#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2or2 n SER 2 N 0.00 0.10 -4.01 0.00 7.64 -1.26 -4.40 113.62 111.69 2or2 n SER 2 Ca 0.00 -2.18 -0.23 0.00 1.01 0.00 0.00 58.87 57.47 2or2 n SER 2 Cb 0.00 0.09 -0.16 0.00 -1.01 0.00 0.00 64.21 63.13 2or2 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2or2 s SER 3 N -2.50 1.55 0.60 6.43 0.15 -1.26 -5.00 113.70 113.67 2or2 s SER 3 Ca 0.19 -0.25 0.40 0.00 0.70 0.00 0.00 55.95 56.99 2or2 s SER 3 Cb 0.39 -0.62 2.10 0.00 -1.71 0.00 0.00 66.02 66.18 2or2 s SER 3 CO -0.07 0.04 2.22 0.58 1.20 0.00 0.00 173.24 177.21 2or2 h VAL 4 N 5.77 0.00 0.00 4.45 2.07 -1.94 0.86 116.25 127.47 2or2 h VAL 4 Ca -0.33 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 2or2 h VAL 4 Cb 1.18 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 2or2 h VAL 4 CO 0.48 0.00 -0.17 -1.13 0.02 0.00 0.00 177.57 176.77 2or2 h ASN 5 N 0.00 0.00 0.80 0.57 -0.73 -2.01 -2.32 115.58 111.89 2or2 h ASN 5 Ca 0.00 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.16 2or2 h ASN 5 Cb 0.08 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.67 2or2 h ASN 5 CO 0.00 0.17 -0.05 -0.33 -0.37 0.00 0.00 177.43 176.86 2or2 h GLU 6 N 0.00 0.00 0.00 6.67 5.08 -1.23 -2.04 114.58 123.06 2or2 h GLU 6 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2or2 h GLU 6 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2or2 h GLU 6 CO 0.02 0.05 0.00 -0.07 -1.00 0.00 0.00 179.01 178.01 2or2 h LEU 7 N 0.00 0.00 -0.09 1.33 3.38 -1.55 -2.29 115.31 116.09 2or2 h LEU 7 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2or2 h LEU 7 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2or2 h LEU 7 CO 0.01 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.92 2or2 n GLU 8 N -2.68 0.13 -2.91 1.13 -0.58 -0.77 -4.43 120.64 110.53 2or2 n GLU 8 Ca 0.01 0.17 -0.44 0.00 -0.42 0.00 0.00 57.16 56.48 2or2 n GLU 8 Cb 0.22 -1.67 -0.03 0.00 -0.57 0.00 0.00 31.44 29.39 2or2 n GLU 8 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 2or2 s ASN 9 N -3.75 6.36 0.64 1.62 3.84 -0.86 -4.89 114.94 117.90 2or2 s ASN 9 Ca 0.11 -1.47 0.38 0.00 0.21 0.00 0.00 52.86 52.09 2or2 s ASN 9 Cb 0.14 -2.40 2.06 0.00 -0.55 0.00 0.00 41.25 40.50 2or2 s ASN 9 CO 0.50 -1.25 2.16 -0.50 -2.79 0.00 0.00 177.10 175.22 2or2 h TRP 10 N 9.23 0.00 0.00 0.43 4.06 -1.83 0.81 115.95 128.65 2or2 h TRP 10 Ca -0.11 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.84 2or2 h TRP 10 Cb 1.05 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.21 2or2 h TRP 10 CO 1.03 0.00 -0.61 0.43 -3.56 0.00 0.00 178.44 175.73 2or2 n SER 11 N -2.94 0.57 -1.61 -3.49 7.64 -1.26 -3.36 113.62 109.17 2or2 n SER 11 Ca -0.03 -0.15 0.02 0.00 1.01 0.00 0.00 58.87 59.73 2or2 n SER 11 Cb 0.18 0.30 0.01 0.00 -1.01 0.00 0.00 64.21 63.69 2or2 n SER 11 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2or2 n LYS 12 N -1.73 0.23 0.31 1.43 5.02 -0.16 -4.83 118.16 118.43 2or2 n LYS 12 Ca 0.04 -2.02 0.20 0.00 -2.02 0.00 0.00 58.31 54.51 2or2 n LYS 12 Cb 0.38 -0.11 0.98 0.00 -0.02 0.00 0.00 35.03 36.25 2or2 n LYS 12 CO 0.00 0.00 0.00 0.11 -0.52 0.00 0.00 177.40 176.99 2or2 h TRP 13 N 1.05 0.00 -0.00 2.13 5.08 -1.12 -1.86 115.95 121.23 2or2 h TRP 13 Ca -0.27 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.70 2or2 h TRP 13 Cb 1.75 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.91 2or2 h TRP 13 CO 0.16 0.01 -0.05 -1.33 -1.28 0.00 0.00 178.44 175.95 2or2 n MET 14 N -3.13 0.09 -0.04 0.12 2.81 -1.26 -4.11 117.12 111.60 2or2 n MET 14 Ca -0.02 -0.01 -0.08 0.00 -1.81 0.00 0.00 57.70 55.79 2or2 n MET 14 Cb 0.18 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.17 2or2 n MET 14 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 2or2 h GLN 15 N 0.02 -0.12 0.00 0.03 4.15 -1.55 -2.69 115.11 114.96 2or2 h GLN 15 Ca 0.00 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2or2 h GLN 15 Cb 0.46 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.18 2or2 h GLN 15 CO 0.00 -0.08 0.00 -0.35 -1.93 0.00 0.00 178.83 176.47 2or2 n PRO 16 N -5.29 0.12 -2.74 -2.39 -0.04 -1.26 -4.80 135.00 118.61 2or2 n PRO 16 Ca -0.02 0.15 -0.41 0.00 -0.04 0.00 0.00 63.50 63.19 2or2 n PRO 16 Cb 0.20 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.12 2or2 n PRO 16 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2or2 s ILE 17 N -2.80 4.65 0.30 0.52 1.01 -1.02 -4.68 121.20 119.18 2or2 s ILE 17 Ca 0.13 2.03 -0.29 0.00 0.00 0.00 0.00 60.65 62.52 2or2 s ILE 17 Cb 0.12 -4.31 -0.13 0.00 0.01 0.00 0.00 42.46 38.16 2or2 s ILE 17 CO 0.31 0.26 1.31 -2.65 0.00 0.00 0.00 174.94 174.17 2or2 n PRO 18 N 3.19 2.01 0.30 2.79 -0.02 -1.26 -4.88 135.00 137.13 2or2 n PRO 18 Ca 0.03 0.71 0.19 0.00 -2.02 0.00 0.00 63.50 62.41 2or2 n PRO 18 Cb 0.50 -2.30 0.92 0.00 -0.02 0.00 0.00 33.50 32.60 2or2 n PRO 18 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2or2 h ASP 19 N 3.15 0.00 0.48 2.55 5.19 -1.94 -2.37 116.42 123.48 2or2 h ASP 19 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 2or2 h ASP 19 Cb 1.29 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.80 2or2 h ASP 19 CO 0.67 0.03 -0.03 -0.46 -3.12 0.00 0.00 179.24 176.33 2or2 n ASN 20 N -3.21 0.13 -4.69 6.45 6.94 -1.26 -0.67 115.26 118.95 2or2 n ASN 20 Ca -0.01 -0.32 -0.42 0.00 -0.02 0.00 0.00 54.58 53.80 2or2 n ASN 20 Cb 0.19 -0.20 -0.03 0.00 -2.36 0.00 0.00 39.78 37.38 2or2 n ASN 20 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2or2 s ILE 21 N -2.51 4.34 0.36 1.53 -1.09 -0.89 -4.83 121.20 118.11 2or2 s ILE 21 Ca 0.30 1.66 -0.28 0.00 -2.23 0.00 0.00 60.65 60.10 2or2 s ILE 21 Cb 0.20 -4.07 -0.10 0.00 -1.58 0.00 0.00 42.46 36.91 2or2 s ILE 21 CO 0.46 -0.00 1.39 -2.84 -1.23 0.00 0.00 174.94 172.72 2or2 s PRO 22 N 2.21 4.17 0.38 2.79 0.02 -1.26 -1.35 135.00 141.96 2or2 s PRO 22 Ca 0.54 2.38 0.13 0.00 0.02 0.00 0.00 61.00 64.08 2or2 s PRO 22 Cb -0.23 -2.97 0.94 0.00 0.02 0.00 0.00 34.50 32.25 2or2 s PRO 22 CO 0.21 -0.41 1.84 -0.07 -0.33 0.00 0.00 177.00 178.25 2or2 h LEU 23 N 3.09 0.56 -1.67 -5.54 3.38 -1.19 -0.58 115.31 113.36 2or2 h LEU 23 Ca -0.50 0.05 0.15 0.00 0.09 0.00 0.00 57.88 57.67 2or2 h LEU 23 Cb 1.24 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.89 2or2 h LEU 23 CO 0.64 0.24 0.48 0.00 0.09 0.00 0.00 178.44 179.89 2or2 h ALA 24 N 