#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ii5 n SER 2 N 0.00 4.90 -4.78 1.61 3.41 -1.26 -4.95 113.62 112.55 1ii5 n SER 2 Ca 0.00 -2.54 -0.35 0.00 -0.26 0.00 0.00 58.87 55.73 1ii5 n SER 2 Cb 0.00 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 1ii5 n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ii5 s ALA 3 N -2.03 2.68 0.20 7.33 0.00 -1.26 -4.94 121.76 123.74 1ii5 s ALA 3 Ca 0.51 0.78 -0.32 0.00 0.00 0.00 0.00 51.96 52.93 1ii5 s ALA 3 Cb 0.34 -3.35 -0.14 0.00 0.00 0.00 0.00 23.12 19.97 1ii5 s ALA 3 CO 0.23 -0.79 1.33 -0.12 0.00 0.00 0.00 175.76 176.41 1ii5 n MET 4 N -1.40 1.68 -2.58 0.00 1.56 -1.26 -4.73 117.12 110.38 1ii5 n MET 4 Ca 0.11 0.60 -0.38 0.00 -0.27 0.00 0.00 57.70 57.76 1ii5 n MET 4 Cb 0.51 -2.21 -0.05 0.00 2.15 0.00 0.00 33.22 33.62 1ii5 n MET 4 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1ii5 s ALA 5 N 0.03 3.21 0.19 -5.12 0.00 -1.26 -4.68 121.76 114.13 1ii5 s ALA 5 Ca 0.72 0.71 -0.30 0.00 0.00 0.00 0.00 51.96 53.09 1ii5 s ALA 5 Cb -0.74 -3.26 -0.08 0.00 0.00 0.00 0.00 23.12 19.03 1ii5 s ALA 5 CO 0.49 -0.10 0.95 -0.51 0.00 0.00 0.00 175.76 176.59 1ii5 s LEU 6 N -2.13 4.59 -0.51 0.00 1.43 0.01 -4.83 118.68 117.25 1ii5 s LEU 6 Ca 0.52 1.90 -0.24 0.00 -1.03 0.00 0.00 54.13 55.28 1ii5 s LEU 6 Cb -0.24 -3.60 0.04 0.00 0.03 0.00 0.00 46.19 42.41 1ii5 s LEU 6 CO 0.31 0.07 0.89 -0.54 0.23 0.00 0.00 176.35 177.31 1ii5 s LYS 7 N -0.74 3.37 -0.38 1.70 1.02 -1.26 -1.13 119.74 122.32 1ii5 s LYS 7 Ca 0.43 -0.19 -0.12 0.00 0.02 0.00 0.00 55.97 56.12 1ii5 s LYS 7 Cb -0.25 -4.01 0.02 0.00 -0.52 0.00 0.00 37.83 33.07 1ii5 s LYS 7 CO 0.31 -1.35 0.23 0.08 -0.92 0.00 0.00 175.35 173.70 1ii5 s VAL 8 N 3.71 4.78 0.18 3.17 1.01 0.17 -0.62 120.40 132.81 1ii5 s VAL 8 Ca 0.31 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 1ii5 s VAL 8 Cb -0.12 -3.65 -0.07 0.00 0.00 0.00 0.00 36.38 32.53 1ii5 s VAL 8 CO 0.21 -0.23 0.95 -0.83 0.00 0.00 0.00 175.10 175.20 1ii5 s GLY 9 N 1.60 3.06 -0.08 4.51 0.00 0.11 -0.83 107.32 115.68 1ii5 s GLY 9 Ca 0.03 0.60 0.04 0.00 0.00 0.00 0.00 44.72 45.39 1ii5 s GLY 9 CO 0.08 1.33 -0.20 0.14 0.00 0.00 0.00 173.10 174.44 1ii5 s VAL 10 N -0.58 1.76 0.04 1.40 1.01 -0.19 -0.77 120.40 123.07 1ii5 s VAL 10 Ca 0.44 -0.86 -0.10 0.00 0.00 0.00 0.00 61.98 61.47 1ii5 s VAL 10 Cb -0.25 -1.53 0.01 0.00 0.00 0.00 0.00 36.38 34.61 1ii5 s VAL 10 CO 0.31 0.49 0.21 0.54 0.00 0.00 0.00 175.10 176.65 1ii5 s VAL 11 N 0.34 0.11 0.00 2.92 0.11 -1.04 -0.65 120.40 122.18 1ii5 s VAL 11 Ca -0.15 -0.87 0.00 0.00 -2.93 0.00 0.00 61.98 58.04 1ii5 s VAL 11 Cb -0.16 -0.91 0.00 0.00 -1.53 0.00 0.00 36.38 33.78 1ii5 s VAL 11 CO 0.06 -0.48 0.00 0.61 -3.33 0.00 0.00 175.10 171.97 1ii5 n GLY 12 N 0.69 1.25 3.48 6.54 0.00 -1.26 -4.15 105.19 111.73 1ii5 n GLY 12 Ca -0.19 -2.20 -0.23 0.00 0.00 0.00 0.00 46.02 43.41 1ii5 n GLY 12 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ii5 s ASN 13 N 0.00 2.75 0.63 1.61 0.01 -1.26 -4.70 114.94 113.99 1ii5 s ASN 13 Ca 0.00 -1.33 -0.18 0.00 -0.71 0.00 0.00 52.86 50.64 1ii5 s ASN 13 Cb 0.00 -0.16 -0.02 0.00 0.41 0.00 0.00 41.25 41.48 1ii5 s ASN 13 CO 0.00 -0.51 1.30 -2.84 -1.51 0.00 0.00 177.10 173.54 1ii5 s PRO 14 N -3.82 2.64 0.00 -0.60 0.02 -0.50 -1.67 135.00 131.07 1ii5 s PRO 14 Ca 0.34 2.07 0.12 0.00 0.02 0.00 0.00 61.00 63.56 1ii5 s PRO 14 Cb 0.08 -1.89 0.39 0.00 0.02 0.00 0.00 34.50 33.10 1ii5 s PRO 14 CO 0.15 -1.53 1.31 -0.35 -0.33 0.00 0.00 177.00 176.25 1ii5 n PRO 15 N -1.79 1.73 0.11 5.54 -0.04 -1.26 -4.12 135.00 135.15 1ii5 n PRO 15 Ca 0.15 -1.12 -0.17 0.00 -0.04 0.00 0.00 63.50 62.32 1ii5 n PRO 15 Cb 0.48 -1.28 -0.13 0.00 -0.04 0.00 0.00 33.50 32.53 1ii5 n PRO 15 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1ii5 h PHE 16 N 1.91 0.58 -3.30 0.54 -1.00 -1.72 -1.81 116.94 112.15 1ii5 h PHE 16 Ca 0.00 -0.41 -0.24 0.00 2.81 0.00 0.00 57.97 60.13 1ii5 h PHE 16 Cb 0.43 -0.03 -0.31 0.00 3.61 0.00 0.00 35.95 39.65 1ii5 h PHE 16 CO 0.19 1.30 -0.60 0.08 -1.61 0.00 0.00 178.31 177.67 1ii5 s VAL 17 N -2.73 -0.04 0.03 -0.55 1.01 -0.67 -1.27 120.40 116.19 1ii5 s VAL 17 Ca -0.05 0.16 0.06 0.00 0.00 0.00 0.00 61.98 62.15 1ii5 s VAL 17 Cb 0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 36.38 36.20 1ii5 s VAL 17 CO 0.89 0.06 -0.19 -0.36 0.00 0.00 0.00 175.10 175.51 1ii5 s PHE 18 N 1.00 1.64 -0.32 5.22 0.40 0.44 -1.41 117.98 124.97 1ii5 s PHE 18 Ca -0.08 -0.36 -0.04 0.00 -0.60 0.00 0.00 56.93 55.86 1ii5 s PHE 18 Cb -0.10 -0.99 0.05 0.00 0.51 0.00 0.00 43.02 42.49 1ii5 s PHE 18 CO -0.05 0.06 0.04 0.71 0.70 0.00 0.00 175.22 176.68 1ii5 s TYR 19 N -0.75 3.26 0.00 0.36 1.51 -1.26 -2.11 117.35 118.36 1ii5 s TYR 19 Ca 0.06 -1.69 0.00 0.00 -1.01 0.00 0.00 57.07 54.43 1ii5 s TYR 19 Cb -0.08 -2.17 0.00 0.00 -0.11 0.00 0.00 41.96 39.59 1ii5 s TYR 19 CO 0.01 -0.77 0.00 0.41 -1.11 0.00 0.00 175.55 174.09 1ii5 n GLY 20 N 4.70 1.86 0.13 0.71 0.00 -1.26 -4.99 105.19 106.34 1ii5 n GLY 20 Ca -0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 1ii5 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ii5 n ALA 26 N -3.00 1.21 -3.75 4.61 0.00 -1.26 -5.14 120.51 113.18 1ii5 n ALA 26 Ca 0.00 -1.02 -0.16 0.00 0.00 0.00 0.00 53.44 52.26 1ii5 n ALA 26 Cb 0.00 -0.03 -0.16 0.00 0.00 0.00 0.00 19.45 19.25 1ii5 n ALA 26 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ii5 s PHE 27 N -2.50 0.02 0.30 0.00 0.40 -1.26 -4.97 117.98 109.97 1ii5 s PHE 27 Ca -0.36 0.19 0.02 0.00 -0.60 0.00 0.00 56.93 56.18 1ii5 s PHE 27 Cb 0.12 -0.27 -0.02 0.00 0.51 0.00 0.00 43.02 43.36 1ii5 s PHE 27 CO 0.54 -0.12 0.31 0.95 0.70 0.00 0.00 175.22 177.61 1ii5 s THR 28 N 1.31 0.00 0.00 0.64 -4.23 -0.90 -4.98 115.64 107.48 1ii5 s THR 28 Ca -0.06 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 1ii5 s THR 28 Cb -0.13 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.19 1ii5 s THR 28 CO -0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 1ii5 n GLY 29 N -0.52 2.25 0.20 3.99 0.00 -1.26 -0.42 105.19 109.42 1ii5 n GLY 29 Ca 0.04 -2.17 -0.02 0.00 0.00 0.00 0.00 46.02 43.87 1ii5 n GLY 29 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ii5 h ILE 30 N 0.00 0.69 -0.92 -0.61 2.04 -1.01 -0.02 117.51 117.67 1ii5 h ILE 30 Ca 0.00 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1ii5 h ILE 30 Cb 0.00 0.47 -0.04 0.00 -0.74 0.00 0.00 36.82 36.51 1ii5 h ILE 30 CO 0.00 0.04 0.55 0.28 0.00 0.00 0.00 178.15 179.01 1ii5 h SER 31 N 0.20 1.11 -0.09 1.72 0.02 -1.45 -1.26 113.55 113.81 1ii5 h SER 31 Ca 0.25 -0.07 -0.12 0.00 -0.84 0.00 0.00 61.79 61.01 1ii5 h SER 31 Cb 0.35 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1ii5 h SER 31 CO -0.35 0.86 -0.33 -0.07 -1.14 0.00 0.00 176.83 175.80 1ii5 h LEU 32 N 1.27 0.60 -0.66 5.07 -0.00 -1.44 -1.45 115.31 118.69 1ii5 h LEU 32 Ca 0.33 -0.24 -0.06 0.00 -0.00 0.00 0.00 57.88 57.90 1ii5 h LEU 32 Cb -0.04 -0.17 -0.03 0.00 -0.00 0.00 0.00 40.66 40.43 1ii5 h LEU 32 CO -0.06 0.89 0.16 0.44 -0.00 0.00 0.00 178.44 179.87 1ii5 h ASP 33 N 0.49 1.00 0.07 -0.43 3.32 -0.50 0.52 116.42 120.89 1ii5 h ASP 33 Ca 0.06 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 56.87 1ii5 h ASP 33 Cb 0.81 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1ii5 h ASP 33 CO 0.07 0.98 -0.03 0.58 -1.72 0.00 0.00 179.24 179.11 1ii5 h VAL 34 N 0.99 1.10 -0.24 -1.35 2.07 -1.05 -2.10 116.25 115.67 1ii5 h VAL 34 Ca 0.21 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 1ii5 h VAL 34 Cb 0.36 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1ii5 h VAL 34 CO 0.00 0.14 0.15 -0.25 0.02 0.00 0.00 177.57 177.63 1ii5 h TRP 35 N -0.35 0.31 -0.75 1.57 2.91 -1.19 -2.25 115.95 116.21 1ii5 h TRP 35 Ca -0.01 0.00 0.01 0.00 1.13 0.00 0.00 58.89 60.02 