -0.02 1.70 2.81 -1.26 -3.11 117.12 117.80 3i4n n MET 1169Ca -0.05 -0.49 -0.00 0.00 -1.81 0.00 0.00 57.70 55.35 3i4n n MET 1169Cb 0.63 -1.18 -0.00 0.00 -0.71 0.00 0.00 33.22 31.96 3i4n n MET 1169CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 3i4n n THR 1170N -0.16 -0.03 0.00 2.03 -1.04 -1.26 -4.74 114.28 109.08 3i4n n THR 1170Ca 0.08 1.04 0.00 0.00 -2.04 0.00 0.00 64.05 63.13 3i4n n THR 1170Cb 0.13 -1.38 0.00 0.00 -1.82 0.00 0.00 70.33 67.27 3i4n n THR 1170CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 3i4n n VAL 1171N -2.79 0.00 -3.39 12.58 0.31 -1.26 -4.84 118.33 118.93 3i4n n VAL 1171Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.90 3i4n n VAL 1171Cb 0.01 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.93 3i4n n VAL 1171CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3i4n s ILE 1172N 0.00 5.70 -0.42 2.52 -1.09 -1.22 -4.88 121.20 121.81 3i4n s ILE 1172Ca 0.00 -3.48 -0.28 0.00 -2.23 0.00 0.00 60.65 54.66 3i4n s ILE 1172Cb 0.00 -4.44 0.00 0.00 -1.58 0.00 0.00 42.46 36.45 3i4n s ILE 1172CO 0.00 -1.16 1.52 0.00 -1.23 0.00 0.00 174.94 174.06 3i4n s ALA 1173N -1.23 2.95 -0.43 9.38 0.00 -1.26 -4.34 121.76 126.82 3i4n s ALA 1173Ca 0.30 -0.14 0.04 0.00 0.00 0.00 0.00 51.96 52.16 3i4n s ALA 1173Cb -0.10 -3.99 0.63 0.00 0.00 0.00 0.00 23.12 19.66 3i4n s ALA 1173CO -0.09 -2.56 1.87 1.63 0.00 0.00 0.00 175.76 176.61 3i4n n LYS 1174N 8.26 2.18 0.00 0.00 5.02 -0.98 -4.93 118.16 127.71 3i4n n LYS 1174Ca 0.18 -2.84 0.00 0.00 -2.02 0.00 0.00 58.31 53.63 3i4n n LYS 1174Cb 0.48 -2.11 0.00 0.00 -0.02 0.00 0.00 35.03 33.38 3i4n n LYS 1174CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3i4n n LEU 1175N -1.05 0.00 0.12 -0.35 4.77 -1.26 -2.35 117.00 116.88 3i4n n LEU 1175Ca 0.57 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 3i4n n LEU 1175Cb 1.60 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.69 3i4n n LEU 1175CO 0.58 0.00 0.00 -3.20 -1.33 0.00 0.00 177.39 173.44 3i4n n ASN 1176N 0.00 -2.10 -0.93 -1.43 2.85 -1.26 -4.83 115.26 107.56 3i4n n ASN 1176Ca 0.00 0.67 0.12 0.00 -0.11 0.00 0.00 54.58 55.26 3i4n n ASN 1176Cb 0.00 2.18 0.20 0.00 1.24 0.00 0.00 39.78 43.40 3i4n n ASN 1176CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 3i4n n HIS 1177N -3.14 0.15 0.00 1.20 8.25 -0.99 -4.95 115.22 115.74 3i4n n HIS 1177Ca 0.00 -0.08 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 3i4n n HIS 1177Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 3i4n n HIS 1177CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3i4n n ASN 1178N 1.18 0.00 -2.41 0.41 3.02 -1.25 -4.93 115.26 111.28 3i4n n ASN 1178Ca 0.16 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.38 3i4n n ASN 1178Cb 0.56 -0.05 -0.05 0.00 -0.61 0.00 0.00 39.78 39.63 3i4n n ASN 1178CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3i4n n GLN 1179N -0.47 0.00 0.00 3.52 6.02 -1.26 -4.61 117.38 120.58 3i4n n GLN 1179Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3i4n n GLN 1179Cb 0.00 -0.78 0.00 0.00 1.02 0.00 0.00 30.24 30.48 3i4n n GLN 1179CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3i4n n PHE 1180N 1.32 0.00 0.00 1.08 0.99 -1.26 -2.31 117.46 117.28 3i4n n PHE 1180Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.58 3i4n n PHE 1180Cb 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.49 3i4n n PHE 1180CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 3i4n n GLU 1181N -0.84 0.00 0.00 -1.08 1.02 -1.26 -3.44 120.64 115.04 3i4n n GLU 1181Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3i4n n GLU 1181Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3i4n n GLU 1181CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3i4n n LYS 1183N -1.43 0.00 0.00 0.00 2.85 -1.26 -4.21 118.16 114.10 3i4n n LYS 1183Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3i4n n LYS 1183Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 3i4n n LYS 1183CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3i4n n GLY 1184N 0.00 0.00 0.05 2.58 0.00 -1.26 0.40 105.19 106.96 3i4n n GLY 1184Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 3i4n n GLY 1184CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4n n ASP 1186N -2.06 -5.77 0.00 0.00 -0.08 0.16 -5.01 116.55 103.79 3i4n n ASP 1186Ca 0.02 -0.24 0.00 0.00 -1.51 0.00 0.00 54.79 53.06 3i4n n ASP 1186Cb 0.45 -2.28 0.00 0.00 2.34 0.00 0.00 41.12 41.63 3i4n n ASP 1186CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 3i4n n ASN 1187N -0.77 0.00 0.00 1.67 2.85 -1.22 -4.89 115.26 112.89 3i4n n ASN 1187Ca -0.11 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.36 3i4n n ASN 1187Cb 0.65 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.67 3i4n n ASN 1187CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 3i4n n LYS 1188N 0.00 0.00 0.00 1.20 4.81 -0.20 -4.81 118.16 119.17 3i4n n LYS 1188Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3i4n n LYS 1188Cb 0.00 -1.22 0.00 0.00 0.02 0.00 0.00 35.03 33.83 3i4n n LYS 1188CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 3i4n n ILE 1189N -2.00 0.00 -3.28 3.15 5.41 -1.26 -4.60 119.36 116.78 3i4n n ILE 1189Ca 0.00 0.00 -0.46 0.00 1.00 0.00 0.00 62.75 63.29 3i4n n ILE 1189Cb 0.00 -0.50 -0.05 0.00 -0.71 0.00 0.00 39.64 38.39 3i4n n ILE 1189CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3i4n s ASP 1190N -3.95 6.22 -0.01 4.38 2.15 -1.26 -5.02 116.67 119.18 3i4n s ASP 1190Ca 0.00 -1.78 -0.07 0.00 0.43 0.00 0.00 52.55 51.13 3i4n s ASP 1190Cb 0.00 -2.23 0.01 0.00 -0.30 0.00 0.00 42.92 40.40 3i4n s ASP 1190CO 0.00 -0.89 0.15 -0.63 -0.17 0.00 0.00 175.17 173.63 3i4n s ILE 1191N 1.70 0.07 0.09 4.11 1.01 -1.26 -1.63 121.20 125.29 3i4n s ILE 1191Ca 0.05 -0.54 0.06 0.00 0.00 0.00 0.00 60.65 60.22 3i4n s ILE 1191Cb -0.28 -0.40 -0.03 0.00 0.01 0.00 0.00 42.46 41.76 3i4n s ILE 1191CO 0.03 -0.30 -0.16 -0.31 0.00 0.00 0.00 174.94 174.20 3i4n s TYR 1192N -1.08 1.39 -0.14 3.97 1.51 -1.10 -4.95 117.35 116.95 3i4n s TYR 1192Ca -0.12 -0.47 -0.07 0.00 -1.01 0.00 0.00 