1.61 2.19 0.00 1.53 0.00 -1.87 -1.47 119.26 121.25 2or2 h ALA 24 Ca 0.48 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 55.22 2or2 h ALA 24 Cb 0.98 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2or2 h ALA 24 CO -0.22 -0.39 -0.81 -0.09 0.00 0.00 0.00 179.25 177.74 2or2 h ARG 25 N 0.33 0.00 -6.94 0.00 9.65 -1.33 -3.42 114.38 112.68 2or2 h ARG 25 Ca 0.35 0.00 -0.52 0.00 -1.10 0.00 0.00 59.98 58.71 2or2 h ARG 25 Cb 0.88 0.00 0.06 0.00 -1.39 0.00 0.00 29.97 29.52 2or2 h ARG 25 CO -0.09 0.81 0.55 0.42 2.80 0.00 0.00 179.97 184.46 2or2 s ILE 26 N -3.02 2.94 -0.29 1.20 1.01 -0.56 -4.88 121.20 117.60 2or2 s ILE 26 Ca 0.01 0.81 -0.22 0.00 0.00 0.00 0.00 60.65 61.25 2or2 s ILE 26 Cb 0.10 -3.47 -0.00 0.00 0.01 0.00 0.00 42.46 39.10 2or2 s ILE 26 CO 0.79 0.10 0.74 -0.44 0.00 0.00 0.00 174.94 176.13 2or2 s SER 27 N -0.95 6.64 -0.06 3.58 0.01 -1.26 -4.58 113.70 117.07 2or2 s SER 27 Ca 0.56 0.67 0.03 0.00 1.31 0.00 0.00 55.95 58.52 2or2 s SER 27 Cb -0.34 -2.39 0.01 0.00 0.21 0.00 0.00 66.02 63.51 2or2 s SER 27 CO 0.43 -0.54 -0.15 -0.63 0.41 0.00 0.00 173.24 172.76 2or2 s ILE 28 N 2.81 1.29 0.35 1.44 1.01 -0.82 -4.52 121.20 122.76 2or2 s ILE 28 Ca 0.30 -0.59 -0.25 0.00 0.00 0.00 0.00 60.65 60.11 2or2 s ILE 28 Cb -0.15 -1.15 -0.10 0.00 0.01 0.00 0.00 42.46 41.07 2or2 s ILE 28 CO 0.11 0.39 0.96 -2.84 0.00 0.00 0.00 174.94 173.55 2or2 s PRO 29 N 0.48 4.49 0.15 2.79 0.02 -1.26 -1.09 135.00 140.58 2or2 s PRO 29 Ca -0.13 1.31 -0.02 0.00 0.02 0.00 0.00 61.00 62.18 2or2 s PRO 29 Cb -0.15 -2.67 -0.04 0.00 0.02 0.00 0.00 34.50 31.66 2or2 s PRO 29 CO 0.04 0.19 0.10 0.20 -0.33 0.00 0.00 177.00 177.20 2or2 s GLY 30 N -1.71 0.99 -0.08 0.52 0.00 -0.04 -1.54 107.32 105.47 2or2 s GLY 30 Ca 0.53 -1.43 0.04 0.00 0.00 0.00 0.00 44.72 43.85 2or2 s GLY 30 CO 0.22 -1.30 -0.19 -0.51 0.00 0.00 0.00 173.10 171.32 2or2 s THR 31 N -4.06 2.55 0.09 0.90 -4.23 -0.58 -1.10 115.64 109.21 2or2 s THR 31 Ca 0.25 -0.87 -0.25 0.00 -1.18 0.00 0.00 61.69 59.64 2or2 s THR 31 Cb 0.07 -1.99 -0.06 0.00 1.34 0.00 0.00 72.50 71.85 2or2 s THR 31 CO 0.03 0.56 0.76 -2.28 -0.54 0.00 0.00 174.62 173.15 2or2 s HIS 32 N -0.08 3.80 -1.35 3.99 2.46 -0.03 -2.49 115.29 121.60 2or2 s HIS 32 Ca -0.04 1.52 -0.10 0.00 0.47 0.00 0.00 55.06 56.90 2or2 s HIS 32 Cb -0.14 -2.78 0.01 0.00 -0.13 0.00 0.00 32.58 29.53 2or2 s HIS 32 CO 0.04 0.38 0.46 -0.25 -2.47 0.00 0.00 174.74 172.90 2or2 n ASP 33 N 2.32 -1.73 -0.35 9.88 8.00 -1.25 -4.76 116.55 128.67 2or2 n ASP 33 Ca -0.04 -1.11 0.24 0.00 0.71 0.00 0.00 54.79 54.58 2or2 n ASP 33 Cb 0.50 -2.59 0.49 0.00 -0.02 0.00 0.00 41.12 39.50 2or2 n ASP 33 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2or2 h SER 34 N -1.98 0.49 -0.27 -2.24 0.02 -1.60 -2.78 113.55 105.18 2or2 h SER 34 Ca -0.66 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 2or2 h SER 34 Cb 1.38 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.98 2or2 h SER 34 CO 0.59 0.01 0.00 0.61 -1.14 0.00 0.00 176.83 176.91 2or2 n GLY 35 N -1.41 1.66 0.51 -3.77 0.00 -1.26 -4.25 105.19 96.67 2or2 n GLY 35 Ca 0.29 -0.39 0.07 0.00 0.00 0.00 0.00 46.02 45.99 2or2 n GLY 35 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2or2 n THR 36 N 0.32 0.32 0.26 2.61 -2.24 -1.05 -4.40 114.28 110.10 2or2 n THR 36 Ca 0.12 -0.36 0.12 0.00 -2.27 0.00 0.00 64.05 61.67 2or2 n THR 36 Cb 0.55 0.22 0.68 0.00 -2.10 0.00 0.00 70.33 69.68 2or2 n THR 36 CO 0.00 0.00 0.00 2.19 -0.57 0.00 0.00 175.07 176.69 2or2 h PHE 37 N 1.77 0.00 0.00 4.78 -0.00 -1.74 -2.91 116.94 118.84 2or2 h PHE 37 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.97 57.91 2or2 h PHE 37 Cb 0.40 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.34 2or2 h PHE 37 CO 0.16 0.14 -0.30 0.87 -0.00 0.00 0.00 178.31 179.17 2or2 h LYS 38 N 0.00 0.00 -0.11 6.09 1.57 -1.83 -3.25 116.57 119.04 2or2 h LYS 38 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2or2 h LYS 38 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2or2 h LYS 38 CO 0.02 0.30 0.00 1.28 -0.57 0.00 0.00 179.45 180.48 2or2 n LEU 39 N -3.29 2.36 -0.10 2.94 4.77 -1.17 -4.60 117.00 117.91 2or2 n LEU 39 Ca 0.01 -1.23 -0.01 0.00 -0.03 0.00 0.00 56.01 54.75 2or2 n LEU 39 Cb 0.56 -0.06 0.24 0.00 -2.33 0.00 0.00 43.42 41.82 2or2 n LEU 39 CO 0.36 0.48 1.01 -0.61 -1.33 0.00 0.00 177.39 177.30 2or2 h GLN 40 N 2.61 0.76 -6.09 3.23 -0.00 -1.55 -3.40 115.11 110.67 2or2 h GLN 40 Ca 0.00 -0.13 -0.66 0.00 -0.00 0.00 0.00 58.65 57.86 2or2 h GLN 40 Cb 0.61 -0.12 -0.00 0.00 0.00 0.00 0.00 27.48 27.97 2or2 h GLN 40 CO 0.00 0.67 1.26 -1.71 0.00 0.00 0.00 178.83 179.04 2or2 n ASN 41 N -4.31 2.66 -0.50 -0.69 2.85 -1.26 -4.78 115.26 109.23 2or2 n ASN 41 Ca 0.04 0.65 0.43 0.00 -0.11 0.00 0.00 54.58 55.59 2or2 n ASN 41 Cb 0.20 -1.30 0.71 0.00 1.24 0.00 0.00 39.78 40.62 2or2 n ASN 41 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2or2 h PRO 42 N 10.96 0.00 0.00 1.20 0.11 -1.93 0.51 132.00 142.86 2or2 h PRO 42 Ca -0.38 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.70 2or2 h PRO 42 Cb 1.30 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 2or2 h PRO 42 CO 0.98 0.00 -0.14 0.97 -0.21 0.00 0.00 178.00 179.60 2or2 h ILE 43 N 0.00 0.69 0.00 4.15 6.09 -1.92 -0.98 117.51 125.54 2or2 h ILE 43 Ca 0.74 -0.59 0.00 0.00 -1.37 0.00 0.00 64.86 63.65 2or2 h ILE 43 Cb 3.27 1.36 0.00 0.00 0.47 0.00 0.00 36.82 41.92 2or2 h ILE 43 CO -0.01 0.14 0.00 0.11 -3.07 0.00 0.00 178.15 175.32 2or2 h LYS 44 N 0.00 0.00 -5.78 2.19 1.79 -0.24 -3.46 116.57 111.08 2or2 h LYS 44 Ca -0.00 0.00 -0.42 0.00 -2.18 0.00 0.00 60.65 58.05 2or2 h LYS 44 Cb 0.35 0.00 0.09 0.00 -1.58 0.00 0.00 32.23 31.09 2or2 h LYS 44 CO 0.02 0.00 -0.69 1.04 -1.08 0.00 0.00 179.45 178.74 2or2 n GLN 45 N -2.85 -7.09 -4.99 3.15 6.02 -0.37 -4.99 117.38 106.25 2or2 n GLN 45 Ca -0.00 0.79 -0.32 0.00 -0.01 0.00 0.00 57.00 57.45 2or2 n GLN 45 Cb 0.21 -5.79 -0.15 0.00 1.02 0.00 0.00 30.24 25.53 2or2 n GLN 45 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2or2 s VAL 46 N -3.29 2.61 0.41 5.09 1.01 -1.26 -5.13 120.40 119.83 2or2 s VAL 46 Ca 0.57 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.73 2or2 s VAL 46 Cb -0.26 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 2or2 s VAL 46 CO 0.71 0.54 0.62 0.00 0.00 0.00 0.00 175.10 