1ii5 h TRP 35 Cb 0.30 -0.10 -0.04 0.00 -0.51 0.00 0.00 29.16 28.81 1ii5 h TRP 35 CO 0.01 0.22 0.50 0.00 -1.03 0.00 0.00 178.44 178.14 1ii5 h ARG 36 N 0.30 0.98 -0.68 2.65 3.08 -0.90 0.63 114.38 120.44 1ii5 h ARG 36 Ca 0.09 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 1ii5 h ARG 36 Cb 0.00 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.80 1ii5 h ARG 36 CO -0.02 0.65 0.20 0.00 -1.07 0.00 0.00 179.97 179.73 1ii5 h ALA 37 N 1.54 0.89 0.15 0.04 0.00 -1.08 0.87 119.26 121.66 1ii5 h ALA 37 Ca 0.28 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ii5 h ALA 37 Cb -0.11 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.43 1ii5 h ALA 37 CO -0.06 0.58 -0.07 0.28 0.00 0.00 0.00 179.25 179.97 1ii5 h VAL 38 N 0.99 0.96 -0.73 0.00 2.07 -0.73 -2.08 116.25 116.73 1ii5 h VAL 38 Ca 0.22 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 67.30 1ii5 h VAL 38 Cb 0.32 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.29 1ii5 h VAL 38 CO -0.00 0.11 0.47 0.00 0.02 0.00 0.00 177.57 178.16 1ii5 h ALA 39 N 0.40 0.93 -0.68 1.67 0.00 -0.73 -2.59 119.26 118.26 1ii5 h ALA 39 Ca -0.02 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1ii5 h ALA 39 Cb 0.33 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1ii5 h ALA 39 CO 0.03 0.30 0.20 0.93 0.00 0.00 0.00 179.25 180.70 1ii5 h GLU 40 N 0.94 1.06 0.00 0.00 5.08 -0.80 0.71 114.58 121.57 1ii5 h GLU 40 Ca 0.28 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1ii5 h GLU 40 Cb -0.05 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 1ii5 h GLU 40 CO -0.08 0.92 -0.06 0.66 -1.00 0.00 0.00 179.01 179.45 1ii5 h SER 41 N 1.02 0.00 -0.02 1.42 4.64 -0.98 -1.98 113.55 117.65 1ii5 h SER 41 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1ii5 h SER 41 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1ii5 h SER 41 CO -0.00 0.06 -0.10 0.00 -0.87 0.00 0.00 176.83 175.91 1ii5 n GLN 42 N -3.44 1.40 -3.32 4.77 1.13 -0.85 -4.98 117.38 112.09 1ii5 n GLN 42 Ca -0.02 -1.24 -0.23 0.00 -1.94 0.00 0.00 57.00 53.57 1ii5 n GLN 42 Cb 0.19 -1.29 0.06 0.00 0.11 0.00 0.00 30.24 29.31 1ii5 n GLN 42 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1ii5 n LYS 43 N 0.57 -6.53 -3.25 -1.09 2.85 -0.06 -4.99 118.16 105.67 1ii5 n LYS 43 Ca 0.08 0.87 -0.32 0.00 -1.05 0.00 0.00 58.31 57.89 1ii5 n LYS 43 Cb 0.38 -5.83 -0.06 0.00 -0.65 0.00 0.00 35.03 28.87 1ii5 n LYS 43 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 1ii5 s TRP 44 N -3.26 3.40 -0.02 5.58 0.51 0.04 -4.80 118.94 120.40 1ii5 s TRP 44 Ca 0.45 1.04 -0.03 0.00 -2.12 0.00 0.00 56.10 55.45 1ii5 s TRP 44 Cb -0.20 -2.40 -0.04 0.00 -0.81 0.00 0.00 33.47 30.02 1ii5 s TRP 44 CO 0.56 0.16 0.18 -0.80 -0.51 0.00 0.00 176.95 176.54 1ii5 s ASN 45 N -2.37 6.37 0.13 2.95 0.01 -1.26 -4.65 114.94 116.12 1ii5 s ASN 45 Ca 0.51 0.36 0.07 0.00 -0.71 0.00 0.00 52.86 53.09 1ii5 s ASN 45 Cb -0.11 -2.01 -0.04 0.00 0.41 0.00 0.00 41.25 39.51 1ii5 s ASN 45 CO 0.20 0.27 -0.16 -0.44 -1.51 0.00 0.00 177.10 175.46 1ii5 s SER 46 N -1.88 2.27 -0.22 -1.22 0.01 -1.26 -0.81 113.70 110.59 1ii5 s SER 46 Ca 0.27 -0.79 -0.03 0.00 1.31 0.00 0.00 55.95 56.70 1ii5 s SER 46 Cb -0.13 -0.10 0.07 0.00 0.21 0.00 0.00 66.02 66.07 1ii5 s SER 46 CO 0.18 -0.08 0.05 -0.70 0.41 0.00 0.00 173.24 173.11 1ii5 s GLU 47 N -2.53 0.61 0.05 12.44 2.12 -0.28 -4.84 118.70 126.26 1ii5 s GLU 47 Ca 0.10 -0.52 -0.22 0.00 0.36 0.00 0.00 54.97 54.69 1ii5 s GLU 47 Cb -0.06 -2.02 -0.06 0.00 0.26 0.00 0.00 34.13 32.25 1ii5 s GLU 47 CO 0.04 -0.72 0.65 0.71 -0.54 0.00 0.00 175.26 175.40 1ii5 s TYR 48 N 1.85 3.75 -0.13 5.30 1.51 -1.26 -0.65 117.35 127.72 1ii5 s TYR 48 Ca 0.01 1.33 -0.02 0.00 -1.01 0.00 0.00 57.07 57.38 1ii5 s TYR 48 Cb -0.17 -2.65 0.04 0.00 -0.11 0.00 0.00 41.96 39.07 1ii5 s TYR 48 CO -0.13 0.41 0.03 0.08 -1.11 0.00 0.00 175.55 174.83 1ii5 s VAL 49 N -0.50 0.37 0.25 0.71 1.01 -0.01 -4.96 120.40 117.27 1ii5 s VAL 49 Ca 0.33 -0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.84 1ii5 s VAL 49 Cb -0.20 -0.72 -0.10 0.00 0.00 0.00 0.00 36.38 35.36 1ii5 s VAL 49 CO 0.20 0.01 1.45 -0.60 0.00 0.00 0.00 175.10 176.17 1ii5 s ARG 50 N 1.95 4.26 -0.00 2.72 3.52 -1.26 -1.02 118.95 129.11 1ii5 s ARG 50 Ca 0.02 2.32 0.00 0.00 -0.13 0.00 0.00 55.73 57.94 1ii5 s ARG 50 Cb -0.15 -3.11 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 1ii5 s ARG 50 CO -0.07 -0.44 0.05 -0.65 -0.81 0.00 0.00 175.30 173.39 1ii5 s GLN 51 N -0.32 2.96 0.23 5.12 -1.52 0.18 -4.82 119.66 121.49 1ii5 s GLN 51 Ca 0.60 -0.54 -0.04 0.00 -1.95 0.00 0.00 55.36 53.43 1ii5 s GLN 51 Cb -0.42 -2.79 0.24 0.00 -0.22 0.00 0.00 33.01 29.82 1ii5 s GLN 51 CO 0.43 0.64 1.70 -0.97 -0.25 0.00 0.00 175.29 176.84 1ii5 h ASN 52 N 4.17 0.83 -5.10 5.90 -1.24 -1.95 -3.44 115.58 114.75 1ii5 h ASN 52 Ca -0.49 -0.23 0.01 0.00 0.71 0.00 0.00 56.30 56.30 1ii5 h ASN 52 Cb 1.18 -0.22 -0.07 0.00 0.73 0.00 0.00 38.32 39.93 1ii5 h ASN 52 CO 0.60 0.93 0.08 -0.94 -1.29 0.00 0.00 177.43 176.81 1ii5 s SER 53 N -6.66 -0.20 0.16 1.15 1.04 -1.26 -5.03 113.70 102.90 1ii5 s SER 53 Ca -0.10 -0.70 -0.11 0.00 0.48 0.00 0.00 55.95 55.52 1ii5 s SER 53 Cb 0.14 0.66 0.05 0.00 0.10 0.00 0.00 66.02 66.96 1ii5 s SER 53 CO 0.83 -1.23 1.65 0.40 0.98 0.00 0.00 173.24 175.87 1ii5 h ILE 54 N 2.12 1.26 -0.36 -1.02 2.04 -1.91 -1.36 117.51 118.27 1ii5 h ILE 54 Ca -0.23 -0.98 -0.00 0.00 1.00 0.00 0.00 64.86 64.65 1ii5 h ILE 54 Cb 1.25 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 1ii5 h ILE 54 CO 0.30 0.36 0.22 0.28 0.00 0.00 0.00 178.15 179.31 1ii5 h SER 55 N 0.82 0.43 -0.65 1.72 0.02 -1.97 0.97 113.55 114.89 1ii5 h SER 55 Ca 0.17 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1ii5 h SER 55 Cb 0.42 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.82 1ii5 h SER 55 CO 0.01 0.35 0.37 0.00 -1.14 0.00 0.00 176.83 176.41 1ii5 h ALA 56 N 1.10 0.83 -0.60 3.77 0.00 -1.93 -1.97 119.26 120.46 1ii5 h ALA 56 Ca 0.13 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1ii5 h ALA 56 Cb -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1ii5 h ALA 56 CO -0.03 0.34 0.19 0.78 0.00 0.00 0.00 179.25 180.53 1ii5 h GLY 57 N 0.89 1.00 1.05 0.00 0.00 -0.74 -1.68 103.07 103.59 1ii5 h GLY 57 Ca 0.23 -0.59 -0.05 0.00 0.00 0.00 0.00 47.33 46.92 1ii5 h GLY 57 CO -0.04 0.55 0.26 -2.22 0.00 0.00 0.00 176.54 175.09 1ii5 h ILE 58 N 0.85 1.26 -0.57 2.60 2.04 -0.57 -1.79 117.51 121.33 1ii5 h ILE 58 Ca 0.19 -0.88 -0.07 0.00 1.00 0.00 0.00 64.86 65.10 1ii5 h ILE 58 Cb 0.28 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1ii5 h ILE 58 CO -0.01 0.35 0.07 0.74 0.00 0.00 0.00 178.15 179.30 1ii5 h THR 59 N 1.11 1.25 -0.25 -0.27 2.02 -1.18 -1.13 112.91 114.46 1ii5 h THR 59 Ca 0.25 -0.98 -0.06 0.00 0.77 0.00 0.00 66.41 66.39 1ii5 h THR 59 Cb 0.28 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 1ii5 h THR 59 CO -0.01 0.36 -0.10 0.00 0.37 0.00 0.00 175.52 176.13 1ii5 h ALA 60 N 1.20 1.36 -0.15 6.16 0.00 -0.83 0.11 119.26 127.12 1ii5 h ALA 60 Ca 0.17 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 1ii5 h ALA 60 Cb 0.42 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1ii5 h ALA 60 CO 0.01 0.43 -0.54 0.28 0.00 0.00 0.00 179.25 179.44 1ii5 h VAL 61 N 0.38 1.33 -0.52 0.00 2.07 -0.73 0.23 116.25 119.01 1ii5 h VAL 61 Ca 0.08 -1.80 -0.05 0.00 0.82 0.00 0.00 66.70 65.74 1ii5 h VAL 61 Cb 0.42 2.04 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 1ii5 h VAL 61 CO 0.02 0.56 0.11 0.00 0.02 0.00 0.00 177.57 178.27 1ii5 h ALA 62 N 0.53 1.20 -0.03 1.67 0.00 -0.89 -2.27 119.26 119.47 1ii5 h ALA 62 Ca -0.03 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1ii5 h ALA 62 Cb 1.17 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1ii5 