57.07 55.41 3i4n s TYR 1192Cb -0.06 -0.76 -0.04 0.00 -0.11 0.00 0.00 41.96 40.98 3i4n s TYR 1192CO 0.01 0.11 0.10 -1.14 -1.11 0.00 0.00 175.55 173.52 3i4n s GLN 1193N -1.98 3.60 -0.05 -0.62 0.74 -1.26 -0.60 119.66 119.50 3i4n s GLN 1193Ca 0.02 -0.24 -0.07 0.00 0.05 0.00 0.00 55.36 55.12 3i4n s GLN 1193Cb -0.09 -3.17 0.01 0.00 1.10 0.00 0.00 33.01 30.87 3i4n s GLN 1193CO 0.03 0.58 0.18 0.96 -0.55 0.00 0.00 175.29 176.49 3i4n s ILE 1194N -0.48 0.03 -0.27 -2.34 -4.36 -1.03 -5.00 121.20 107.75 3i4n s ILE 1194Ca 0.11 -0.24 -0.10 0.00 -0.26 0.00 0.00 60.65 60.16 3i4n s ILE 1194Cb -0.12 -0.34 -0.05 0.00 1.25 0.00 0.00 42.46 43.21 3i4n s ILE 1194CO 0.02 -0.13 0.17 -1.00 0.24 0.00 0.00 174.94 174.24 3i4n s HIS 1195N -0.43 3.23 0.08 1.37 3.76 -1.26 -2.23 115.29 119.80 3i4n s HIS 1195Ca -0.05 0.09 -0.12 0.00 -0.15 0.00 0.00 55.06 54.82 3i4n s HIS 1195Cb -0.03 -2.34 0.02 0.00 1.11 0.00 0.00 32.58 31.33 3i4n s HIS 1195CO 0.01 -0.13 0.28 0.96 -0.85 0.00 0.00 174.74 175.02 3i4n s ILE 1196N 1.57 0.10 0.12 0.60 -5.25 -0.99 -4.96 121.20 112.40 3i4n s ILE 1196Ca 0.07 -0.84 -0.31 0.00 -0.99 0.00 0.00 60.65 58.58 3i4n s ILE 1196Cb -0.15 -1.13 -0.09 0.00 2.95 0.00 0.00 42.46 44.03 3i4n s ILE 1196CO 0.09 -0.46 1.58 -2.16 -1.79 0.00 0.00 174.94 172.19 3i4n s PRO 1197N -3.32 4.22 0.64 0.37 0.04 -1.26 -1.85 135.00 133.84 3i4n s PRO 1197Ca 0.00 2.31 0.17 0.00 0.04 0.00 0.00 61.00 63.53 3i4n s PRO 1197Cb 0.02 -3.34 0.83 0.00 0.04 0.00 0.00 34.50 32.05 3i4n s PRO 1197CO -0.08 -0.63 1.44 -0.92 0.04 0.00 0.00 177.00 176.84 3i4n h TYR 1198N 7.39 0.00 -0.33 0.56 3.20 -1.86 1.34 116.97 127.26 3i4n h TYR 1198Ca -0.42 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.34 3i4n h TYR 1198Cb 1.20 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.46 3i4n h TYR 1198CO 0.70 0.00 -0.21 0.00 -1.64 0.00 0.00 178.16 177.01 3i4n h ALA 1199N 0.67 1.01 0.11 1.82 0.00 -1.88 -0.56 119.26 120.43 3i4n h ALA 1199Ca 0.12 -0.35 -0.28 0.00 0.00 0.00 0.00 54.91 54.40 3i4n h ALA 1199Cb 1.68 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 19.35 3i4n h ALA 1199CO -0.00 0.59 -1.20 0.00 0.00 0.00 0.00 179.25 178.64 3i4n h ALA 1200N 1.20 0.09 0.14 0.00 0.00 0.14 0.39 119.26 121.23 3i4n h ALA 1200Ca 0.08 -0.80 0.02 0.00 0.00 0.00 0.00 54.91 54.21 3i4n h ALA 1200Cb 0.67 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 3i4n h ALA 1200CO 0.05 0.80 -0.41 -0.22 0.00 0.00 0.00 179.25 179.47 3i4n h LYS 1201N 0.19 -0.63 0.35 0.00 3.64 -1.22 0.42 116.57 119.32 3i4n h LYS 1201Ca -0.16 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3i4n h LYS 1201Cb 1.88 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 33.81 3i4n h LYS 1201CO 0.22 -0.42 -0.51 1.25 -2.27 0.00 0.00 179.45 177.71 3i4n h LEU 1202N -0.65 -1.46 -1.30 5.20 5.85 -1.09 -0.67 115.31 121.18 3i4n h LEU 1202Ca 0.02 0.13 0.41 0.00 0.84 0.00 0.00 57.88 59.28 3i4n h LEU 1202Cb 0.67 0.51 -0.14 0.00 0.37 0.00 0.00 40.66 42.07 3i4n h LEU 1202CO -0.22 -0.62 0.77 0.25 -0.34 0.00 0.00 