176.97 2or2 s ALA 47 N 0.27 3.80 0.00 5.51 0.00 -1.26 -4.48 121.76 125.59 2or2 s ALA 47 Ca -0.13 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.76 2or2 s ALA 47 Cb -0.16 -2.07 0.00 0.00 0.00 0.00 0.00 23.12 20.88 2or2 s ALA 47 CO 0.07 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2or2 n GLY 48 N -1.95 0.78 3.79 0.00 0.00 -1.26 -5.03 105.19 101.52 2or2 n GLY 48 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2or2 n GLY 48 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2or2 s MET 49 N -0.11 3.96 0.00 1.61 1.00 -1.26 -4.98 119.30 119.53 2or2 s MET 49 Ca 0.00 1.40 0.00 0.00 0.00 0.00 0.00 55.69 57.09 2or2 s MET 49 Cb 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 34.83 32.56 2or2 s MET 49 CO 0.00 -0.30 0.23 0.25 0.00 0.00 0.00 175.02 175.20 2or2 n THR 50 N -0.61 0.00 -3.94 2.05 -2.24 -1.26 -4.76 114.28 103.52 2or2 n THR 50 Ca 0.08 -0.26 -0.13 0.00 -2.27 0.00 0.00 64.05 61.47 2or2 n THR 50 Cb 0.52 1.44 -0.14 0.00 -2.10 0.00 0.00 70.33 70.05 2or2 n THR 50 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2or2 s GLN 51 N -0.05 0.12 0.07 -0.78 -1.52 -1.26 0.28 119.66 116.51 2or2 s GLN 51 Ca 0.00 -0.10 0.20 0.00 -1.95 0.00 0.00 55.36 53.51 2or2 s GLN 51 Cb 0.00 -0.08 -0.14 0.00 -0.22 0.00 0.00 33.01 32.57 2or2 s GLN 51 CO 0.00 0.02 0.76 0.39 -0.25 0.00 0.00 175.29 176.21 2or2 n GLU 52 N 2.90 0.63 -4.52 2.91 1.02 -1.26 -3.57 120.64 118.75 2or2 n GLU 52 Ca -0.13 0.08 -0.25 0.00 -0.02 0.00 0.00 57.16 56.84 2or2 n GLU 52 Cb 0.59 -1.73 -0.10 0.00 -0.02 0.00 0.00 31.44 30.18 2or2 n GLU 52 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2or2 s TYR 53 N -3.15 2.31 1.01 -0.32 2.02 -1.26 -4.92 117.35 113.03 2or2 s TYR 53 Ca -0.04 -0.53 -0.16 0.00 -0.37 0.00 0.00 57.07 55.97 2or2 s TYR 53 Cb 0.10 -1.32 0.20 0.00 -0.40 0.00 0.00 41.96 40.54 2or2 s TYR 53 CO 0.83 0.53 1.22 0.16 -1.57 0.00 0.00 175.55 176.71 2or2 s ASP 54 N -3.57 2.71 0.20 2.29 1.47 -1.26 -4.66 116.67 113.84 2or2 s ASP 54 Ca 0.32 0.54 -0.11 0.00 1.18 0.00 0.00 52.55 54.48 2or2 s ASP 54 Cb 0.03 -0.77 0.23 0.00 -0.34 0.00 0.00 42.92 42.06 2or2 s ASP 54 CO 0.16 -3.01 1.73 -0.26 0.68 0.00 0.00 175.17 174.47 2or2 h PHE 55 N -1.82 0.29 -0.56 2.11 0.04 -1.99 -1.03 116.94 113.97 2or2 h PHE 55 Ca -0.46 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.28 2or2 h PHE 55 Cb 1.28 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 39.35 2or2 h PHE 55 CO -1.02 0.06 0.11 -0.09 -0.60 0.00 0.00 178.31 176.77 2or2 h ARG 56 N 0.33 0.88 -0.39 1.51 9.65 -1.93 0.34 114.38 124.77 2or2 h ARG 56 Ca 0.27 -0.20 -0.02 0.00 -1.10 0.00 0.00 59.98 58.94 2or2 h ARG 56 Cb 0.34 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.78 2or2 h ARG 56 CO -0.30 0.80 0.17 -0.92 2.80 0.00 0.00 179.97 182.52 2or2 h TYR 57 N 0.84 0.57 -0.38 2.20 5.03 -1.72 0.15 116.97 123.65 2or2 h TYR 57 Ca 0.18 -0.04 0.02 0.00 2.58 0.00 0.00 58.73 61.48 2or2 h TYR 57 Cb 0.34 -0.17 -0.03 0.00 1.55 0.00 0.00 36.73 38.42 2or2 h TYR 57 CO 0.02 0.50 0.20 1.96 -1.32 0.00 0.00 178.16 179.52 2or2 h GLN 58 N 0.48 0.40 -0.44 1.82 4.20 -0.70 -1.91 115.11 118.96 2or2 h GLN 58 Ca 0.13 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 2or2 h GLN 58 Cb 0.15 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 2or2 h GLN 58 CO -0.01 0.26 0.07 0.52 -0.67 0.00 0.00 178.83 179.00 2or2 h MET 59 N 0.41 0.73 0.00 1.46 2.86 -0.66 -2.03 114.93 117.70 2or2 h MET 59 Ca 0.16 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2or2 h MET 59 Cb 0.05 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.62 2or2 h MET 59 CO -0.10 0.76 0.00 -0.44 1.06 0.00 0.00 176.91 178.19 2or2 h ASP 60 N 0.59 0.00 0.17 1.22 3.32 -0.44 -1.24 116.42 120.05 2or2 h ASP 60 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2or2 h ASP 60 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2or2 h ASP 60 CO 0.01 0.00 -0.45 1.41 -1.72 0.00 0.00 179.24 178.49 2or2 n HIS 61 N -2.43 0.00 0.00 4.55 8.25 -0.74 -4.12 115.22 120.73 2or2 n HIS 61 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2or2 n HIS 61 Cb 0.15 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.17 2or2 n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2or2 n GLY 62 N 1.41 1.61 3.75 -1.41 0.00 -0.47 -4.79 105.19 105.29 2or2 n GLY 62 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2or2 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2or2 s ALA 63 N -1.81 3.58 0.00 4.61 0.00 -0.80 -4.51 121.76 122.84 2or2 s ALA 63 Ca 0.00 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.28 2or2 s ALA 63 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2or2 s ALA 63 CO 0.00 -0.73 0.00 0.54 0.00 0.00 0.00 175.76 175.57 2or2 n ARG 64 N 1.78 3.72 -4.41 0.00 5.12 -0.59 -4.26 116.66 118.02 2or2 n ARG 64 Ca 0.04 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.63 2or2 n ARG 64 Cb 0.41 -0.35 -0.13 0.00 -1.16 0.00 0.00 32.46 31.22 2or2 n ARG 64 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2or2 s ILE 65 N -0.64 3.54 -0.10 0.55 1.01 -1.07 0.36 121.20 124.85 2or2 s ILE 65 Ca 0.00 -0.47 0.03 0.00 0.00 0.00 0.00 60.65 60.20 2or2 s ILE 65 Cb 0.00 -2.55 0.01 0.00 0.01 0.00 0.00 42.46 39.93 2or2 s ILE 65 CO 0.00 0.49 -0.18 -0.36 0.00 0.00 0.00 174.94 174.88 2or2 s PHE 66 N 0.60 2.12 -0.93 3.97 0.40 -0.19 -1.52 117.98 122.43 2or2 s PHE 66 Ca -0.04 -0.90 -0.18 0.00 -0.60 0.00 0.00 56.93 55.20 2or2 s PHE 66 Cb -0.15 -1.47 0.14 0.00 0.51 0.00 0.00 43.02 42.05 2or2 s PHE 66 CO 0.03 -0.41 1.10 0.34 0.70 0.00 0.00 175.22 176.97 2or2 s ASP 67 N 0.63 6.66 -0.13 1.36 2.15 -1.04 -0.56 116.67 125.73 2or2 s ASP 67 Ca -0.14 -2.15 -0.17 0.00 0.43 0.00 0.00 52.55 50.52 2or2 s ASP 67 Cb -0.16 -2.38 -0.04 0.00 -0.30 0.00 0.00 42.92 40.04 2or2 s ASP 67 CO 0.04 -1.00 0.44 -0.63 -0.17 0.00 0.00 175.17 173.85 2or2 s ILE 68 N 2.37 5.21 -0.22 4.11 -1.09 -0.30 -2.45 121.20 128.83 2or2 s ILE 68 Ca 0.31 0.87 -0.00 0.00 -2.23 0.00 0.00 60.65 59.60 2or2 s ILE 68 Cb -0.05 -3.78 0.02 0.00 -1.58 0.00 0.00 42.46 37.07 2or2 s ILE 68 CO -0.09 0.32 -0.12 -0.13 -1.23 0.00 0.00 174.94 173.69 2or2 s ARG 69 N 0.69 2.87 0.36 2.79 1.81 -1.26 -1.97 118.95 124.24 2or2 s ARG 69 Ca 0.24 -0.93 0.09 0.00 -1.72 0.00 0.00 55.73 53.40 2or2 s ARG 69 Cb -0.15 -2.80 -0.07 0.00 -0.45 0.00 0.00 34.95 