h ALA 62 CO 0.11 0.54 0.00 -0.85 0.00 0.00 0.00 179.25 179.06 1ii5 n GLU 63 N -4.27 1.28 -0.99 0.00 0.28 0.34 -4.92 120.64 112.36 1ii5 n GLU 63 Ca 0.04 -0.41 0.00 0.00 -0.16 0.00 0.00 57.16 56.63 1ii5 n GLU 63 Cb 0.24 -1.44 0.00 0.00 1.43 0.00 0.00 31.44 31.67 1ii5 n GLU 63 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ii5 n GLY 64 N 1.02 0.74 0.19 -1.84 0.00 -0.85 -4.90 105.19 99.54 1ii5 n GLY 64 Ca 0.20 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.27 1ii5 n GLY 64 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ii5 h GLU 65 N 1.99 0.00 -5.63 1.61 5.08 -0.81 -3.44 114.58 113.38 1ii5 h GLU 65 Ca 0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.89 1ii5 h GLU 65 Cb 0.01 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 29.04 1ii5 h GLU 65 CO 0.00 0.37 -0.80 -0.51 -1.00 0.00 0.00 179.01 177.07 1ii5 s LEU 66 N -6.93 2.27 0.00 1.33 1.43 -0.80 -4.92 118.68 111.06 1ii5 s LEU 66 Ca 0.01 -0.62 0.13 0.00 -1.03 0.00 0.00 54.13 52.61 1ii5 s LEU 66 Cb 0.10 -0.66 -0.21 0.00 0.03 0.00 0.00 46.19 45.46 1ii5 s LEU 66 CO 0.69 -0.01 0.79 0.44 0.23 0.00 0.00 176.35 178.48 1ii5 h ASP 67 N 4.31 0.00 -4.87 2.29 3.32 -1.16 -3.39 116.42 116.91 1ii5 h ASP 67 Ca -0.42 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.57 1ii5 h ASP 67 Cb 1.19 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.54 1ii5 h ASP 67 CO 0.40 0.92 0.16 -0.51 -1.72 0.00 0.00 179.24 178.50 1ii5 s ILE 68 N -2.67 0.00 -0.21 0.35 2.07 -1.09 -4.20 121.20 115.45 1ii5 s ILE 68 Ca -0.03 -0.02 -0.02 0.00 -1.41 0.00 0.00 60.65 59.16 1ii5 s ILE 68 Cb 0.08 -0.98 0.00 0.00 0.13 0.00 0.00 42.46 41.70 1ii5 s ILE 68 CO 0.82 -0.01 -0.10 -0.22 -1.91 0.00 0.00 174.94 173.52 1ii5 s LEU 69 N -1.00 2.65 0.24 8.50 2.96 -0.22 -0.72 118.68 131.09 1ii5 s LEU 69 Ca -0.10 -0.50 0.09 0.00 -0.22 0.00 0.00 54.13 53.41 1ii5 s LEU 69 Cb -0.01 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 44.99 1ii5 s LEU 69 CO 0.09 -0.02 -0.04 0.27 -1.32 0.00 0.00 176.35 175.33 1ii5 s ILE 70 N 1.41 3.35 -5.00 6.68 -4.36 0.05 -1.18 121.20 122.15 1ii5 s ILE 70 Ca 0.05 -1.83 0.00 0.00 -0.26 0.00 0.00 60.65 58.62 1ii5 s ILE 70 Cb -0.14 -2.75 0.00 0.00 1.25 0.00 0.00 42.46 40.82 1ii5 s ILE 70 CO -0.07 -0.28 0.00 0.61 0.24 0.00 0.00 174.94 175.44 1ii5 n GLY 71 N -0.56 0.83 2.53 6.27 0.00 -1.26 -2.50 105.19 110.50 1ii5 n GLY 71 Ca -0.08 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.64 1ii5 n GLY 71 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ii5 n PRO 72 N -1.06 3.39 -2.97 1.61 -0.04 -1.26 -4.62 135.00 130.05 1ii5 n PRO 72 Ca 0.00 -2.51 -0.43 0.00 -0.04 0.00 0.00 63.50 60.52 1ii5 n PRO 72 Cb 0.00 -3.00 -0.05 0.00 -0.04 0.00 0.00 33.50 30.40 1ii5 n PRO 72 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ii5 s ILE 73 N 2.32 4.65 0.21 0.52 1.01 -1.25 -4.95 121.20 123.70 1ii5 s ILE 73 Ca 0.58 0.37 -0.31 0.00 0.00 0.00 0.00 60.65 61.29 1ii5 s ILE 73 Cb 0.16 -4.33 -0.11 0.00 0.01 0.00 0.00 42.46 38.19 1ii5 s ILE 73 CO -0.07 -0.74 1.59 -0.44 0.00 0.00 0.00 174.94 175.28 1ii5 s SER 74 N 2.19 6.51 -0.54 3.58 0.01 -1.26 -1.08 113.70 123.11 1ii5 s SER 74 Ca 0.29 2.74 -0.25 0.00 1.31 0.00 0.00 55.95 60.04 1ii5 s SER 74 Cb -0.12 -2.61 0.04 0.00 0.21 0.00 0.00 66.02 63.54 1ii5 s SER 74 CO 0.22 -0.86 0.96 -0.69 0.41 0.00 0.00 173.24 173.28 1ii5 s VAL 75 N 0.78 4.37 0.25 3.43 1.01 -0.23 -4.89 120.40 125.13 1ii5 s VAL 75 Ca 0.68 0.41 0.11 0.00 0.00 0.00 0.00 61.98 63.18 1ii5 s VAL 75 Cb -0.46 -4.54 -0.05 0.00 0.00 0.00 0.00 36.38 31.34 1ii5 s VAL 75 CO 0.36 -1.09 -0.19 0.42 0.00 0.00 0.00 175.10 174.60 1ii5 s THR 76 N 4.00 2.28 0.22 3.92 -4.23 -1.26 -4.68 115.64 115.89 1ii5 s THR 76 Ca 0.33 -2.29 -0.09 0.00 -1.18 0.00 0.00 61.69 58.46 1ii5 s THR 76 Cb -0.12 -2.20 0.16 0.00 1.34 0.00 0.00 72.50 71.68 1ii5 s THR 76 CO 0.21 -0.39 1.83 -0.65 -0.54 0.00 0.00 174.62 175.08 1ii5 h PRO 77 N 2.52 0.78 -0.67 3.99 0.11 -1.98 0.05 132.00 136.80 1ii5 h PRO 77 Ca -0.41 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.60 1ii5 h PRO 77 Cb 1.24 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 1ii5 h PRO 77 CO 0.58 0.51 0.19 0.93 -0.21 0.00 0.00 178.00 180.00 1ii5 h GLU 78 N 0.80 1.03 -0.01 1.05 3.07 -1.98 -1.64 114.58 116.89 1ii5 h GLU 78 Ca 0.31 -0.22 -0.25 0.00 -0.50 0.00 0.00 59.36 58.70 1ii5 h GLU 78 Cb 0.13 -0.15 0.01 0.00 -0.84 0.00 0.00 28.75 27.90 1ii5 h GLU 78 CO -0.16 0.90 -0.99 0.00 -1.40 0.00 0.00 179.01 177.36 1ii5 h ARG 79 N 0.99 0.62 0.00 2.33 3.08 -1.83 -3.12 114.38 116.46 1ii5 h ARG 79 Ca 0.22 -0.65 -0.01 0.00 0.07 0.00 0.00 59.98 59.60 1ii5 h ARG 79 Cb 0.31 0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 1ii5 h ARG 79 CO -0.00 1.25 -0.05 0.00 -1.07 0.00 0.00 179.97 180.10 1ii5 h ALA 80 N 0.52 1.08 0.00 0.04 0.00 -0.85 -2.21 119.26 117.85 1ii5 h ALA 80 Ca -0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ii5 h ALA 80 Cb 1.63 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1ii5 h ALA 80 CO 0.19 0.06 -0.14 0.00 0.00 0.00 0.00 179.25 179.35 1ii5 n ALA 81 N -2.15 2.62 -1.93 0.00 0.00 -0.63 -4.86 120.51 113.56 1ii5 n ALA 81 Ca -0.01 -0.15 -0.42 0.00 0.00 0.00 0.00 53.44 52.86 1ii5 n ALA 81 Cb 0.23 -1.38 -0.03 0.00 0.00 0.00 0.00 19.45 18.28 1ii5 n ALA 81 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ii5 s ILE 82 N -3.02 2.88 0.31 0.00 1.01 -0.83 -4.94 121.20 116.61 1ii5 s ILE 82 Ca 0.12 0.47 -0.29 0.00 0.00 0.00 0.00 60.65 60.95 1ii5 s ILE 82 Cb 0.18 -3.30 -0.11 0.00 0.01 0.00 0.00 42.46 39.24 1ii5 s ILE 82 CO 0.59 0.01 1.49 -1.83 0.00 0.00 0.00 174.94 175.20 1ii5 s GLU 83 N 2.10 4.18 0.00 2.79 4.04 -1.26 -3.30 118.70 127.26 1ii5 s GLU 83 Ca 0.73 2.47 0.00 0.00 0.04 0.00 0.00 54.97 58.20 1ii5 s GLU 83 Cb -0.41 -3.03 0.00 0.00 0.02 0.00 0.00 34.13 30.70 1ii5 s GLU 83 CO 0.32 -0.50 0.00 0.41 -1.84 0.00 0.00 175.26 173.65 1ii5 n GLY 84 N 1.54 0.84 3.39 -3.83 0.00 -1.26 -4.86 105.19 101.01 1ii5 n GLY 84 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 1ii5 n GLY 84 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ii5 s ILE 85 N -3.10 1.41 -0.14 -0.61 -5.25 -1.21 -0.95 121.20 111.34 1ii5 s ILE 85 Ca 0.00 -2.09 -0.14 0.00 -0.99 0.00 0.00 60.65 57.43 1ii5 s ILE 85 Cb 0.00 -2.38 0.04 0.00 2.95 0.00 0.00 42.46 43.07 1ii5 s ILE 85 CO 0.00 -0.33 0.40 0.28 -1.79 0.00 0.00 174.94 173.50 1ii5 s THR 86 N -3.17 0.00 0.34 8.37 -1.32 -0.37 -4.46 115.64 115.04 1ii5 s THR 86 Ca 0.28 -0.02 -0.13 0.00 -1.21 0.00 0.00 61.69 60.62 1ii5 s THR 86 Cb 0.04 -0.56 -0.08 0.00 -1.51 0.00 0.00 72.50 70.39 1ii5 s THR 86 CO 0.10 -0.01 0.73 -0.36 -2.21 0.00 0.00 174.62 172.87 1ii5 s PHE 87 N 0.15 3.40 0.92 9.09 0.40 -1.26 -1.06 117.98 129.62 1ii5 s PHE 87 Ca -0.01 1.13 -0.14 0.00 -0.60 0.00 0.00 56.93 57.31 1ii5 s PHE 87 Cb -0.03 -2.48 0.17 0.00 0.51 0.00 0.00 43.02 41.19 1ii5 s PHE 87 CO 0.01 0.05 1.28 0.95 0.70 0.00 0.00 175.22 178.20 1ii5 s THR 88 N -2.08 2.01 0.46 0.64 -4.23 -0.46 -4.92 115.64 107.05 1ii5 s THR 88 Ca 0.53 -0.03 -0.24 0.00 -1.18 0.00 0.00 61.69 60.77 1ii5 s THR 88 Cb -0.10 -2.98 -0.07 0.00 1.34 0.00 0.00 72.50 70.68 1ii5 s THR 88 CO 0.22 0.00 1.32 -1.10 -0.54 0.00 0.00 174.62 174.51 1ii5 s GLN 89 N -5.79 3.68 0.53 3.99 -1.52 -1.26 -4.63 119.66 114.67 1ii5 s GLN 89 Ca 0.71 2.16 -0.20 0.00 -1.95 0.00 0.00 55.36 56.08 1ii5 s GLN 89 Cb -0.06 -2.56 -0.05 0.00 -0.22 0.00 0.00 33.01 30.12 1ii5 s GLN 89 CO 0.52 -0.73 1.19 -1.25 -0.25 0.00 0.00 175.29 174.77 1ii5 s PRO 90 N -2.51 3.33 0.00 2.91 0.04 -1.26 -4.65 135.00 132.86 1ii5 s PRO 90 Ca 0.62 1.79 0.05 0.00 0.04 0.00 0.00 61.00 63.51 1ii5 s PRO 90 Cb -0.38 -2.13 0.01 0.00 0.04 0.00 0.00 34.50 32.05 1ii5 s PRO 90 CO 0.48 -0.91 0.53 2.48 0.04 0.00 0.00 177.00 