178.44 178.27 3i4n h LEU 1203N -0.90 0.29 0.11 2.25 5.85 0.44 0.49 115.31 123.85 3i4n h LEU 1203Ca -0.04 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3i4n h LEU 1203Cb 0.83 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.00 3i4n h LEU 1203CO -0.16 -0.20 -0.05 -0.26 -0.34 0.00 0.00 178.44 177.43 3i4n h PHE 1204N 0.12 -0.14 -1.00 1.25 0.05 0.74 -2.50 116.94 115.45 3i4n h PHE 1204Ca 0.81 -0.00 0.20 0.00 3.82 0.00 0.00 57.97 62.80 3i4n h PHE 1204Cb 2.38 0.05 -0.11 0.00 2.00 0.00 0.00 35.95 40.27 3i4n h PHE 1204CO -0.01 0.24 0.61 1.96 -0.18 0.00 0.00 178.31 180.94 3i4n h GLN 1205N -0.97 0.69 -0.37 1.51 4.20 0.28 0.43 115.11 120.88 3i4n h GLN 1205Ca -0.02 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 3i4n h GLN 1205Cb 0.44 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 3i4n h GLN 1205CO 0.03 0.45 0.06 0.93 -0.67 0.00 0.00 178.83 179.63 3i4n h GLU 1206N 0.71 0.55 0.00 1.46 5.08 -0.12 0.47 114.58 122.73 3i4n h GLU 1206Ca 0.59 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.75 3i4n h GLU 1206Cb 0.99 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 3i4n h GLU 1206CO -0.39 0.53 -0.47 -0.07 -1.00 0.00 0.00 179.01 177.61 3i4n h LEU 1207N 0.54 0.00 -0.16 1.33 3.38 0.20 -3.12 115.31 117.48 3i4n h LEU 1207Ca 0.12 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.87 3i4n h LEU 1207Cb 0.26 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.02 3i4n h LEU 1207CO 0.00 0.47 -0.80 0.24 0.09 0.00 0.00 178.44 178.44 3i4n h MET 1208N 0.00 0.76 0.00 1.13 2.86 0.13 0.26 114.93 120.07 3i4n h MET 1208Ca -0.00 -0.64 0.00 0.00 -2.06 0.00 0.00 59.70 57.00 3i4n h MET 1208Cb 1.23 0.14 0.00 0.00 0.06 0.00 0.00 31.60 33.02 3i4n h MET 1208CO 0.06 1.24 0.00 0.00 1.06 0.00 0.00 176.91 179.27 3i4n n ALA 1209N -2.60 1.13 -0.35 6.32 0.00 0.06 0.83 120.51 125.89 3i4n n ALA 1209Ca -0.08 0.15 0.07 0.00 0.00 0.00 0.00 53.44 53.58 3i4n n ALA 1209Cb 0.76 -1.27 0.21 0.00 0.00 0.00 0.00 19.45 19.15 3i4n n ALA 1209CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3i4n n MET 1210N -2.11 2.94 -3.21 0.00 2.00 -1.08 -4.97 117.12 110.70 3i4n n MET 1210Ca -0.01 -2.33 -0.16 0.00 0.00 0.00 0.00 57.70 55.21 3i4n n MET 1210Cb 0.06 -1.45 0.06 0.00 0.00 0.00 0.00 33.22 31.89 3i4n n MET 1210CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 3i4n n ASN 1211N 0.61 -4.37 -4.13 7.83 2.85 0.24 -5.03 115.26 113.27 3i4n n ASN 1211Ca 0.16 -0.40 -0.31 0.00 -0.11 0.00 0.00 54.58 53.93 3i4n n ASN 1211Cb 0.56 -3.72 -0.17 0.00 1.24 0.00 0.00 39.78 37.69 3i4n n ASN 1211CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 3i4n s ILE 1212N -3.23 1.85 -0.32 -1.44 -1.09 0.89 -4.98 121.20 112.87 3i4n s ILE 1212Ca 0.32 -0.85 -0.17 0.00 -2.23 0.00 0.00 60.65 57.71 3i4n s ILE 1212Cb -0.14 -1.65 -0.02 0.00 -1.58 0.00 0.00 42.46 39.08 3i4n s ILE 1212CO 0.52 0.51 0.46 0.42 -1.23 0.00 0.00 174.94 175.62 3i4n s THR 1213N 0.85 5.08 -0.89 2.92 -4.23 -1.26 -2.95 115.64 115.16 3i4n s THR 1213Ca -0.07 0.43 -0.14 0.00 -1.18 0.00 