31.48 2or2 s ARG 69 CO 0.09 -0.33 -0.06 0.20 -0.68 0.00 0.00 175.30 174.53 2or2 s GLY 70 N 1.29 2.26 -0.01 -3.53 0.00 -0.43 -0.90 107.32 106.00 2or2 s GLY 70 Ca 0.01 -2.13 0.00 0.00 0.00 0.00 0.00 44.72 42.60 2or2 s GLY 70 CO -0.08 -2.04 -0.00 -1.60 0.00 0.00 0.00 173.10 169.38 2or2 s ARG 71 N -3.65 0.15 -0.02 2.90 3.52 0.56 -0.35 118.95 122.07 2or2 s ARG 71 Ca 0.33 0.02 -0.29 0.00 -0.13 0.00 0.00 55.73 55.66 2or2 s ARG 71 Cb 0.04 -0.24 -0.03 0.00 -1.56 0.00 0.00 34.95 33.16 2or2 s ARG 71 CO 0.17 -0.05 0.96 -1.17 -0.81 0.00 0.00 175.30 174.40 2or2 s LEU 72 N 0.44 4.35 0.64 -0.88 2.96 -1.26 -1.60 118.68 123.32 2or2 s LEU 72 Ca -0.04 1.59 0.05 0.00 -0.22 0.00 0.00 54.13 55.51 2or2 s LEU 72 Cb -0.06 -3.52 0.11 0.00 0.50 0.00 0.00 46.19 43.21 2or2 s LEU 72 CO -0.01 -0.27 0.88 0.42 -1.32 0.00 0.00 176.35 176.05 2or2 s THR 73 N 1.14 2.14 -2.19 3.68 -4.23 -0.42 -0.68 115.64 115.07 2or2 s THR 73 Ca 0.50 -0.82 0.23 0.00 -1.18 0.00 0.00 61.69 60.42 2or2 s THR 73 Cb -0.20 -2.31 0.57 0.00 1.34 0.00 0.00 72.50 71.89 2or2 s THR 73 CO 0.26 0.00 1.74 -0.90 -0.54 0.00 0.00 174.62 175.18 2or2 n ASP 74 N -2.51 0.88 -1.32 3.99 5.68 -1.26 -3.35 116.55 118.66 2or2 n ASP 74 Ca 0.16 -1.47 0.08 0.00 -0.50 0.00 0.00 54.79 53.05 2or2 n ASP 74 Cb 0.61 -0.04 0.32 0.00 -1.14 0.00 0.00 41.12 40.87 2or2 n ASP 74 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2or2 n ASP 75 N -0.24 4.58 -2.08 -1.12 4.64 -1.26 -4.71 116.55 116.35 2or2 n ASP 75 Ca 0.17 -2.81 -0.19 0.00 -1.38 0.00 0.00 54.79 50.59 2or2 n ASP 75 Cb 0.22 -0.57 -0.01 0.00 -1.04 0.00 0.00 41.12 39.72 2or2 n ASP 75 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 2or2 n ASN 76 N 0.23 -5.37 -4.48 1.67 3.02 -1.21 -5.00 115.26 104.12 2or2 n ASN 76 Ca 0.23 0.01 -0.23 0.00 -0.03 0.00 0.00 54.58 54.56 2or2 n ASN 76 Cb 0.96 -4.43 -0.10 0.00 -0.61 0.00 0.00 39.78 35.59 2or2 n ASN 76 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2or2 s THR 77 N -2.91 1.92 -0.16 3.41 -4.23 -1.26 -4.97 115.64 107.43 2or2 s THR 77 Ca 0.00 -2.17 0.01 0.00 -1.18 0.00 0.00 61.69 58.35 2or2 s THR 77 Cb 0.00 -2.52 0.01 0.00 1.34 0.00 0.00 72.50 71.32 2or2 s THR 77 CO 0.00 -0.27 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.01 2or2 s ILE 78 N -2.82 2.39 0.24 2.99 1.01 -1.26 -1.30 121.20 122.44 2or2 s ILE 78 Ca 0.31 -0.86 0.09 0.00 0.00 0.00 0.00 60.65 60.19 2or2 s ILE 78 Cb 0.03 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 2or2 s ILE 78 CO 0.14 0.52 -0.03 0.68 0.00 0.00 0.00 174.94 176.26 2or2 s VAL 79 N 0.96 3.39 0.07 2.92 -7.23 -0.63 -1.43 120.40 118.46 2or2 s VAL 79 Ca -0.03 -1.85 -0.23 0.00 -1.81 0.00 0.00 61.98 58.06 2or2 s VAL 79 Cb -0.15 -2.78 -0.06 0.00 0.56 0.00 0.00 36.38 33.95 2or2 s VAL 79 CO -0.04 -0.31 0.70 -0.76 -0.31 0.00 0.00 175.10 174.38 2or2 s LEU 80 N -3.46 4.49 0.25 1.32 1.43 0.33 -0.32 118.68 122.72 2or2 s LEU 80 Ca 0.30 1.40 0.02 0.00 -1.03 0.00 0.00 54.13 54.82 2or2 s LEU 80 Cb -0.07 -3.12 -0.05 0.00 0.03 0.00 0.00 46.19 42.98 2or2 s LEU 80 CO 0.19 0.13 0.05 -1.00 0.23 0.00 0.00 176.35 175.95 2or2 s HIS 81 N -0.55 1.56 -0.33 0.29 3.76 -0.07 -1.10 115.29 118.85 2or2 s HIS 81 Ca 0.34 -1.07 -0.01 0.00 -0.15 0.00 0.00 55.06 54.17 2or2 s HIS 81 Cb -0.20 -0.93 0.12 0.00 1.11 0.00 0.00 32.58 32.68 2or2 s HIS 81 CO 0.22 -0.20 0.18 -1.58 -0.85 0.00 0.00 174.74 172.50 2or2 s HIS 82 N -3.60 0.69 0.00 1.40 2.46 -0.72 -4.61 115.29 110.91 2or2 s HIS 82 Ca 0.34 -1.40 0.00 0.00 0.47 0.00 0.00 55.06 54.47 2or2 s HIS 82 Cb 0.07 -1.00 0.00 0.00 -0.13 0.00 0.00 32.58 31.52 2or2 s HIS 82 CO 0.11 -0.83 0.00 0.41 -2.47 0.00 0.00 174.74 171.96 2or2 n GLY 83 N 4.50 1.93 0.00 1.59 0.00 -1.26 -2.59 105.19 109.37 2or2 n GLY 83 Ca 0.04 -0.53 0.14 0.00 0.00 0.00 0.00 46.02 45.68 2or2 n GLY 83 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2or2 n PRO 84 N 13.11 0.11 -3.39 1.61 -0.04 -1.26 -4.56 135.00 140.58 2or2 n PRO 84 Ca 0.00 0.01 -0.37 0.00 -0.04 0.00 0.00 63.50 63.10 2or2 n PRO 84 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 2or2 n PRO 84 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2or2 s LEU 85 N -2.89 4.28 0.14 1.53 2.34 -1.07 -5.05 118.68 117.96 2or2 s LEU 85 Ca 0.17 0.73 -0.30 0.00 0.06 0.00 0.00 54.13 54.79 2or2 s LEU 85 Cb 0.19 -2.60 -0.07 0.00 -0.56 0.00 0.00 46.19 43.15 2or2 s LEU 85 CO 0.50 0.04 1.24 -0.47 -1.06 0.00 0.00 176.35 176.61 2or2 s TYR 86 N 0.49 3.38 -2.33 3.48 5.04 -1.26 -1.76 117.35 124.39 2or2 s TYR 86 Ca 0.23 1.28 0.21 0.00 -2.44 0.00 0.00 57.07 56.36 2or2 s TYR 86 Cb -0.15 -3.49 0.67 0.00 0.35 0.00 0.00 41.96 39.34 2or2 s TYR 86 CO 0.09 -1.51 1.51 1.28 -1.34 0.00 0.00 175.55 175.57 2or2 n LEU 87 N 3.14 2.04 -2.26 6.97 4.77 -0.26 -4.93 117.00 126.48 2or2 n LEU 87 Ca 0.07 -0.86 -0.19 0.00 -0.03 0.00 0.00 56.01 55.00 2or2 n LEU 87 Cb 0.44 -0.13 -0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2or2 n LEU 87 CO 0.56 0.43 -0.20 -1.22 -1.33 0.00 0.00 177.39 175.64 2or2 n TYR 88 N 0.57 -1.06 -3.95 -1.77 4.02 -1.26 -4.67 117.16 109.04 2or2 n TYR 88 Ca 0.17 0.09 -0.13 0.00 -0.01 0.00 0.00 57.90 58.02 2or2 n TYR 88 Cb 0.39 -3.78 -0.14 0.00 -0.02 0.00 0.00 39.34 35.79 2or2 n TYR 88 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2or2 s VAL 89 N -2.98 0.11 0.37 -0.72 1.01 -1.26 -5.03 120.40 111.90 2or2 s VAL 89 Ca 0.05 -0.13 0.08 0.00 0.00 0.00 0.00 61.98 61.98 2or2 s VAL 89 Cb -0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 36.20 2or2 s VAL 89 CO 0.06 -0.01 0.17 0.42 0.00 0.00 0.00 175.10 175.74 2or2 s THR 90 N -0.15 2.75 0.20 3.92 -4.23 -1.26 -0.52 115.64 116.36 2or2 s THR 90 Ca -0.01 -1.68 -0.06 0.00 -1.18 0.00 0.00 61.69 58.77 2or2 s THR 90 Cb -0.01 -2.97 0.03 0.00 1.34 0.00 0.00 72.50 70.88 2or2 s THR 90 CO -0.00 -0.11 1.61 0.25 -0.54 0.00 0.00 174.62 175.83 2or2 h LEU 91 N 1.48 0.84 -1.20 4.79 5.85 -1.56 -2.54 115.31 122.97 2or2 h LEU 91 Ca -0.43 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 57.96 2or2 h LEU 91 Cb 1.25 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 2or2 h LEU 91 CO 0.65 1.03 0.29 0.45 -0.34 0.00 0.00 178.44 180.52 2or2 h HIS 92 N 0.72 0.84 -0.43 1.25 3.86 -1.97 -1.18 115.15 118.25 2or2 h HIS 92 Ca 0.10 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 2or2 h HIS 92 Cb 0.75 