179.62 1ii5 n TYR 91 N -1.12 0.00 -3.63 0.56 0.18 -0.20 -4.98 117.16 107.97 1ii5 n TYR 91 Ca 0.11 0.00 -0.15 0.00 1.88 0.00 0.00 57.90 59.74 1ii5 n TYR 91 Cb 0.49 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.38 1ii5 n TYR 91 CO 0.00 0.00 0.00 0.12 -2.08 0.00 0.00 176.86 174.90 1ii5 s PHE 92 N -0.77 -0.64 -0.33 -3.48 5.36 -1.24 -5.00 117.98 111.87 1ii5 s PHE 92 Ca 0.05 1.43 -0.06 0.00 -0.96 0.00 0.00 56.93 57.40 1ii5 s PHE 92 Cb 0.04 0.27 0.04 0.00 -0.34 0.00 0.00 43.02 43.03 1ii5 s PHE 92 CO 0.11 -0.41 0.09 0.45 -1.46 0.00 0.00 175.22 174.00 1ii5 s SER 93 N -0.20 5.26 0.44 6.13 0.15 -1.26 -0.50 113.70 123.73 1ii5 s SER 93 Ca -0.04 -1.14 0.07 0.00 0.70 0.00 0.00 55.95 55.54 1ii5 s SER 93 Cb -0.03 -1.85 -0.02 0.00 -1.71 0.00 0.00 66.02 62.40 1ii5 s SER 93 CO 0.04 -0.31 0.28 -0.55 1.20 0.00 0.00 173.24 173.89 1ii5 s SER 94 N 1.39 4.64 0.06 5.45 0.15 0.37 -4.95 113.70 120.82 1ii5 s SER 94 Ca -0.02 -1.03 0.04 0.00 0.70 0.00 0.00 55.95 55.64 1ii5 s SER 94 Cb -0.19 -0.29 -0.03 0.00 -1.71 0.00 0.00 66.02 63.80 1ii5 s SER 94 CO 0.02 -0.71 -0.13 -0.83 1.20 0.00 0.00 173.24 172.80 1ii5 s GLY 95 N -4.05 0.78 -0.24 9.45 0.00 -1.26 -0.49 107.32 111.50 1ii5 s GLY 95 Ca 0.41 -0.94 -0.13 0.00 0.00 0.00 0.00 44.72 44.06 1ii5 s GLY 95 CO 0.23 -0.97 0.27 -0.42 0.00 0.00 0.00 173.10 172.21 1ii5 s ILE 96 N -1.28 5.28 0.00 0.90 -1.09 -0.49 -0.19 121.20 124.33 1ii5 s ILE 96 Ca -0.04 0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.78 1ii5 s ILE 96 Cb -0.10 -3.60 0.00 0.00 -1.58 0.00 0.00 42.46 37.18 1ii5 s ILE 96 CO 0.02 0.27 0.00 0.61 -1.23 0.00 0.00 174.94 174.61 1ii5 n GLY 97 N 4.36 6.84 2.91 6.18 0.00 0.17 -0.90 105.19 124.75 1ii5 n GLY 97 Ca -0.12 -2.03 -0.16 0.00 0.00 0.00 0.00 46.02 43.71 1ii5 n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ii5 s LEU 98 N 0.00 1.72 -0.19 0.99 1.43 -1.26 -2.15 118.68 119.22 1ii5 s LEU 98 Ca 0.00 -0.07 -0.05 0.00 -1.03 0.00 0.00 54.13 52.98 1ii5 s LEU 98 Cb 0.00 -0.25 -0.03 0.00 0.03 0.00 0.00 46.19 45.94 1ii5 s LEU 98 CO 0.00 0.00 -0.00 -0.22 0.23 0.00 0.00 176.35 176.36 1ii5 s LEU 99 N 0.30 3.30 0.16 1.79 2.96 0.17 -1.32 118.68 126.04 1ii5 s LEU 99 Ca -0.03 -0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 53.71 1ii5 s LEU 99 Cb -0.06 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 1ii5 s LEU 99 CO -0.00 0.09 0.08 0.27 -1.32 0.00 0.00 176.35 175.47 1ii5 s ILE 100 N 0.83 0.12 0.53 6.68 -4.36 0.27 -1.19 121.20 124.08 1ii5 s ILE 100 Ca 0.01 -1.95 -0.20 0.00 -0.26 0.00 0.00 60.65 58.24 1ii5 s ILE 100 Cb -0.14 -2.24 -0.06 0.00 1.25 0.00 0.00 42.46 41.26 1ii5 s ILE 100 CO 0.02 -0.28 1.12 -2.84 0.24 0.00 0.00 174.94 173.20 1ii5 s PRO 101 N -4.08 3.46 0.55 0.37 0.02 -1.26 -0.35 135.00 133.72 1ii5 s PRO 101 Ca 0.30 1.60 0.26 0.00 0.02 0.00 0.00 61.00 63.18 1ii5 s PRO 101 Cb 0.07 -2.07 1.47 0.00 0.02 0.00 0.00 34.50 34.00 1ii5 s PRO 101 CO 0.06 -0.76 2.04 0.78 -0.33 0.00 0.00 177.00 178.79 1ii5 h GLY 102 N 1.35 0.00 2.00 0.52 0.00 -1.81 -1.38 103.07 103.75 1ii5 h GLY 102 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1ii5 h GLY 102 CO 0.58 0.00 0.00 -0.91 0.00 0.00 0.00 176.54 176.21 1ii5 h THR 103 N 0.00 0.00 -0.21 4.70 1.35 -1.91 -3.25 112.91 113.60 1ii5 h THR 103 Ca 0.17 -0.74 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 1ii5 h THR 103 Cb 0.75 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 1ii5 h THR 103 CO -0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1ii5 n ALA 104 N -2.07 2.50 -0.21 6.62 0.00 -0.52 -4.47 120.51 122.37 1ii5 n ALA 104 Ca 0.03 -0.57 0.15 0.00 0.00 0.00 0.00 53.44 53.04 1ii5 n ALA 104 Cb 0.42 -1.06 0.46 0.00 0.00 0.00 0.00 19.45 19.28 1ii5 n ALA 104 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1ii5 h THR 105 N 2.39 0.80 0.00 0.00 1.35 -1.66 -1.29 112.91 114.50 1ii5 h THR 105 Ca 0.00 -0.17 -0.05 0.00 -0.55 0.00 0.00 66.41 65.64 1ii5 h THR 105 Cb 0.53 0.25 -0.01 0.00 -1.73 0.00 0.00 68.15 67.19 1ii5 h THR 105 CO 0.00 0.09 -0.22 -0.65 -0.25 0.00 0.00 175.52 174.49 1ii5 h PRO 106 N 0.51 0.00 0.00 4.72 0.11 -1.89 -3.14 132.00 132.30 1ii5 h PRO 106 Ca 0.40 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.41 1ii5 h PRO 106 Cb 0.83 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 1ii5 h PRO 106 CO -0.15 0.22 -0.49 -0.07 -0.21 0.00 0.00 178.00 177.30 1ii5 h LEU 107 N 0.00 0.00 -7.52 2.35 3.38 -1.56 -3.41 115.31 108.54 1ii5 h LEU 107 Ca -0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.28 1ii5 h LEU 107 Cb 0.54 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 40.92 1ii5 h LEU 107 CO 0.03 0.49 -0.42 -0.36 0.09 0.00 0.00 178.44 178.27 1ii5 s PHE 108 N -3.12 3.36 -0.16 1.13 0.40 -1.19 -4.84 117.98 113.56 1ii5 s PHE 108 Ca 0.03 -2.82 0.05 0.00 -0.60 0.00 0.00 56.93 53.58 1ii5 s PHE 108 Cb 0.09 -3.11 -0.06 0.00 0.51 0.00 0.00 43.02 40.44 1ii5 s PHE 108 CO 0.73 -0.82 0.18 0.54 0.70 0.00 0.00 175.22 176.55 1ii5 n ARG 109 N 3.40 3.69 -3.77 0.44 1.74 -1.26 -4.83 116.66 116.06 1ii5 n ARG 109 Ca 0.07 -0.02 -0.07 0.00 -0.77 0.00 0.00 57.85 57.07 1ii5 n ARG 109 Cb 0.37 -0.86 -0.02 0.00 -1.02 0.00 0.00 32.46 30.93 1ii5 n ARG 109 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1ii5 s SER 110 N -1.83 -0.29 0.51 0.55 1.04 -1.26 -4.88 113.70 107.54 1ii5 s SER 110 Ca 0.01 -0.47 0.25 0.00 0.48 0.00 0.00 55.95 56.21 1ii5 s SER 110 Cb 0.04 0.66 1.40 0.00 0.10 0.00 0.00 66.02 68.21 1ii5 s SER 110 CO 0.21 -1.19 2.08 -0.37 0.98 0.00 0.00 173.24 174.95 1ii5 h VAL 111 N 2.00 0.70 0.00 5.02 -1.51 -1.97 -1.59 116.25 118.89 1ii5 h VAL 111 Ca -0.22 -0.47 -0.02 0.00 -1.23 0.00 0.00 66.70 64.76 1ii5 h VAL 111 Cb 1.25 1.29 -0.00 0.00 -2.13 0.00 0.00 31.29 31.70 1ii5 h VAL 111 CO 0.26 0.11 -0.10 1.23 -1.23 0.00 0.00 177.57 177.84 1ii5 h GLY 112 N 0.64 0.00 1.71 5.19 0.00 -1.95 -1.60 103.07 107.05 1ii5 h GLY 112 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ii5 h GLY 112 CO 0.02 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.78 1ii5 n ASP 113 N -3.71 0.00 0.14 0.19 10.43 -0.60 -3.23 116.55 119.77 1ii5 n ASP 113 Ca -0.02 0.11 0.01 0.00 2.57 0.00 0.00 54.79 57.46 1ii5 n ASP 113 Cb 0.21 -0.35 0.10 0.00 1.84 0.00 0.00 41.12 42.91 1ii5 n ASP 113 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 1ii5 h LEU 114 N 0.00 0.00 -9.17 0.64 3.38 -1.42 -3.43 115.31 105.32 1ii5 h LEU 114 Ca 0.00 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 57.30 1ii5 h LEU 114 Cb 0.29 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.06 1ii5 h LEU 114 CO 0.00 0.59 1.05 1.17 0.09 0.00 0.00 178.44 181.34 1ii5 n LYS 115 N -3.39 1.68 -0.27 1.13 4.81 -1.20 -1.62 118.16 119.30 1ii5 n LYS 115 Ca 0.01 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 1ii5 n LYS 115 Cb 0.70 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.34 1ii5 n LYS 115 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1ii5 n ASN 116 N 6.42 0.00 -4.76 3.14 3.02 -0.43 -4.93 115.26 117.73 1ii5 n ASN 116 Ca 0.26 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.41 1ii5 n ASN 116 Cb 0.22 -0.43 -0.05 0.00 -0.61 0.00 0.00 39.78 38.92 1ii5 n ASN 116 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1ii5 s LYS 117 N -0.07 4.68 -0.43 3.52 3.01 -0.64 -4.45 119.74 125.35 1ii5 s LYS 117 Ca 0.00 1.61 -0.28 0.00 -1.01 0.00 0.00 55.97 56.29 1ii5 s LYS 117 Cb 0.00 -3.13 -0.01 0.00 -1.01 0.00 0.00 37.83 33.68 1ii5 s LYS 117 CO 0.00 0.31 1.64 -1.21 0.51 0.00 0.00 175.35 176.60 1ii5 s GLU 118 N -1.49 3.28 -0.14 1.68 0.41 -1.26 -0.85 118.70 120.33 1ii5 s GLU 118 Ca 0.45 1.00 -0.01 0.00 -0.41 0.00 0.00 54.97 56.01 1ii5 s GLU 118 Cb -0.28 -4.17 -0.01 0.00 -1.78 0.00 0.00 34.13 27.89 1ii5 s GLU 118 CO 0.35 -1.93 -0.12 0.08 -0.49 0.00 