0.00 61.69 60.73 3i4n s THR 1213Cb -0.15 -3.87 0.22 0.00 1.34 0.00 0.00 72.50 70.04 3i4n s THR 1213CO -0.01 -0.08 0.86 -2.16 -0.54 0.00 0.00 174.62 172.69 3i4n s PRO 1214N 2.26 3.71 0.31 3.99 0.04 -1.26 -5.03 135.00 139.02 3i4n s PRO 1214Ca 0.17 -2.52 -0.28 0.00 0.04 0.00 0.00 61.00 58.41 3i4n s PRO 1214Cb -0.16 -4.50 -0.09 0.00 0.04 0.00 0.00 34.50 29.79 3i4n s PRO 1214CO 0.12 -1.33 1.13 1.03 0.04 0.00 0.00 177.00 177.99 3i4n s ARG 1215N 0.18 4.50 -0.17 4.56 1.81 -1.25 -4.64 118.95 123.93 3i4n s ARG 1215Ca 0.22 1.84 0.01 0.00 -1.72 0.00 0.00 55.73 56.07 3i4n s ARG 1215Cb -0.09 -3.06 0.02 0.00 -0.45 0.00 0.00 34.95 31.37 3i4n s ARG 1215CO -0.09 0.07 -0.19 -0.51 -0.68 0.00 0.00 175.30 173.90 3i4n s LEU 1216N -1.72 2.07 -0.14 2.53 1.43 -0.13 -4.92 118.68 117.80 3i4n s LEU 1216Ca 0.48 -0.62 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 3i4n s LEU 1216Cb -0.32 -1.44 0.00 0.00 0.03 0.00 0.00 46.19 44.47 3i4n s LEU 1216CO 0.41 -0.00 -0.19 -0.31 0.23 0.00 0.00 176.35 176.49 3i4n s TYR 1217N 1.27 2.71 -1.93 0.29 1.51 -1.26 -4.38 117.35 115.56 3i4n s TYR 1217Ca 0.04 -1.20 0.10 0.00 -1.01 0.00 0.00 57.07 55.00 3i4n s TYR 1217Cb -0.13 -1.84 0.60 0.00 -0.11 0.00 0.00 41.96 40.48 3i4n s TYR 1217CO -0.12 -0.54 1.07 0.25 -1.11 0.00 0.00 175.55 175.10 3i4n n THR 1218N 4.02 0.10 -3.58 -0.71 -2.24 -1.26 -4.71 114.28 105.90 3i4n n THR 1218Ca -0.20 0.03 -0.16 0.00 -2.27 0.00 0.00 64.05 61.45 3i4n n THR 1218Cb 0.52 -0.87 -0.06 0.00 -2.10 0.00 0.00 70.33 67.82 3i4n n THR 1218CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3i4n s ASP 1219N -2.07 -0.50 0.29 3.42 1.47 -1.26 -5.17 116.67 112.85 3i4n s ASP 1219Ca 0.15 0.41 0.05 0.00 1.18 0.00 0.00 52.55 54.34 3i4n s ASP 1219Cb 0.07 0.48 -0.02 0.00 -0.34 0.00 0.00 42.92 43.11 3i4n s ASP 1219CO 0.12 -0.62 0.42 0.00 0.68 0.00 0.00 175.17 175.77 3i4n s ARG 1220N -1.68 3.30 0.00 2.11 1.70 -1.26 -4.98 118.95 118.14 3i4n s ARG 1220Ca -0.09 -0.84 0.00 0.00 -0.47 0.00 0.00 55.73 54.33 3i4n s ARG 1220Cb -0.01 -2.84 0.00 0.00 -0.57 0.00 0.00 34.95 31.53 3i4n s ARG 1220CO 0.05 0.25 0.00 -1.13 -1.08 0.00 0.00 175.30 173.38 3i4n n SER 1221N -1.54 2.42 -0.12 -2.89 3.41 -1.26 -4.85 113.62 108.79 3i4n n SER 1221Ca -0.05 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.51 3i4n n SER 1221Cb 0.57 0.32 0.02 0.00 -0.26 0.00 0.00 64.21 64.86 3i4n n SER 1221CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3i4n h ARG 1222N 0.00 0.02 0.00 4.33 2.43 -2.07 -3.47 114.38 115.62 3i4n h ARG 1222Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3i4n h ARG 1222Cb 0.33 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3i4n h ARG 1222CO 0.00 0.01 0.00 -0.25 -1.51 0.00 0.00 179.97 178.22 3i4n n ASP 1223N -5.28 0.00 0.00 -3.80 8.00 -1.26 -5.36 116.55 108.84 3i4n n ASP 1223Ca 0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.52 3i4n n ASP 1223Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 3i4n n ASP 1223CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14