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 2or2 h HIS 92 CO 0.04 0.61 0.27 1.49 0.86 0.00 0.00 177.93 181.21 2or2 h GLU 93 N 0.85 0.57 -0.13 2.45 4.81 -1.86 0.19 114.58 121.46 2or2 h GLU 93 Ca 0.21 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 2or2 h GLU 93 Cb 0.09 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 2or2 h GLU 93 CO -0.03 0.40 -0.01 0.35 -0.73 0.00 0.00 179.01 178.99 2or2 h PHE 94 N 0.57 0.26 -0.90 0.92 3.57 -1.06 -2.53 116.94 117.77 2or2 h PHE 94 Ca 0.15 -0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.66 2or2 h PHE 94 Cb -0.03 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.58 2or2 h PHE 94 CO -0.04 0.49 0.57 0.82 -2.23 0.00 0.00 178.31 177.93 2or2 h ILE 95 N -0.04 1.08 -0.70 1.41 2.04 -1.03 -0.32 117.51 119.94 2or2 h ILE 95 Ca 0.04 -0.36 -0.07 0.00 1.00 0.00 0.00 64.86 65.46 2or2 h ILE 95 Cb 0.39 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.37 2or2 h ILE 95 CO 0.01 0.19 0.17 0.78 0.00 0.00 0.00 178.15 179.30 2or2 h ASN 96 N 1.06 1.05 -0.50 1.72 2.35 -0.90 0.80 115.58 121.16 2or2 h ASN 96 Ca 0.38 -0.22 -0.04 0.00 -0.55 0.00 0.00 56.30 55.87 2or2 h ASN 96 Cb 0.13 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 2or2 h ASN 96 CO -0.16 1.00 0.16 -0.33 -1.65 0.00 0.00 177.43 176.45 2or2 h GLU 97 N 1.05 0.77 -0.75 0.81 4.39 -0.91 -1.59 114.58 118.37 2or2 h GLU 97 Ca 0.22 -0.17 -0.04 0.00 0.34 0.00 0.00 59.36 59.71 2or2 h GLU 97 Cb 0.37 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 2or2 h GLU 97 CO 0.00 0.72 0.30 0.00 -1.16 0.00 0.00 179.01 178.88 2or2 h ALA 98 N 1.01 0.97 -0.33 3.43 0.00 -0.72 -1.70 119.26 121.92 2or2 h ALA 98 Ca 0.16 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2or2 h ALA 98 Cb 0.27 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2or2 h ALA 98 CO -0.01 0.59 0.21 0.87 0.00 0.00 0.00 179.25 180.92 2or2 h LYS 99 N 1.08 0.42 -0.60 0.00 1.57 -0.50 -0.58 116.57 117.97 2or2 h LYS 99 Ca 0.25 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.96 2or2 h LYS 99 Cb 0.21 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 2or2 h LYS 99 CO -0.02 0.28 0.21 0.37 -0.57 0.00 0.00 179.45 179.72 2or2 h GLN 100 N 0.43 0.91 -0.79 3.15 5.75 -1.12 -0.57 115.11 122.87 2or2 h GLN 100 Ca 0.12 -0.18 -0.02 0.00 -0.15 0.00 0.00 58.65 58.42 2or2 h GLN 100 Cb -0.03 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 28.34 2or2 h GLN 100 CO -0.04 0.80 0.43 0.35 -2.65 0.00 0.00 178.83 177.72 2or2 h PHE 101 N 0.84 1.09 -0.13 3.99 3.57 -1.01 -0.45 116.94 124.83 2or2 h PHE 101 Ca 0.19 -0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.56 2or2 h PHE 101 Cb 0.25 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 2or2 h PHE 101 CO 0.02 0.77 -0.40 -0.07 -2.23 0.00 0.00 178.31 176.39 2or2 h LEU 102 N 1.10 0.31 -0.40 0.59 3.38 -0.80 0.13 115.31 119.62 2or2 h LEU 102 Ca 0.28 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 2or2 h LEU 102 Cb 0.04 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2or2 h LEU 102 CO -0.04 0.69 -0.07 0.50 0.09 0.00 0.00 178.44 179.61 2or2 h LYS 103 N 0.25 0.76 0.00 1.13 3.64 -0.52 -1.38 116.57 120.45 2or2 h LYS 103 Ca 0.02 -0.28 -0.14 0.00 -1.27 0.00 0.00 60.65 58.99 2or2 h LYS 103 Cb 0.82 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.57 2or2 h LYS 103 CO 0.07 0.88 -0.65 -0.44 -2.27 0.00 0.00 179.45 177.03 2or2 h ASP 104 N 0.57 0.00 -2.09 4.20 3.32 -0.81 -3.37 116.42 118.25 2or2 h ASP 104 Ca 0.11 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.58 2or2 h ASP 104 Cb 0.58 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.73 2or2 h ASP 104 CO 0.03 0.65 -0.95 0.59 -1.72 0.00 0.00 179.24 177.85 2or2 n ASN 105 N -3.65 1.17 0.00 6.45 3.02 0.43 -4.96 115.26 117.72 2or2 n ASN 105 Ca -0.01 -2.89 0.00 0.00 -0.03 0.00 0.00 54.58 51.65 2or2 n ASN 105 Cb 0.67 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 2or2 n ASN 105 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2or2 n PRO 106 N 1.34 0.00 0.18 3.52 -0.04 -0.53 -1.37 135.00 138.10 2or2 n PRO 106 Ca 0.24 0.38 0.12 0.00 -0.04 0.00 0.00 63.50 64.20 2or2 n PRO 106 Cb 0.49 -1.51 0.20 0.00 -0.04 0.00 0.00 33.50 32.64 2or2 n PRO 106 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2or2 h SER 107 N 0.00 0.00 -2.47 3.54 4.64 -1.93 -3.19 113.55 114.14 2or2 h SER 107 Ca 0.00 -0.01 -0.44 0.00 -0.47 0.00 0.00 61.79 60.87 2or2 h SER 107 Cb 0.02 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.15 2or2 h SER 107 CO 0.00 0.00 -0.05 -1.61 -0.87 0.00 0.00 176.83 174.31 2or2 s GLU 108 N -3.20 2.57 0.08 4.77 0.41 -0.47 -4.44 118.70 118.42 2or2 s GLU 108 Ca 0.07 -0.80 0.03 0.00 -0.41 0.00 0.00 54.97 53.86 2or2 s GLU 108 Cb 0.07 -2.50 -0.03 0.00 -1.78 0.00 0.00 34.13 29.89 2or2 s GLU 108 CO 0.67 -0.68 -0.09 -0.08 -0.49 0.00 0.00 175.26 174.59 2or2 s THR 109 N -2.74 0.81 -0.13 3.63 -1.32 -1.26 -0.24 115.64 114.39 2or2 s THR 109 Ca 0.57 -1.52 0.03 0.00 -1.21 0.00 0.00 61.69 59.55 2or2 s THR 109 Cb -0.10 -1.20 0.01 0.00 -1.51 0.00 0.00 72.50 69.70 2or2 s THR 109 CO 0.38 -0.54 -0.21 -0.63 -2.21 0.00 0.00 174.62 171.41 2or2 s ILE 110 N -2.28 1.96 -0.26 5.08 -1.09 -0.97 -4.85 121.20 118.80 2or2 s ILE 110 Ca 0.02 -0.93 -0.10 0.00 -2.23 0.00 0.00 60.65 57.41 2or2 s ILE 110 Cb -0.04 -1.74 -0.05 0.00 -1.58 0.00 0.00 42.46 39.06 2or2 s ILE 110 CO -0.01 0.53 0.15 -0.63 -1.23 0.00 0.00 174.94 173.76 2or2 s ILE 111 N 0.78 5.11 -0.28 2.92 1.01 0.16 -0.04 121.20 130.86 2or2 s ILE 111 Ca -0.09 0.10 -0.03 0.00 0.00 0.00 0.00 60.65 60.63 2or2 s ILE 111 Cb -0.16 -3.41 0.03 0.00 0.01 0.00 0.00 42.46 38.94 2or2 s ILE 111 CO -0.00 0.30 -0.00 -0.32 0.00 0.00 0.00 174.94 174.92 2or2 s MET 112 N 1.46 2.71 -0.01 2.79 1.75 0.28 -1.02 119.30 127.26 2or2 s MET 112 Ca 0.07 -1.08 -0.24 0.00 -1.25 0.00 0.00 55.69 53.19 2or2 s MET 112 Cb -0.15 -3.16 -0.04 0.00 2.84 0.00 0.00 34.83 34.32 2or2 s MET 112 CO 0.07 -0.51 0.74 0.45 -0.65 0.00 0.00 175.02 175.12 2or2 s SER 113 N 1.34 7.10 -0.12 1.11 0.15 0.27 -0.59 113.70 122.96 2or2 s SER 113 Ca -0.02 1.32 -0.00 0.00 0.70 0.00 0.00 55.95 57.95 2or2 s SER 113 Cb -0.18 -2.44 0.02 0.00 -1.71 0.00 0.00 66.02 61.71 2or2 s SER 113 CO -0.01 -0.06 -0.10 -0.22 1.20 0.00 0.00 173.24 174.05 2or2 s LEU 114 N 0.39 1.34 0.04 3.45 2.96 -0.84 -1.15 118.68 124.88 