0.00 175.26 173.15 1ii5 s VAL 119 N 6.71 3.08 -0.00 2.63 1.01 -0.68 -0.69 120.40 132.45 1ii5 s VAL 119 Ca 0.68 -0.64 -0.19 0.00 0.00 0.00 0.00 61.98 61.83 1ii5 s VAL 119 Cb -0.16 -2.31 -0.06 0.00 0.00 0.00 0.00 36.38 33.85 1ii5 s VAL 119 CO 0.30 0.51 0.53 0.00 0.00 0.00 0.00 175.10 176.44 1ii5 s ALA 120 N 0.51 3.56 0.04 5.51 0.00 -0.03 -0.77 121.76 130.58 1ii5 s ALA 120 Ca -0.08 -0.06 -0.00 0.00 0.00 0.00 0.00 51.96 51.82 1ii5 s ALA 120 Cb -0.16 -2.62 -0.03 0.00 0.00 0.00 0.00 23.12 20.31 1ii5 s ALA 120 CO 0.04 0.27 -0.03 0.14 0.00 0.00 0.00 175.76 176.17 1ii5 s VAL 121 N -0.49 0.21 -0.03 0.00 -7.23 -0.71 -1.20 120.40 110.95 1ii5 s VAL 121 Ca 0.28 -1.34 -0.19 0.00 -1.81 0.00 0.00 61.98 58.92 1ii5 s VAL 121 Cb -0.18 -0.87 -0.05 0.00 0.56 0.00 0.00 36.38 35.84 1ii5 s VAL 121 CO 0.16 -0.72 0.55 -0.69 -0.31 0.00 0.00 175.10 174.09 1ii5 s VAL 122 N -2.57 4.98 0.55 1.32 1.01 -1.26 -0.70 120.40 123.73 1ii5 s VAL 122 Ca -0.05 1.14 -0.21 0.00 0.00 0.00 0.00 61.98 62.86 1ii5 s VAL 122 Cb -0.02 -3.88 -0.06 0.00 0.00 0.00 0.00 36.38 32.42 1ii5 s VAL 122 CO -0.05 0.42 1.17 -2.11 0.00 0.00 0.00 175.10 174.53 1ii5 n ARG 123 N 2.82 1.34 -3.29 2.72 1.85 -0.06 -3.20 116.66 118.83 1ii5 n ARG 123 Ca -0.08 0.50 -0.23 0.00 -1.00 0.00 0.00 57.85 57.04 1ii5 n ARG 123 Cb 0.51 -2.35 0.05 0.00 -1.05 0.00 0.00 32.46 29.62 1ii5 n ARG 123 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1ii5 n ASP 124 N -0.74 -6.08 -4.36 2.89 -0.08 -1.26 -5.01 116.55 101.90 1ii5 n ASP 124 Ca 0.12 -0.41 -0.20 0.00 -1.51 0.00 0.00 54.79 52.79 1ii5 n ASP 124 Cb 0.45 -4.86 -0.10 0.00 2.34 0.00 0.00 41.12 38.94 1ii5 n ASP 124 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1ii5 s THR 125 N -3.23 1.89 0.58 5.18 -4.23 -1.19 -4.59 115.64 110.04 1ii5 s THR 125 Ca 0.43 -2.18 0.32 0.00 -1.18 0.00 0.00 61.69 59.08 1ii5 s THR 125 Cb -0.19 -2.05 0.36 0.00 1.34 0.00 0.00 72.50 71.96 1ii5 s THR 125 CO 0.53 -0.50 2.25 0.71 -0.54 0.00 0.00 174.62 177.08 1ii5 h THR 126 N 2.66 0.43 -0.35 3.99 1.35 -1.95 -2.22 112.91 116.83 1ii5 h THR 126 Ca -0.39 -0.08 0.04 0.00 -0.55 0.00 0.00 66.41 65.43 1ii5 h THR 126 Cb 1.22 1.05 -0.02 0.00 -1.73 0.00 0.00 68.15 68.68 1ii5 h THR 126 CO 0.59 0.02 0.23 0.00 -0.25 0.00 0.00 175.52 176.11 1ii5 h ALA 127 N 1.98 1.97 -0.42 6.62 0.00 -1.89 -1.75 119.26 125.77 1ii5 h ALA 127 Ca -0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ii5 h ALA 127 Cb 0.05 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1ii5 h ALA 127 CO 0.00 -0.03 0.26 0.28 0.00 0.00 0.00 179.25 179.77 1ii5 h VAL 128 N 0.28 1.07 -0.30 0.00 2.07 -1.65 -0.13 116.25 117.59 1ii5 h VAL 128 Ca 0.15 -0.18 -0.16 0.00 0.82 0.00 0.00 66.70 67.33 1ii5 h VAL 128 Cb 0.23 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1ii5 h VAL 128 CO -0.03 0.10 -0.44 0.44 0.02 0.00 0.00 177.57 177.66 1ii5 h ASP 129 N 0.53 0.83 -0.31 0.57 3.32 -1.51 -2.24 116.42 117.62 1ii5 h ASP 129 Ca 0.16 -0.40 -0.13 0.00 0.02 0.00 0.00 57.03 56.69 1ii5 h ASP 129 Cb -0.02 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 1ii5 h ASP 129 CO -0.06 1.15 -0.27 -0.50 -1.72 0.00 0.00 179.24 177.84 1ii5 h TRP 130 N 0.62 0.94 -0.56 4.55 4.06 -1.18 -0.11 115.95 124.27 1ii5 h TRP 130 Ca 0.04 -0.23 -0.09 0.00 2.06 0.00 0.00 58.89 60.67 1ii5 h TRP 130 Cb 1.00 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 28.92 1ii5 h TRP 130 CO 0.05 0.99 -0.01 0.00 -3.56 0.00 0.00 178.44 175.91 1ii5 h ALA 131 N 1.00 0.91 -0.35 1.49 0.00 -0.96 -0.89 119.26 120.46 1ii5 h ALA 131 Ca 0.09 -0.30 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 1ii5 h ALA 131 Cb 0.80 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1ii5 h ALA 131 CO 0.07 0.64 -0.33 -0.91 0.00 0.00 0.00 179.25 178.72 1ii5 h ASN 132 N 0.90 0.90 -0.64 0.00 2.35 -1.26 -1.64 115.58 116.19 1ii5 h ASN 132 Ca 0.16 -0.46 -0.03 0.00 -0.55 0.00 0.00 56.30 55.42 1ii5 h ASN 132 Cb 0.54 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.63 1ii5 h ASN 132 CO 0.03 1.18 0.31 0.15 -1.65 0.00 0.00 177.43 177.45 1ii5 h PHE 133 N 0.63 0.94 -0.28 1.19 3.57 -0.71 -2.03 116.94 120.25 1ii5 h PHE 133 Ca 0.06 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1ii5 h PHE 133 Cb 0.92 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.36 1ii5 h PHE 133 CO 0.07 0.69 0.00 0.66 -2.23 0.00 0.00 178.31 177.50 1ii5 n TYR 134 N -4.34 0.48 -2.90 0.41 4.02 -0.37 -4.93 117.16 109.54 1ii5 n TYR 134 Ca 0.06 -0.21 -0.22 0.00 -0.01 0.00 0.00 57.90 57.52 1ii5 n TYR 134 Cb 0.14 -0.05 0.02 0.00 -0.02 0.00 0.00 39.34 39.43 1ii5 n TYR 134 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1ii5 n GLN 135 N 0.33 -4.15 -1.84 -0.72 6.02 -0.76 -3.29 117.38 112.97 1ii5 n GLN 135 Ca 0.10 0.91 -0.29 0.00 -0.01 0.00 0.00 57.00 57.70 1ii5 n GLN 135 Cb 0.33 -5.72 0.08 0.00 1.02 0.00 0.00 30.24 25.94 1ii5 n GLN 135 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ii5 s ALA 136 N -3.13 2.62 -1.09 -1.58 0.00 -0.63 -1.32 121.76 116.63 1ii5 s ALA 136 Ca 0.24 -0.51 -0.15 0.00 0.00 0.00 0.00 51.96 51.54 1ii5 s ALA 136 Cb -0.11 -3.00 0.16 0.00 0.00 0.00 0.00 23.12 20.18 1ii5 s ALA 136 CO 0.30 -1.57 1.28 -0.51 0.00 0.00 0.00 175.76 175.26 1ii5 s ASP 137 N -4.41 6.91 0.05 0.00 -0.00 -0.03 -4.74 116.67 114.44 1ii5 s ASP 137 Ca 0.61 -2.66 -0.31 0.00 -0.00 0.00 0.00 52.55 50.20 1ii5 s ASP 137 Cb -0.12 -2.38 -0.07 0.00 -0.00 0.00 0.00 42.92 40.35 1ii5 s ASP 137 CO 0.51 -0.84 1.51 -0.69 -0.00 0.00 0.00 175.17 175.66 1ii5 s VAL 138 N 1.81 3.31 -0.32 -1.27 1.01 -1.26 -1.68 120.40 122.00 1ii5 s VAL 138 Ca 0.37 0.78 0.04 0.00 0.00 0.00 0.00 61.98 63.17 1ii5 s VAL 138 Cb -0.04 -3.50 0.09 0.00 0.00 0.00 0.00 36.38 32.93 1ii5 s VAL 138 CO -0.04 0.01 0.00 0.00 0.00 0.00 0.00 175.10 175.07 1ii5 s ARG 139 N 2.25 1.72 0.29 2.72 3.03 0.05 -4.96 118.95 124.05 1ii5 s ARG 139 Ca 0.68 -1.72 -0.29 0.00 2.03 0.00 0.00 55.73 56.44 1ii5 s ARG 139 Cb -0.36 -3.12 -0.09 0.00 -1.03 0.00 0.00 34.95 30.34 1ii5 s ARG 139 CO 0.30 -0.83 1.05 -1.21 -1.13 0.00 0.00 175.30 173.48 1ii5 s GLU 140 N 0.96 4.63 0.23 3.89 2.02 -1.26 -1.74 118.70 127.43 1ii5 s GLU 140 Ca 0.05 1.68 0.04 0.00 0.02 0.00 0.00 54.97 56.75 1ii5 s GLU 140 Cb -0.19 -3.11 -0.05 0.00 0.10 0.00 0.00 34.13 30.87 1ii5 s GLU 140 CO -0.07 0.24 -0.01 0.95 0.02 0.00 0.00 175.26 176.39 1ii5 s THR 141 N -1.25 1.08 0.02 3.63 -4.23 0.13 -4.93 115.64 110.09 1ii5 s THR 141 Ca 0.46 -2.04 0.15 0.00 -1.18 0.00 0.00 61.69 59.07 1ii5 s THR 141 Cb -0.29 -2.34 0.04 0.00 1.34 0.00 0.00 72.50 71.25 1ii5 s THR 141 CO 0.37 -0.33 1.52 0.78 -0.54 0.00 0.00 174.62 176.42 1ii5 h ASN 142 N 2.46 0.00 -5.07 3.99 2.35 -1.95 -0.13 115.58 117.24 1ii5 h ASN 142 Ca -0.38 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.40 1ii5 h ASN 142 Cb 1.22 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.53 1ii5 h ASN 142 CO 0.65 0.54 0.14 0.54 -1.65 0.00 0.00 177.43 177.65 1ii5 s ASN 143 N -6.51 -0.19 0.24 5.81 2.20 -1.26 -4.70 114.94 110.53 1ii5 s ASN 143 Ca 0.02 -0.72 -0.06 0.00 -0.94 0.00 0.00 52.86 51.16 1ii5 s ASN 143 Cb 0.09 0.70 0.26 0.00 -2.00 0.00 0.00 41.25 40.30 1ii5 s ASN 143 CO 0.74 -1.31 1.85 0.25 -2.94 0.00 0.00 177.10 175.68 1ii5 h LEU 144 N 2.06 1.05 -0.70 3.54 5.85 -1.96 -1.86 115.31 123.29 1ii5 h LEU 144 Ca -0.21 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.41 1ii5 h LEU 144 Cb 1.25 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 1ii5 h LEU 144 CO 0.27 0.88 0.46 0.74 -0.34 0.00 0.00 178.44 180.44 1ii5 h THR 145 N 1.16 1.15 -0.60 1.05 2.02 -1.98 0.16 112.91 115.88 1ii5 h THR 145 Ca 0.28 -0.32 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 1ii5 h THR 145 Cb 0.09 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 66.62 1ii5 h THR 145 CO -0.04 0.17 0.20 0.00 0.37 0.00 0.00 175.52 176.22 1ii5 h ALA 146 N 1.27 0.78 -0.65 6.16 0.00 -1.88 0.17 119.26 125.11 1ii5 h ALA 146 Ca 0.27 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1ii5 h ALA 146 Cb -0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1ii5 h ALA 146 CO -0.07 0.44 0.17 0.00 0.00 0.00 0.00 179.25 179.78 1ii5 h ALA 147 N 1.06 0.86 -0.03 0.00 0.00 -0.80 -1.98 119.26 118.38 1ii5 h ALA 147 Ca 0.19 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 1ii5 h ALA 147 Cb 0.27 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1ii5 h ALA 147 CO -0.01 0.57 -0.70 0.82 0.00 0.00 0.00 179.25 179.93 1ii5 h ILE 148 N 0.97 1.45 -0.02 0.00 2.04 -0.72 -2.68 117.51 118.56 1ii5 h ILE 148 Ca 0.21 -2.28 -0.07 0.00 1.00 0.00 0.00 64.86 63.72 1ii5 h ILE 148 Cb 0.35 2.22 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 1ii5 h ILE 148 CO -0.00 0.66 -0.33 0.74 0.00 0.00 0.00 178.15 179.23 1ii5 h THR 149 N 0.09 1.24 0.00 -0.27 2.02 -0.42 0.56 112.91 116.14 1ii5 h THR 149 Ca -0.02 -1.15 -0.08 0.00 0.77 0.00 0.00 66.41 65.93 1ii5 h THR 149 Cb 1.25 1.59 -0.01 0.00 -1.74 0.00 0.00 68.15 69.24 1ii5 h THR 149 CO 0.10 0.33 -0.40 0.25 0.37 0.00 0.00 175.52 176.17 1ii5 h LEU 150 N 0.03 0.00 0.18 2.58 5.85 -1.12 -1.78 115.31 121.06 1ii5 h LEU 150 Ca 0.00 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.42 1ii5 h LEU 150 Cb 0.59 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.64 1ii5 h LEU 150 CO 0.04 0.40 -1.38 0.25 -0.34 0.00 0.00 178.44 177.42 1ii5 h LEU 151 N 0.00 0.60 -1.19 2.25 5.85 -0.92 -2.91 115.31 118.98 1ii5 h LEU 151 Ca -0.00 -0.66 -0.08 0.00 0.84 0.00 0.00 57.88 57.97 1ii5 h LEU 151 Cb 1.00 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1ii5 h LEU 151 CO 0.05 1.52 -0.32 1.56 -0.34 0.00 0.00 178.44 180.91 1ii5 h GLN 152 N 0.11 0.14 0.00 1.25 4.20 -0.76 -3.38 115.11 116.66 1ii5 h GLN 152 Ca -0.20 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.46 1ii5 h GLN 152 Cb 2.06 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.83 1ii5 h GLN 152 CO 0.23 0.45 0.00 1.63 -0.67 0.00 0.00 178.83 180.47 1ii5 n LYS 153 N -4.12 0.00 0.00 1.46 5.02 -0.68 -5.05 118.16 114.79 1ii5 n LYS 153 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1ii5 n LYS 153 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.40 1ii5 n LYS 153 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1ii5 n LYS 154 N 0.00 0.00 -0.23 1.97 4.01 -1.15 -4.93 118.16 117.83 1ii5 n LYS 154 Ca 0.00 -0.04 0.13 0.00 -0.51 0.00 0.00 58.31 57.90 1ii5 n LYS 154 Cb 0.00 -0.07 0.43 0.00 -0.51 0.00 0.00 35.03 34.87 1ii5 n LYS 154 CO 0.00 0.00 0.00 1.96 -1.11 0.00 0.00 177.40 178.25 1ii5 h GLN 155 N 0.00 0.57 -6.10 1.97 1.08 -1.85 -3.42 115.11 107.36 1ii5 h GLN 155 Ca 0.00 -0.03 -0.58 0.00 -1.45 0.00 0.00 58.65 56.59 1ii5 h GLN 155 Cb 0.75 -0.13 -0.15 0.00 -0.05 0.00 0.00 27.48 27.90 1ii5 h GLN 155 CO 0.00 0.38 -0.76 0.14 -0.95 0.00 0.00 178.83 177.64 1ii5 s VAL 156 N -5.58 2.30 -0.86 -0.54 -7.23 -1.20 -4.90 120.40 102.38 1ii5 s VAL 156 Ca -0.09 -2.33 0.19 0.00 -1.81 0.00 0.00 61.98 57.94 1ii5 s VAL 156 Cb 0.22 -2.22 -0.21 0.00 0.56 0.00 0.00 36.38 34.73 1ii5 s VAL 156 CO 0.78 -0.42 0.79 -0.62 -0.31 0.00 0.00 175.10 175.33 1ii5 n GLU 157 N -0.47 0.71 -3.54 4.82 1.02 0.13 -4.67 120.64 118.64 1ii5 n GLU 157 Ca -0.06 -0.01 -0.08 0.00 -0.02 0.00 0.00 57.16 56.99 1ii5 n GLU 157 Cb 0.60 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.60 1ii5 n GLU 157 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ii5 s ALA 158 N -2.82 -1.77 -0.12 0.62 0.00 -1.18 -4.56 121.76 111.94 1ii5 s ALA 158 Ca 0.07 0.81 0.02 0.00 0.00 0.00 0.00 51.96 52.86 1ii5 s ALA 158 Cb 0.14 0.50 0.01 0.00 0.00 0.00 0.00 23.12 23.78 1ii5 s ALA 158 CO 0.78 -0.75 -0.16 0.08 0.00 0.00 0.00 175.76 175.70 1ii5 s VAL 159 N -3.22 1.61 -0.24 0.00 1.01 -0.33 -0.85 120.40 118.38 1ii5 s VAL 159 Ca 0.06 -0.71 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 1ii5 s VAL 159 Cb -0.01 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1ii5 s VAL 159 CO -0.08 0.46 0.12 -0.32 0.00 0.00 0.00 175.10 175.28 1ii5 s MET 160 N 0.98 3.89 0.14 2.72 1.75 -0.35 -0.66 119.30 127.78 1ii5 s MET 160 Ca -0.06 -0.36 -0.25 0.00 -1.25 0.00 0.00 55.69 53.77 1ii5 s MET 160 Cb -0.15 -3.42 0.07 0.00 2.84 0.00 0.00 34.83 34.16 1ii5 s MET 160 CO -0.02 -0.02 0.92 0.12 -0.65 0.00 0.00 175.02 175.38 1ii5 s PHE 161 N 1.22 -0.17 0.06 4.11 5.36 -0.91 -4.48 117.98 123.16 1ii5 s PHE 161 Ca 0.06 -0.12 -0.36 0.00 -0.96 0.00 0.00 56.93 55.55 1ii5 s PHE 161 Cb -0.14 0.63 -0.15 0.00 -0.34 0.00 0.00 43.02 43.01 1ii5 s PHE 161 CO 0.05 -0.82 1.50 -0.25 -1.46 0.00 0.00 175.22 174.24 1ii5 n ASP 162 N -0.44 2.32 -0.22 6.13 10.43 -1.26 -0.66 116.55 132.86 1ii5 n ASP 162 Ca -0.07 1.09 0.02 0.00 2.57 0.00 0.00 54.79 58.40 1ii5 n ASP 162 Cb 0.61 -1.28 0.13 0.00 1.84 0.00 0.00 41.12 42.42 1ii5 n ASP 162 CO 0.00 0.00 0.00 -0.09 -1.07 0.00 0.00 177.20 176.04 1ii5 h ARG 163 N 5.61 0.39 -0.79 -1.24 2.43 -0.88 -2.33 114.38 117.57 1ii5 h ARG 163 Ca -0.47 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 58.67 1ii5 h ARG 163 Cb 1.30 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.73 1ii5 h ARG 163 CO 0.84 0.26 0.46 -1.35 -1.51 0.00 0.00 179.97 178.67 1ii5 h PRO 164 N 0.40 1.08 -0.43 0.20 0.11 -1.90 -0.50 132.00 130.96 1ii5 h PRO 164 Ca 0.34 -0.10 -0.12 0.00 0.11 0.00 0.00 66.00 66.23 1ii5 h PRO 164 Cb 0.46 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 1ii5 h PRO 164 CO -0.35 0.77 -0.20 0.00 -0.21 0.00 0.00 178.00 178.01 1ii5 h ALA 165 N 1.41 0.84 -0.35 -0.75 0.00 -1.62 -0.69 119.26 118.10 1ii5 h ALA 165 Ca 0.28 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1ii5 h ALA 165 Cb -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1ii5 h ALA 165 CO -0.05 0.64 -0.04 -0.07 0.00 0.00 0.00 179.25 179.73 1ii5 h LEU 166 N 0.74 0.65 -0.54 0.00 3.38 -0.90 -1.65 115.31 116.99 1ii5 h LEU 166 Ca 0.10 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 1ii5 h LEU 166 Cb 0.73 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1ii5 h LEU 166 CO 0.06 0.83 0.17 0.40 0.09 0.00 0.00 178.44 179.99 1ii5 h ILE 167 N 0.45 1.23 -0.74 1.22 2.04 -1.01 -1.69 117.51 119.01 1ii5 h ILE 167 Ca 0.09 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.17 1ii5 h ILE 167 Cb 0.53 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 1ii5 h ILE 167 CO 0.03 0.29 0.47 0.22 0.00 0.00 0.00 178.15 179.16 1ii5 h TYR 168 N 0.74 0.96 0.14 1.37 3.20 -1.02 -1.82 116.97 120.55 1ii5 h TYR 168 Ca 0.17 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 1ii5 h TYR 168 Cb 0.28 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.23 1ii5 h TYR 168 CO 0.02 0.63 -0.07 -0.92 -1.64 0.00 0.00 178.16 176.18 1ii5 h TYR 169 N 1.01 -0.17 -0.65 -3.82 3.20 -0.95 -2.23 116.97 113.37 1ii5 h TYR 169 Ca 0.27 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.21 1ii5 h TYR 169 Cb -0.07 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.22 1ii5 h TYR 169 CO -0.01 -0.10 0.43 1.79 -1.64 0.00 0.00 178.16 178.63 1ii5 h THR 170 N -0.20 0.96 0.00 1.81 1.35 -1.07 -0.70 112.91 115.07 1ii5 h THR 170 Ca -0.02 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 1ii5 h THR 170 Cb 0.15 0.34 0.00 0.00 -1.73 0.00 0.00 68.15 66.91 1ii5 h THR 170 CO 0.03 0.10 0.00 0.03 -0.25 0.00 0.00 175.52 175.44 1ii5 h ARG 171 N 0.57 0.00 0.00 4.72 3.08 -0.74 -1.92 114.38 120.09 1ii5 h ARG 171 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1ii5 h ARG 171 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1ii5 h ARG 171 CO -0.09 0.00 -0.78 1.04 -1.07 0.00 0.00 179.97 179.07 1ii5 n GLN 172 N -2.82 0.06 -3.17 0.04 1.13 -0.31 -4.52 117.38 