2or2 s LEU 114 Ca 0.38 -0.34 0.06 0.00 -0.22 0.00 0.00 54.13 54.01 2or2 s LEU 114 Cb -0.19 -0.92 -0.02 0.00 0.50 0.00 0.00 46.19 45.56 2or2 s LEU 114 CO 0.21 -0.09 -0.18 -0.75 -1.32 0.00 0.00 176.35 174.22 2or2 s LYS 115 N 1.57 1.20 -0.41 1.98 2.20 -0.83 -1.11 119.74 124.33 2or2 s LYS 115 Ca 0.03 -0.84 -0.29 0.00 -0.36 0.00 0.00 55.97 54.51 2or2 s LYS 115 Cb -0.13 -1.27 0.02 0.00 -1.51 0.00 0.00 37.83 34.95 2or2 s LYS 115 CO -0.08 0.32 1.17 0.21 -0.36 0.00 0.00 175.35 176.61 2or2 s LYS 116 N -1.10 3.82 -0.00 4.03 2.20 -1.26 -1.32 119.74 126.11 2or2 s LYS 116 Ca 0.05 0.82 0.06 0.00 -0.36 0.00 0.00 55.97 56.54 2or2 s LYS 116 Cb -0.08 -3.87 -0.24 0.00 -1.51 0.00 0.00 37.83 32.13 2or2 s LYS 116 CO 0.01 -1.24 0.82 1.49 -0.36 0.00 0.00 175.35 176.07 2or2 h GLU 117 N 9.08 0.08 -3.74 4.03 4.57 -1.00 -3.47 114.58 124.14 2or2 h GLU 117 Ca -0.23 -0.14 -0.11 0.00 -1.18 0.00 0.00 59.36 57.70 2or2 h GLU 117 Cb 1.07 0.05 -0.16 0.00 -0.16 0.00 0.00 28.75 29.55 2or2 h GLU 117 CO 1.09 0.81 -0.43 -0.47 -1.18 0.00 0.00 179.01 178.83 2or2 s TYR 118 N -2.62 0.15 0.48 0.92 5.04 -1.24 -4.53 117.35 115.54 2or2 s TYR 118 Ca -0.06 -0.48 -0.23 0.00 -2.44 0.00 0.00 57.07 53.87 2or2 s TYR 118 Cb 0.08 -0.09 -0.09 0.00 0.35 0.00 0.00 41.96 42.22 2or2 s TYR 118 CO 0.83 -0.45 1.04 -0.85 -1.34 0.00 0.00 175.55 174.77 2or2 n GLU 119 N 0.43 1.31 -1.78 4.97 0.28 -1.26 -4.58 120.64 120.00 2or2 n GLU 119 Ca -0.17 0.48 -0.37 0.00 -0.16 0.00 0.00 57.16 56.93 2or2 n GLU 119 Cb 0.60 -2.14 0.06 0.00 1.43 0.00 0.00 31.44 31.39 2or2 n GLU 119 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2or2 s ASP 120 N -0.86 4.86 0.54 -1.84 1.01 -1.26 -4.70 116.67 114.42 2or2 s ASP 120 Ca 0.67 2.65 -0.20 0.00 0.71 0.00 0.00 52.55 56.38 2or2 s ASP 120 Cb -0.50 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 40.75 2or2 s ASP 120 CO 0.54 -1.84 1.20 -0.04 0.21 0.00 0.00 175.17 175.25 2or2 s MET 121 N -3.22 3.27 0.32 8.23 -1.94 0.14 -4.94 119.30 121.16 2or2 s MET 121 Ca 0.79 1.83 -0.29 0.00 -1.71 0.00 0.00 55.69 56.31 2or2 s MET 121 Cb -0.38 -2.11 -0.10 0.00 2.01 0.00 0.00 34.83 34.25 2or2 s MET 121 CO 0.42 -0.97 1.34 0.15 -0.01 0.00 0.00 175.02 175.95 2or2 s LYS 122 N -3.10 4.32 0.00 2.03 -0.14 -1.26 -3.06 119.74 118.53 2or2 s LYS 122 Ca 0.72 2.26 0.00 0.00 -1.36 0.00 0.00 55.97 57.59 2or2 s LYS 122 Cb -0.30 -3.07 0.00 0.00 -1.68 0.00 0.00 37.83 32.78 2or2 s LYS 122 CO 0.34 -0.25 0.00 0.41 -0.76 0.00 0.00 175.35 175.09 2or2 n GLY 123 N 0.99 0.80 3.73 -3.33 0.00 -1.26 -4.71 105.19 101.41 2or2 n GLY 123 Ca 0.01 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 2or2 n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2or2 s ALA 124 N -2.00 3.29 0.07 4.61 0.00 -1.17 -4.79 121.76 121.78 2or2 s ALA 124 Ca 0.00 0.68 -0.37 0.00 0.00 0.00 0.00 51.96 52.27 2or2 s ALA 124 Cb 0.00 -3.33 -0.19 0.00 0.00 0.00 0.00 23.12 19.60 2or2 s ALA 124 CO 0.00 -0.15 1.57 0.93 0.00 0.00 0.00 175.76 178.11 2or2 h GLU 125 N 5.65 -1.13 0.00 0.00 4.39 -1.86 -3.46 114.58 118.16 2or2 h GLU 125 Ca -0.43 0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.35 2or2 h GLU 125 Cb 1.21 0.26 0.00 0.00 -0.10 0.00 0.00 28.75 30.12 2or2 h GLU 125 CO 0.73 -0.76 0.00 0.41 -1.16 0.00 0.00 179.01 178.24 2or2 n GLY 126 N -1.62 4.35 4.02 -3.84 0.00 -1.26 -5.15 105.19 101.69 2or2 n GLY 126 Ca -0.14 -2.04 -0.19 0.00 0.00 0.00 0.00 46.02 43.65 2or2 n GLY 126 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2or2 s SER 127 N -0.20 5.36 0.09 1.61 1.04 -1.26 -4.92 113.70 115.41 2or2 s SER 127 Ca 0.00 -0.54 -0.27 0.00 0.48 0.00 0.00 55.95 55.62 2or2 s SER 127 Cb 0.00 -0.30 -0.15 0.00 0.10 0.00 0.00 66.02 65.67 2or2 s SER 127 CO 0.00 -1.06 1.69 0.15 0.98 0.00 0.00 173.24 175.00 2or2 h PHE 128 N 0.36 -0.36 -0.01 5.02 3.04 -1.98 -0.58 116.94 122.43 2or2 h PHE 128 Ca -0.36 -0.01 -0.00 0.00 3.98 0.00 0.00 57.97 61.58 2or2 h PHE 128 Cb 1.28 0.13 -0.00 0.00 2.56 0.00 0.00 35.95 39.92 2or2 h PHE 128 CO 0.38 -0.22 0.01 0.66 -2.02 0.00 0.00 178.31 177.11 2or2 h SER 129 N -0.37 0.01 -0.88 0.41 4.64 -1.92 -1.14 113.55 114.31 2or2 h SER 129 Ca -0.03 -0.06 -0.02 0.00 -0.47 0.00 0.00 61.79 61.22 2or2 h SER 129 Cb 0.30 -0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.34 2or2 h SER 129 CO 0.04 0.06 0.47 0.77 -0.87 0.00 0.00 176.83 177.30 2or2 h SER 130 N -0.04 1.11 -0.42 4.97 4.64 -1.86 -1.27 113.55 120.69 2or2 h SER 130 Ca 0.00 -0.11 -0.12 0.00 -0.47 0.00 0.00 61.79 61.09 2or2 h SER 130 Cb 0.05 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.85 2or2 h SER 130 CO -0.00 0.90 -0.22 0.74 -0.87 0.00 0.00 176.83 177.39 2or2 h THR 131 N 1.24 1.28 0.33 2.95 2.02 -0.97 -1.01 112.91 118.75 2or2 h THR 131 Ca 0.31 -1.37 -0.02 0.00 0.77 0.00 0.00 66.41 66.11 2or2 h THR 131 Cb 0.05 1.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 2or2 h THR 131 CO -0.05 0.46 -0.16 0.15 0.37 0.00 0.00 175.52 176.29 2or2 h PHE 132 N 0.71 -0.41 -0.82 3.16 3.57 -0.97 -1.00 116.94 121.18 2or2 h PHE 132 Ca 0.09 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 2or2 h PHE 132 Cb 0.78 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.62 2or2 h PHE 132 CO 0.06 -0.14 0.36 0.93 -2.23 0.00 0.00 178.31 177.29 2or2 h GLU 133 N -0.64 1.20 -0.03 1.11 5.08 -1.27 0.36 114.58 120.39 2or2 h GLU 133 Ca -0.05 -0.20 -0.25 0.00 -1.00 0.00 0.00 59.36 57.86 2or2 h GLU 133 Cb 0.46 -0.20 0.02 0.00 0.50 0.00 0.00 28.75 29.52 2or2 h GLU 133 CO 0.07 0.94 -0.99 -0.22 -1.00 0.00 0.00 179.01 177.82 2or2 h LYS 134 N 1.18 0.68 0.00 2.33 3.64 -1.20 -2.23 116.57 120.97 2or2 h LYS 134 Ca 0.28 -0.70 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 2or2 h LYS 134 Cb 0.17 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2or2 h LYS 134 CO -0.03 1.29 -1.50 0.09 -2.27 0.00 0.00 179.45 177.03 2or2 n ASN 135 N -3.85 0.48 0.04 4.20 3.02 -0.38 -4.62 115.26 114.14 2or2 n ASN 135 Ca -0.10 -0.45 0.00 0.00 -0.03 0.00 0.00 54.58 54.01 2or2 n ASN 135 Cb 0.85 1.48 0.00 0.00 -0.61 0.00 0.00 39.78 41.51 2or2 n ASN 135 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2or2 n TYR 136 N -1.91 -0.29 -0.09 3.10 4.02 0.10 -4.86 117.16 117.23 2or2 n TYR 136 Ca -0.00 0.05 0.10 0.00 -0.01 0.00 0.00 57.90 58.04 2or2 n TYR 136 Cb 0.46 0.11 0.47 0.00 -0.02 0.00 0.00 39.34 40.36 