107.80 1ii5 n GLN 172 Ca 0.01 -0.00 -0.20 0.00 -1.94 0.00 0.00 57.00 54.87 1ii5 n GLN 172 Cb 0.29 -1.52 -0.04 0.00 0.11 0.00 0.00 30.24 29.09 1ii5 n GLN 172 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1ii5 n ASN 173 N -1.60 1.13 0.28 1.08 3.02 -0.75 -4.93 115.26 113.48 1ii5 n ASN 173 Ca 0.04 -3.04 0.12 0.00 -0.03 0.00 0.00 54.58 51.68 1ii5 n ASN 173 Cb 0.36 -0.62 0.79 0.00 -0.61 0.00 0.00 39.78 39.70 1ii5 n ASN 173 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1ii5 h PRO 174 N 3.15 0.00 -0.21 3.52 0.11 -1.71 -2.12 132.00 134.75 1ii5 h PRO 174 Ca 0.10 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 1ii5 h PRO 174 Cb 0.91 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 1ii5 h PRO 174 CO 0.53 0.03 0.08 -2.95 -0.21 0.00 0.00 178.00 175.48 1ii5 h ASN 175 N 0.00 0.25 0.26 -2.05 -1.07 -1.91 -3.12 115.58 107.93 1ii5 h ASN 175 Ca -0.00 -0.02 -0.04 0.00 0.07 0.00 0.00 56.30 56.31 1ii5 h ASN 175 Cb 0.06 -0.06 -0.01 0.00 -2.07 0.00 0.00 38.32 36.24 1ii5 h ASN 175 CO 0.00 0.23 -0.21 -0.07 0.07 0.00 0.00 177.43 177.45 1ii5 h LEU 176 N 0.29 0.00 0.19 6.14 3.38 -1.75 -3.47 115.31 120.08 1ii5 h LEU 176 Ca 0.07 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.79 1ii5 h LEU 176 Cb 0.06 0.00 0.05 0.00 0.09 0.00 0.00 40.66 40.85 1ii5 h LEU 176 CO -0.01 0.21 -0.38 -3.20 0.09 0.00 0.00 178.44 175.15 1ii5 n ASN 177 N -4.14 -4.42 -4.92 -0.43 4.05 -1.18 -4.96 115.26 99.26 1ii5 n ASN 177 Ca -0.02 -0.20 -0.30 0.00 0.45 0.00 0.00 54.58 54.51 1ii5 n ASN 177 Cb 0.28 -3.25 -0.04 0.00 1.23 0.00 0.00 39.78 38.00 1ii5 n ASN 177 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1ii5 s LEU 178 N -4.38 4.30 0.01 1.20 1.43 -1.26 -2.43 118.68 117.54 1ii5 s LEU 178 Ca 0.22 0.39 0.04 0.00 -1.03 0.00 0.00 54.13 53.74 1ii5 s LEU 178 Cb -0.09 -3.11 -0.01 0.00 0.03 0.00 0.00 46.19 43.00 1ii5 s LEU 178 CO 0.27 0.07 -0.12 -1.61 0.23 0.00 0.00 176.35 175.19 1ii5 s GLU 179 N -2.83 0.91 -0.33 1.70 8.01 0.53 -4.85 118.70 121.84 1ii5 s GLU 179 Ca 0.38 -0.53 -0.16 0.00 0.01 0.00 0.00 54.97 54.66 1ii5 s GLU 179 Cb -0.12 -0.88 -0.01 0.00 -4.31 0.00 0.00 34.13 28.80 1ii5 s GLU 179 CO 0.27 0.23 0.41 0.08 0.01 0.00 0.00 175.26 176.26 1ii5 s VAL 180 N -0.50 5.13 1.09 2.63 1.01 -1.26 -0.56 120.40 127.93 1ii5 s VAL 180 Ca 0.03 0.22 -0.12 0.00 0.00 0.00 0.00 61.98 62.11 1ii5 s VAL 180 Cb -0.06 -3.84 0.24 0.00 0.00 0.00 0.00 36.38 32.73 1ii5 s VAL 180 CO 0.00 -0.08 1.06 0.42 0.00 0.00 0.00 175.10 176.50 1ii5 s THR 181 N 2.13 2.09 -1.15 3.92 -4.23 -0.43 -4.92 115.64 113.05 1ii5 s THR 181 Ca 0.14 0.03 0.29 0.00 -1.18 0.00 0.00 61.69 60.97 1ii5 s THR 181 Cb -0.16 -2.17 0.28 0.00 1.34 0.00 0.00 72.50 71.78 1ii5 s THR 181 CO 0.12 -0.04 1.86 -1.84 -0.54 0.00 0.00 174.62 174.18 1ii5 n GLU 182 N -4.65 0.16 -1.98 3.99 0.00 -1.26 -4.74 120.64 112.15 1ii5 n GLU 182 Ca 0.05 -0.03 -0.42 0.00 0.00 0.00 0.00 57.16 56.76 1ii5 n GLU 182 Cb 0.54 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.45 1ii5 n GLU 182 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1ii5 s ILE 183 N -2.86 2.78 -0.37 3.84 1.01 -1.26 -4.99 121.20 119.35 1ii5 s ILE 183 Ca 0.18 0.54 -0.01 0.00 0.00 0.00 0.00 60.65 61.36 1ii5 s ILE 183 Cb 0.19 -3.35 0.09 0.00 0.01 0.00 0.00 42.46 39.41 1ii5 s ILE 183 CO 0.54 0.04 0.13 0.00 0.00 0.00 0.00 174.94 175.64 1ii5 s ARG 184 N 1.25 2.01 0.45 2.79 1.04 -1.26 -4.33 118.95 120.91 1ii5 s ARG 184 Ca 0.69 -1.69 0.17 0.00 -1.04 0.00 0.00 55.73 53.86 1ii5 s ARG 184 Cb -0.42 -3.42 1.06 0.00 -2.04 0.00 0.00 34.95 30.14 1ii5 s ARG 184 CO 0.31 -0.94 1.98 0.28 -0.04 0.00 0.00 175.30 176.90 1ii5 h VAL 185 N 6.43 1.01 -2.06 4.99 2.07 -1.37 -3.46 116.25 123.86 1ii5 h VAL 185 Ca -0.13 -0.72 0.18 0.00 0.82 0.00 0.00 66.70 66.85 1ii5 h VAL 185 Cb 1.05 1.40 -0.13 0.00 -1.52 0.00 0.00 31.29 32.09 1ii5 h VAL 185 CO 0.63 0.20 0.59 -0.55 0.02 0.00 0.00 177.57 178.45 1ii5 s SER 186 N -6.78 -0.23 -0.15 0.57 0.15 -1.24 -4.97 113.70 101.06 1ii5 s SER 186 Ca -0.03 -0.15 0.02 0.00 0.70 0.00 0.00 55.95 56.49 1ii5 s SER 186 Cb 0.15 0.35 0.01 0.00 -1.71 0.00 0.00 66.02 64.82 1ii5 s SER 186 CO 0.67 -0.61 -0.21 -0.76 1.20 0.00 0.00 173.24 173.54 1ii5 s LEU 187 N -2.66 2.09 -0.01 3.45 1.02 -1.26 -1.40 118.68 119.91 1ii5 s LEU 187 Ca 0.09 -0.61 0.02 0.00 0.02 0.00 0.00 54.13 53.65 1ii5 s LEU 187 Cb -0.00 -1.44 0.00 0.00 0.02 0.00 0.00 46.19 44.77 1ii5 s LEU 187 CO -0.04 0.05 -0.06 -1.61 0.02 0.00 0.00 176.35 174.71 1ii5 s GLU 188 N 0.98 0.60 0.27 1.70 2.02 0.35 -4.99 118.70 119.63 1ii5 s GLU 188 Ca -0.03 -0.22 -0.16 0.00 0.02 0.00 0.00 54.97 54.58 1ii5 s GLU 188 Cb -0.15 -0.59 -0.08 0.00 0.10 0.00 0.00 34.13 33.41 1ii5 s GLU 188 CO -0.05 0.10 0.71 -1.25 0.02 0.00 0.00 175.26 174.79 1ii5 s PRO 189 N 0.05 4.09 -0.11 0.39 0.04 -1.26 -0.48 135.00 137.72 1ii5 s PRO 189 Ca -0.00 0.72 -0.05 0.00 0.04 0.00 0.00 61.00 61.71 1ii5 s PRO 189 Cb -0.05 -2.65 -0.04 0.00 0.04 0.00 0.00 34.50 31.81 1ii5 s PRO 189 CO -0.00 0.28 0.07 0.71 0.04 0.00 0.00 177.00 178.09 1ii5 s TYR 190 N -1.77 3.36 0.29 0.56 4.12 0.34 -1.06 117.35 123.19 1ii5 s TYR 190 Ca 0.48 0.33 -0.02 0.00 0.02 0.00 0.00 57.07 57.88 1ii5 s TYR 190 Cb -0.13 -1.88 -0.02 0.00 -1.52 0.00 0.00 41.96 38.41 1ii5 s TYR 190 CO 0.19 0.55 0.35 0.20 0.02 0.00 0.00 175.55 176.86 1ii5 s GLY 191 N -0.81 1.50 0.26 0.71 0.00 -0.24 -1.03 107.32 107.71 1ii5 s GLY 191 Ca 0.13 -1.58 0.07 0.00 0.00 0.00 0.00 44.72 43.34 1ii5 s GLY 191 CO 0.03 -1.14 0.26 -1.36 0.00 0.00 0.00 173.10 170.89 1ii5 s PHE 192 N -3.58 3.16 -0.14 1.90 2.99 -1.26 -3.92 117.98 117.13 1ii5 s PHE 192 Ca 0.34 -0.12 0.00 0.00 0.00 0.00 0.00 56.93 57.15 1ii5 s PHE 192 Cb 0.02 -1.52 -0.01 0.00 0.00 0.00 0.00 43.02 41.51 1ii5 s PHE 192 CO 0.18 0.43 -0.14 0.08 -0.00 0.00 0.00 175.22 175.77 1ii5 s VAL 193 N -2.12 2.90 0.38 -0.44 1.01 -0.33 -1.35 120.40 120.45 1ii5 s VAL 193 Ca 0.35 -0.70 0.08 0.00 0.00 0.00 0.00 61.98 61.70 1ii5 s VAL 193 Cb -0.08 -2.22 -0.07 0.00 0.00 0.00 0.00 36.38 34.01 1ii5 s VAL 193 CO 0.26 0.52 -0.02 -0.76 0.00 0.00 0.00 175.10 175.10 1ii5 s LEU 194 N 0.53 2.84 0.35 3.92 1.43 -0.22 -1.05 118.68 126.48 1ii5 s LEU 194 Ca -0.09 -1.27 -0.27 0.00 -1.03 0.00 0.00 54.13 51.47 1ii5 s LEU 194 Cb -0.16 -0.98 -0.09 0.00 0.03 0.00 0.00 46.19 44.99 1ii5 s LEU 194 CO 0.04 -0.35 1.13 -0.75 0.23 0.00 0.00 176.35 176.65 1ii5 s LYS 195 N -3.68 4.31 0.36 1.70 2.47 -1.26 -1.23 119.74 122.40 1ii5 s LYS 195 Ca 0.34 1.78 -0.28 0.00 -1.56 0.00 0.00 55.97 56.25 1ii5 s LYS 195 Cb 0.06 -2.85 -0.12 0.00 -1.46 0.00 0.00 37.83 33.47 1ii5 s LYS 195 CO 0.18 -0.08 1.42 -1.91 0.16 0.00 0.00 175.35 175.12 1ii5 n GLU 196 N 0.48 2.48 -2.33 4.03 2.13 -0.13 -1.98 120.64 125.33 1ii5 n GLU 196 Ca 0.02 0.87 -0.21 0.00 0.66 0.00 0.00 57.16 58.50 1ii5 n GLU 196 Cb 0.46 -2.55 -0.02 0.00 0.27 0.00 0.00 31.44 29.60 1ii5 n GLU 196 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1ii5 n ASN 197 N 0.65 -5.91 -4.75 4.31 3.02 -1.26 -4.93 115.26 106.39 1ii5 n ASN 197 Ca 0.03 0.02 -0.41 0.00 -0.03 0.00 0.00 54.58 54.19 1ii5 n ASN 197 Cb 0.38 -4.94 -0.02 0.00 -0.61 0.00 0.00 39.78 34.58 1ii5 n ASN 197 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ii5 s SER 198 N -2.11 6.70 0.00 6.41 0.15 -0.84 -4.89 113.70 119.12 1ii5 s SER 198 Ca 0.00 2.65 0.13 0.00 0.70 0.00 0.00 55.95 59.43 1ii5 s SER 198 Cb 0.00 -2.63 0.68 0.00 -1.71 0.00 0.00 66.02 62.36 1ii5 s SER 198 CO 0.00 -0.65 1.33 -0.81 1.20 0.00 0.00 173.24 174.31 1ii5 n PRO 199 N 2.01 0.21 0.03 5.44 -0.04 -1.26 -2.10 135.00 139.30 1ii5 n PRO 199 Ca 0.05 0.14 0.11 0.00 -0.04 0.00 0.00 63.50 63.77 1ii5 n PRO 199 Cb 0.41 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.27 1ii5 n PRO 199 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1ii5 n LEU 200 N -1.26 0.37 -0.21 1.53 4.77 -1.26 -4.65 117.00 116.29 1ii5 n LEU 200 Ca 0.07 0.08 -0.06 0.00 -0.03 0.00 0.00 56.01 56.07 1ii5 n LEU 200 Cb 0.10 -0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1ii5 n LEU 200 CO 0.10 -0.04 0.62 -0.61 -1.33 0.00 0.00 177.39 176.12 1ii5 h GLN 201 N 0.00 -0.17 -0.40 3.23 4.15 -1.80 -1.18 115.11 118.94 1ii5 h GLN 201 Ca 0.00 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.41 1ii5 h GLN 201 Cb 0.95 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.66 1ii5 h GLN 201 CO 0.00 -0.11 0.16 -0.22 -1.93 0.00 0.00 178.83 176.73 1ii5 h LYS 202 N -0.17 0.61 -0.46 1.69 3.64 -1.82 -0.37 116.57 119.68 1ii5 h LYS 202 Ca 0.22 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1ii5 h LYS 202 Cb 0.56 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 1ii5 h LYS 202 CO -0.69 0.58 0.28 1.15 -2.27 0.00 0.00 179.45 178.49 1ii5 h THR 203 N 0.51 1.15 -0.17 1.00 2.02 -1.79 -0.62 112.91 115.01 1ii5 h THR 203 Ca 0.13 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 1ii5 h THR 203 Cb 0.20 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1ii5 h THR 203 CO -0.01 0.15 0.05 0.40 0.37 0.00 0.00 175.52 176.48 1ii5 h ILE 204 N 0.61 1.19 -0.29 3.11 2.04 -1.06 -1.72 117.51 121.39 1ii5 h ILE 204 Ca 0.17 -0.60 0.01 0.00 1.00 0.00 0.00 64.86 65.44 1ii5 h ILE 204 Cb -0.00 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1ii5 h ILE 204 CO -0.03 0.18 0.18 0.78 0.00 0.00 0.00 178.15 179.26 1ii5 h ASN 205 N 0.10 0.30 -0.46 1.72 2.35 -0.89 -0.03 115.58 118.66 1ii5 h ASN 205 Ca 0.06 -0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1ii5 h ASN 205 Cb 0.24 -0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 1ii5 h ASN 205 CO -0.00 0.22 0.25 0.58 -1.65 0.00 0.00 177.43 176.83 1ii5 h VAL 206 N 0.37 1.00 -0.49 2.81 2.07 -1.04 -0.25 116.25 120.71 1ii5 h VAL 206 Ca 0.11 -0.17 -0.12 0.00 0.82 0.00 0.00 66.70 67.34 1ii5 h VAL 206 Cb -0.02 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1ii5 h VAL 206 CO -0.04 0.09 -0.15 -0.33 0.02 0.00 0.00 177.57 177.16 1ii5 h GLU 207 N 0.50 0.95 -0.42 1.57 4.39 -1.00 -1.05 114.58 119.52 1ii5 h GLU 207 Ca 0.19 -0.36 -0.10 0.00 0.34 0.00 0.00 59.36 59.43 1ii5 h GLU 207 Cb 0.07 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 1ii5 h GLU 207 CO -0.12 1.03 -0.15 0.52 -1.16 0.00 0.00 179.01 179.13 1ii5 h MET 208 N 0.84 0.79 -0.41 2.33 2.86 -0.72 -1.55 114.93 119.07 1ii5 h MET 208 Ca 0.13 -0.28 -0.11 0.00 -2.06 0.00 0.00 59.70 57.38 1ii5 h MET 208 Cb 0.70 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.29 1ii5 h MET 208 CO 0.05 0.89 -0.17 -0.07 1.06 0.00 0.00 176.91 178.67 1ii5 h LEU 209 N 0.70 0.77 -0.26 1.22 3.38 -0.80 -0.49 115.31 119.83 1ii5 h LEU 209 Ca 0.11 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1ii5 h LEU 209 Cb 0.65 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1ii5 h LEU 209 CO 0.05 0.94 0.12 0.78 0.09 0.00 0.00 178.44 180.42 1ii5 h ASN 210 N 0.68 0.35 -0.70 -0.43 2.35 -0.87 -0.09 115.58 116.87 1ii5 h ASN 210 Ca 0.10 -0.14 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 1ii5 h ASN 210 Cb 0.67 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.92 1ii5 h ASN 210 CO 0.05 0.39 0.36 -0.07 -1.65 0.00 0.00 177.43 176.50 1ii5 h LEU 211 N 0.28 0.90 0.46 1.61 3.38 -1.06 -1.15 115.31 119.73 1ii5 h LEU 211 Ca 0.09 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1ii5 h LEU 211 Cb 0.14 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1ii5 h LEU 211 CO -0.01 0.75 -0.22 0.25 0.09 0.00 0.00 178.44 179.30 1ii5 h LEU 212 N 1.00 -0.52 -1.55 1.67 5.85 -0.72 -0.61 115.31 120.43 1ii5 h LEU 212 Ca 0.25 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 1ii5 h LEU 212 Cb 0.07 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1ii5 h LEU 212 CO -0.04 -0.15 -0.24 1.88 -0.34 0.00 0.00 178.44 179.56 1ii5 h TYR 213 N -0.95 0.00 -0.03 1.25 -1.99 -0.99 -2.05 116.97 112.21 1ii5 h TYR 213 Ca -0.06 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.67 1ii5 h TYR 213 Cb 0.58 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.31 1ii5 h TYR 213 CO 0.01 0.24 0.00 -1.13 -0.00 0.00 0.00 178.16 177.28 1ii5 n SER 214 N -4.10 0.56 -0.37 3.88 3.41 -0.44 -4.89 113.62 111.68 1ii5 n SER 214 Ca -0.02 -1.35 -0.05 0.00 -0.26 0.00 0.00 58.87 57.19 1ii5 n SER 214 Cb 0.30 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.21 1ii5 n SER 214 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1ii5 n ARG 215 N -0.49 -0.98 -0.17 4.33 0.00 -0.77 -4.90 116.66 113.68 1ii5 n ARG 215 Ca 0.18 0.54 -0.09 0.00 -0.00 0.00 0.00 57.85 58.48 1ii5 n ARG 215 Cb 0.18 -4.43 0.04 0.00 -0.00 0.00 0.00 32.46 28.25 1ii5 n ARG 215 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1ii5 h VAL 216 N 0.00 1.27 -0.48 8.89 2.07 -1.33 -1.97 116.25 124.70 1ii5 h VAL 216 Ca -0.10 -1.24 -0.06 0.00 0.82 0.00 0.00 66.70 66.12 1ii5 h VAL 216 Cb 0.63 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1ii5 h VAL 216 CO 0.14 0.44 0.05 0.40 0.02 0.00 0.00 177.57 178.62 1ii5 h ILE 217 N 0.88 1.23 -0.64 4.57 2.04 -1.75 -1.41 117.51 122.43 1ii5 h ILE 217 Ca 0.14 -0.89 -0.05 0.00 1.00 0.00 0.00 64.86 65.06 1ii5 h ILE 217 Cb 0.65 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 1ii5 h ILE 217 CO 0.04 0.32 0.19 0.00 0.00 0.00 0.00 178.15 178.70 1ii5 h ALA 218 N 1.33 1.12 -0.61 1.87 0.00 -1.76 -1.13 119.26 120.08 1ii5 h ALA 218 Ca 0.15 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1ii5 h ALA 218 Cb 0.37 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1ii5 h ALA 218 CO 0.01 0.60 0.13 1.05 0.00 0.00 0.00 179.25 181.04 1ii5 h GLU 219 N 0.95 0.99 -0.25 0.00 9.09 -0.60 -0.07 114.58 124.70 1ii5 h GLU 219 Ca 0.21 -0.25 -0.00 0.00 0.05 0.00 0.00 59.36 59.37 1ii5 h GLU 219 Cb 0.29 -0.12 -0.01 0.00 -1.65 0.00 0.00 28.75 27.25 1ii5 h GLU 219 CO -0.01 0.91 0.15 0.74 0.05 0.00 0.00 179.01 180.86 1ii5 h PHE 220 N 0.90 0.32 -0.54 2.06 0.05 -0.75 -1.57 116.94 117.41 1ii5 h PHE 220 Ca 0.19 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.96 1ii5 h PHE 220 Cb 0.38 -0.11 -0.02 0.00 2.00 0.00 0.00 35.95 38.20 1ii5 h PHE 220 CO 0.03 0.24 0.27 1.15 -0.18 0.00 0.00 178.31 179.82 1ii5 h THR 221 N 0.31 1.19 -0.24 -1.55 2.02 -0.99 -2.49 112.91 111.17 1ii5 h THR 221 Ca 0.09 -0.52 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 1ii5 h THR 221 Cb 0.01 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1ii5 h THR 221 CO -0.02 0.21 0.07 -0.33 0.37 0.00 0.00 175.52 175.82 1ii5 h GLU 222 N 0.72 0.33 -0.01 6.66 3.07 -0.77 0.13 114.58 124.71 1ii5 h GLU 222 Ca 0.19 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.36 58.94 1ii5 h GLU 222 Cb 0.09 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.92 1ii5 h GLU 222 CO -0.03 0.31 -0.31 0.07 -1.40 0.00 0.00 179.01 177.65 1ii5 h ARG 223 N 0.34 0.03 0.00 2.33 0.11 -0.82 0.74 114.38 117.10 1ii5 h ARG 223 Ca 0.08 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.15 1ii5 h ARG 223 Cb 0.12 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.20 1ii5 h ARG 223 CO -0.00 0.33 -1.47 0.91 0.10 0.00 0.00 179.97 179.84 1ii5 n TRP 224 N -4.16 0.00 -1.15 4.08 7.02 -0.73 -4.72 117.44 117.77 1ii5 n TRP 224 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 1ii5 n TRP 224 Cb 0.36 -0.27 0.00 0.00 -2.42 0.00 0.00 31.31 28.98 1ii5 n TRP 224 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1ii5 n LEU 225 N -1.88 0.00 -0.10 -0.99 7.94 0.37 -4.96 117.00 117.39 1ii5 n LEU 225 Ca -0.01 -0.09 0.16 0.00 -1.11 0.00 0.00 56.01 54.95 1ii5 n LEU 225 Cb 0.40 0.00 0.86 0.00 0.53 0.00 0.00 43.42 45.21 1ii5 n LEU 225 CO 0.37 0.07 1.06 0.61 -1.11 0.00 0.00 177.39 178.39