2or2 n TYR 136 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 2or2 h PHE 137 N 0.00 0.49 -0.02 -0.72 3.57 -0.88 -2.13 116.94 117.24 2or2 h PHE 137 Ca 0.00 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.52 2or2 h PHE 137 Cb 0.35 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.93 2or2 h PHE 137 CO 0.00 0.24 0.19 -0.24 -2.23 0.00 0.00 178.31 176.27 2or2 h VAL 138 N 0.47 0.05 -2.39 1.41 3.04 -1.65 -3.43 116.25 113.75 2or2 h VAL 138 Ca 0.27 0.00 -0.56 0.00 -1.01 0.00 0.00 66.70 65.40 2or2 h VAL 138 Cb 0.44 0.82 0.06 0.00 -2.01 0.00 0.00 31.29 30.60 2or2 h VAL 138 CO -0.08 0.00 0.89 -0.67 -1.01 0.00 0.00 177.57 176.71 2or2 n ASP 139 N -3.07 3.43 0.01 3.17 -0.08 -0.80 -4.84 116.55 114.37 2or2 n ASP 139 Ca -0.02 1.07 0.01 0.00 -1.51 0.00 0.00 54.79 54.34 2or2 n ASP 139 Cb 0.25 -1.48 0.05 0.00 2.34 0.00 0.00 41.12 42.28 2or2 n ASP 139 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2or2 n PRO 140 N 3.85 0.01 0.22 -0.67 -0.02 -1.26 -1.50 135.00 135.63 2or2 n PRO 140 Ca 0.17 0.50 0.10 0.00 -2.02 0.00 0.00 63.50 62.24 2or2 n PRO 140 Cb 0.31 -1.55 0.48 0.00 -0.02 0.00 0.00 33.50 32.72 2or2 n PRO 140 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2or2 h ILE 141 N 0.00 0.62 -3.28 4.25 6.09 -1.90 -3.42 117.51 119.87 2or2 h ILE 141 Ca 0.00 -1.10 -0.59 0.00 -1.37 0.00 0.00 64.86 61.80 2or2 h ILE 141 Cb 0.03 1.73 -0.08 0.00 0.47 0.00 0.00 36.82 38.97 2or2 h ILE 141 CO 0.00 0.23 0.47 -0.36 -3.07 0.00 0.00 178.15 175.42 2or2 s PHE 142 N -3.73 3.34 0.18 2.19 0.08 -0.56 -0.91 117.98 118.56 2or2 s PHE 142 Ca -0.00 1.18 -0.31 0.00 0.12 0.00 0.00 56.93 57.92 2or2 s PHE 142 Cb 0.11 -3.05 -0.10 0.00 -0.57 0.00 0.00 43.02 39.41 2or2 s PHE 142 CO 0.64 -0.37 1.54 -1.17 -0.10 0.00 0.00 175.22 175.76 2or2 s LEU 143 N 2.71 4.37 0.00 -0.37 2.96 -0.83 -4.91 118.68 122.60 2or2 s LEU 143 Ca 0.36 2.61 0.20 0.00 -0.22 0.00 0.00 54.13 57.08 2or2 s LEU 143 Cb -0.16 -3.60 0.33 0.00 0.50 0.00 0.00 46.19 43.26 2or2 s LEU 143 CO 0.08 -0.80 1.28 0.29 -1.32 0.00 0.00 176.35 175.88 2or2 n LYS 144 N 3.72 2.22 -2.75 1.98 4.76 -1.26 -3.53 118.16 123.30 2or2 n LYS 144 Ca 0.13 -2.04 -0.22 0.00 -2.87 0.00 0.00 58.31 53.30 2or2 n LYS 144 Cb 0.39 -1.43 0.03 0.00 -1.84 0.00 0.00 35.03 32.17 2or2 n LYS 144 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2or2 s THR 145 N -1.42 3.25 0.00 -0.18 -4.23 -1.26 -2.97 115.64 108.83 2or2 s THR 145 Ca 0.32 -0.54 0.00 0.00 -1.18 0.00 0.00 61.69 60.28 2or2 s THR 145 Cb 0.19 -3.22 0.00 0.00 1.34 0.00 0.00 72.50 70.81 2or2 s THR 145 CO 0.27 -0.16 0.00 -0.62 -0.54 0.00 0.00 174.62 173.57 2or2 n GLU 146 N -2.27 0.73 0.00 3.99 1.02 -1.26 -1.98 120.64 120.86 2or2 n GLU 146 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 2or2 n GLU 146 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.01 2or2 n GLU 146 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2or2 n GLY 147 N 2.51 -0.01 3.27 0.62 0.00 -1.26 -3.84 105.19 106.48 2or2 n GLY 147 Ca 0.00 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 2or2 n GLY 147 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2or2 n ASN 148 N -1.32 5.13 -4.63 1.61 5.15 -1.26 -4.91 115.26 115.03 2or2 n ASN 148 Ca 0.00 -3.01 -0.63 0.00 -0.60 0.00 0.00 54.58 50.33 2or2 n ASN 148 Cb 0.00 -1.56 -0.09 0.00 -0.53 0.00 0.00 39.78 37.60 2or2 n ASN 148 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 2or2 n ILE 149 N 4.35 0.00 -3.50 -1.44 5.41 -1.25 -4.74 119.36 118.19 2or2 n ILE 149 Ca 0.39 -0.00 -0.33 0.00 1.00 0.00 0.00 62.75 63.81 2or2 n ILE 149 Cb 0.41 -0.27 -0.05 0.00 -0.71 0.00 0.00 39.64 39.01 2or2 n ILE 149 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2or2 s LYS 150 N 1.56 3.78 0.32 0.38 1.02 -1.26 -0.67 119.74 124.86 2or2 s LYS 150 Ca 0.98 0.20 0.05 0.00 0.02 0.00 0.00 55.97 57.22 2or2 s LYS 150 Cb -1.38 -2.81 0.67 0.00 -0.52 0.00 0.00 37.83 33.78 2or2 s LYS 150 CO 0.70 0.43 1.86 1.25 -0.92 0.00 0.00 175.35 178.66 2or2 h LEU 151 N 3.03 0.81 -0.94 3.17 5.85 -1.25 -1.80 115.31 124.17 2or2 h LEU 151 Ca -0.47 0.04 0.10 0.00 0.84 0.00 0.00 57.88 58.39 2or2 h LEU 151 Cb 1.18 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 42.01 2or2 h LEU 151 CO 0.69 0.43 0.58 1.23 -0.34 0.00 0.00 178.44 181.02 2or2 h GLY 152 N 0.87 1.51 1.76 3.75 0.00 -1.16 -0.53 103.07 109.27 2or2 h GLY 152 Ca 0.47 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 2or2 h GLY 152 CO -0.23 0.17 -0.36 -0.55 0.00 0.00 0.00 176.54 175.57 2or2 h ASP 153 N 0.95 0.00 1.30 0.19 3.32 -1.61 -3.32 116.42 117.25 2or2 h ASP 153 Ca 0.46 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.44 2or2 h ASP 153 Cb 0.41 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 2or2 h ASP 153 CO -0.25 0.13 -0.72 0.00 -1.72 0.00 0.00 179.24 176.68 2or2 h ALA 154 N 1.87 0.70 -2.10 3.45 0.00 -0.63 -3.45 119.26 119.10 2or2 h ALA 154 Ca -0.01 -0.29 -0.61 0.00 0.00 0.00 0.00 54.91 54.00 2or2 h ALA 154 Cb 1.11 0.04 0.08 0.00 0.00 0.00 0.00 17.79 19.02 2or2 h ALA 154 CO 0.02 0.35 0.46 0.54 0.00 0.00 0.00 179.25 180.61 2or2 n ARG 155 N -2.96 1.67 -0.94 0.00 1.74 -0.33 -0.89 116.66 114.96 2or2 n ARG 155 Ca -0.01 0.59 0.00 0.00 -0.77 0.00 0.00 57.85 57.67 2or2 n ARG 155 Cb 0.65 -2.17 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 2or2 n ARG 155 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2or2 n GLY 156 N 2.02 0.38 3.43 -0.13 0.00 0.66 -4.97 105.19 106.59 2or2 n GLY 156 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 2or2 n GLY 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2or2 s LYS 157 N -0.69 1.55 -0.22 1.61 -0.14 -0.07 -4.98 119.74 116.80 2or2 s LYS 157 Ca 0.00 -1.80 -0.08 0.00 -1.36 0.00 0.00 55.97 52.73 2or2 s LYS 157 Cb 0.00 -1.05 -0.04 0.00 -1.68 0.00 0.00 37.83 35.06 2or2 s LYS 157 CO 0.00 -0.02 0.09 0.42 -0.76 0.00 0.00 175.35 175.08 2or2 s ILE 158 N -3.10 4.77 -0.30 2.17 1.01 -0.09 -2.28 121.20 123.38 2or2 s ILE 158 Ca 0.31 -0.03 -0.10 0.00 0.00 0.00 0.00 60.65 60.83 2or2 s ILE 158 Cb 0.05 -3.20 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 2or2 s ILE 158 CO 0.12 0.39 0.17 -0.69 0.00 0.00 0.00 174.94 174.93 2or2 s VAL 159 N 0.98 4.91 0.13 2.92 1.01 0.94 -1.97 120.40 129.32 2or2 s VAL 159 Ca 0.05 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 2or2 s VAL 159 Cb -0.14 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.76 2or2 s VAL 159 CO 0.03 0.15 0.99 -0.22 0.00 0.00 0.00 175.10 176.05 2or2 s LEU 160 N 1.68 4.50 -0.39 3.92 2.96 -1.26 -0.56 118.68 129.53 2or2 s LEU 160 Ca 0.06 1.86 0.00 0.00 -0.22 0.00 0.00 54.13 55.83 2or2 s LEU 160 Cb -0.16 -3.59 0.11 0.00 0.50 0.00 0.00 46.19 43.04 2or2 s LEU 160 CO 0.08 -0.09 0.15 -0.22 -1.32 0.00 0.00 176.35 174.95 2or2 s LEU 161 N -0.11 5.01 0.05 -0.68 2.96 0.25 -0.55 118.68 125.61 2or2 s LEU 161 Ca 0.47 -2.16 -0.31 0.00 -0.22 0.00 0.00 54.13 51.92 2or2 s LEU 161 Cb -0.25 -1.74 -0.07 0.00 0.50 0.00 0.00 46.19 44.64 2or2 s LEU 161 CO 0.31 -0.46 1.41 -0.54 -1.32 0.00 0.00 176.35 175.75 2or2 s LYS 162 N 0.93 4.29 -0.11 1.98 1.02 -0.70 -1.98 119.74 125.18 2or2 s LYS 162 Ca 0.10 2.03 0.16 0.00 0.02 0.00 0.00 55.97 58.28 2or2 s LYS 162 Cb -0.21 -3.45 0.37 0.00 -0.52 0.00 0.00 37.83 34.02 2or2 s LYS 162 CO -0.06 -0.53 1.18 0.54 -0.92 0.00 0.00 175.35 175.56 2or2 n ARG 163 N 4.83 0.86 -4.16 1.68 1.74 -0.27 -3.88 116.66 117.46 2or2 n ARG 163 Ca 0.13 -2.57 -0.16 0.00 -0.77 0.00 0.00 57.85 54.47 2or2 n ARG 163 Cb 0.43 -0.94 -0.12 0.00 -1.02 0.00 0.00 32.46 30.81 2or2 n ARG 163 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 2or2 s TYR 164 N -1.78 0.96 0.50 -1.55 -0.85 -1.21 -4.22 117.35 109.21 2or2 s TYR 164 Ca 0.33 -0.44 0.03 0.00 -0.52 0.00 0.00 57.07 56.47 2or2 s TYR 164 Cb 0.34 -0.56 0.02 0.00 0.38 0.00 0.00 41.96 42.14 2or2 s TYR 164 CO -0.09 -0.00 0.71 -1.54 -1.52 0.00 0.00 175.55 173.11 2or2 s SER 165 N -1.49 5.44 0.00 -0.18 1.04 -1.26 -4.58 113.70 112.67 2or2 s SER 165 Ca -0.04 -0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.32 2or2 s SER 165 Cb -0.09 -0.91 0.00 0.00 0.10 0.00 0.00 66.02 65.11 2or2 s SER 165 CO 0.01 -0.99 0.00 0.61 0.98 0.00 0.00 173.24 173.85 2or2 n GLY 166 N -2.19 0.61 3.78 7.32 0.00 -1.26 -4.66 105.19 108.79 2or2 n GLY 166 Ca 0.07 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2or2 n GLY 166 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2or2 s SER 167 N -2.03 6.35 0.00 1.61 0.15 -1.26 -4.79 113.70 113.73 2or2 s SER 167 Ca 0.00 3.01 0.00 0.00 0.70 0.00 0.00 55.95 59.66 2or2 s SER 167 Cb 0.00 -2.67 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 2or2 s SER 167 CO 0.00 -0.86 0.48 0.59 1.20 0.00 0.00 173.24 174.64 2or2 n ASN 168 N 0.45 0.86 -4.29 5.45 3.02 -1.26 -5.04 115.26 114.45 2or2 n ASN 168 Ca 0.01 -1.19 -0.32 0.00 -0.03 0.00 0.00 54.58 53.05 2or2 n ASN 168 Cb 0.40 0.00 -0.16 0.00 -0.61 0.00 0.00 39.78 39.41 2or2 n ASN 168 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2or2 s GLU 169 N -0.19 2.72 0.52 3.52 0.41 -1.26 -5.12 118.70 119.30 2or2 s GLU 169 Ca 0.00 -0.86 -0.20 0.00 -0.41 0.00 0.00 54.97 53.50 2or2 s GLU 169 Cb 0.00 -2.26 -0.07 0.00 -1.78 0.00 0.00 34.13 30.02 2or2 s GLU 169 CO 0.00 0.35 1.10 -1.12 -0.49 0.00 0.00 175.26 175.10 2or2 s SER 170 N -0.08 5.97 0.00 -0.19 0.01 -1.26 -4.99 113.70 113.15 2or2 s SER 170 Ca -0.05 2.10 0.00 0.00 1.31 0.00 0.00 55.95 59.30 2or2 s SER 170 Cb -0.14 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.51 2or2 s SER 170 CO 0.04 -1.04 0.00 0.61 0.41 0.00 0.00 173.24 173.26 2or2 n GLY 171 N 0.04 4.66 7.00 3.44 0.00 -1.16 -4.70 105.19 114.47 2or2 n GLY 171 Ca 0.11 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2or2 n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2or2 n GLY 172 N -1.20 0.29 3.65 -0.02 0.00 -0.84 -4.69 105.19 102.39 2or2 n GLY 172 Ca 0.00 -0.87 -0.38 0.00 0.00 0.00 0.00 46.02 44.77 2or2 n GLY 172 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2or2 s TYR 173 N 0.00 3.32 0.69 1.61 2.02 0.29 -4.60 117.35 120.69 2or2 s TYR 173 Ca 0.00 0.40 -0.17 0.00 -0.37 0.00 0.00 57.07 56.93 2or2 s TYR 173 Cb 0.00 -2.42 0.01 0.00 -0.40 0.00 0.00 41.96 39.15 2or2 s TYR 173 CO 0.00 -0.02 1.14 0.09 -1.57 0.00 0.00 175.55 175.19 2or2 n ASN 174 N 4.55 1.26 -4.77 2.29 3.02 -1.26 -1.73 115.26 118.63 2or2 n ASN 174 Ca -0.11 0.74 -0.41 0.00 -0.03 0.00 0.00 54.58 54.77 2or2 n ASN 174 Cb 0.51 -1.48 -0.02 0.00 -0.61 0.00 0.00 39.78 38.18 2or2 n ASN 174 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2or2 s ASN 175 N -1.57 6.69 0.19 6.41 3.04 -1.25 -4.61 114.94 123.84 2or2 s ASN 175 Ca 0.78 2.71 0.01 0.00 0.04 0.00 0.00 52.86 56.40 2or2 s ASN 175 Cb -0.36 -2.65 -0.05 0.00 -1.54 0.00 0.00 41.25 36.66 2or2 s ASN 175 CO 0.46 -0.59 0.04 0.72 -3.04 0.00 0.00 177.10 174.68 2or2 s PHE 176 N -1.15 1.22 -0.05 0.43 -0.12 -1.26 -5.00 117.98 112.04 2or2 s PHE 176 Ca 0.50 -1.11 -0.35 0.00 -0.05 0.00 0.00 56.93 55.91 2or2 s PHE 176 Cb -0.40 -0.69 -0.13 0.00 -0.63 0.00 0.00 43.02 41.17 2or2 s PHE 176 CO 0.53 -0.32 1.74 0.98 -0.05 0.00 0.00 175.22 178.10 2or2 n TYR 177 N -0.26 2.20 -3.58 3.49 9.36 -1.26 -4.94 117.16 122.16 2or2 n TYR 177 Ca -0.04 0.21 -0.28 0.00 3.32 0.00 0.00 57.90 61.10 2or2 n TYR 177 Cb 0.64 -2.57 -0.11 0.00 -0.63 0.00 0.00 39.34 36.67 2or2 n TYR 177 CO 0.00 0.00 0.00 -0.46 0.22 0.00 0.00 176.86 176.62 2or2 s TRP 178 N 2.95 1.84 0.90 2.98 -0.11 -1.26 -4.91 118.94 121.32 2or2 s TRP 178 Ca 0.90 -2.55 -0.10 0.00 1.22 0.00 0.00 56.10 55.57 2or2 s TRP 178 Cb -0.78 -1.53 0.14 0.00 -1.50 0.00 0.00 33.47 29.80 2or2 s TRP 178 CO 0.50 -0.75 1.15 -1.25 -4.62 0.00 0.00 176.95 171.99 2or2 s PRO 179 N -0.20 1.09 -0.02 5.86 0.04 -1.26 -4.95 135.00 135.56 2or2 s PRO 179 Ca 0.27 1.56 -0.26 0.00 0.04 0.00 0.00 61.00 62.61 2or2 s PRO 179 Cb -0.05 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.72 2or2 s PRO 179 CO -0.14 -2.58 0.82 0.34 0.04 0.00 0.00 177.00 175.48 2or2 s ASP 180 N -2.64 7.18 -1.30 6.66 2.15 -1.26 -4.32 116.67 123.13 2or2 s ASP 180 Ca 0.67 1.42 -0.03 0.00 0.43 0.00 0.00 52.55 55.05 2or2 s ASP 180 Cb -0.23 -2.48 -0.00 0.00 -0.30 0.00 0.00 42.92 39.90 2or2 s ASP 180 CO 0.57 -0.15 0.65 -3.20 -0.17 0.00 0.00 175.17 172.87 2or2 n ASN 181 N 3.64 -1.61 -3.97 -0.34 5.15 -1.24 -4.99 115.26 111.89 2or2 n ASN 181 Ca 0.01 -0.89 -0.12 0.00 -0.60 0.00 0.00 54.58 52.99 2or2 n ASN 181 Cb 0.51 -3.77 -0.08 0.00 -0.53 0.00 0.00 39.78 35.92 2or2 n ASN 181 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2or2 s GLU 182 N -6.06 1.42 -0.22 1.20 2.02 -1.21 -4.65 118.70 111.19 2or2 s GLU 182 Ca 0.07 -1.56 -0.04 0.00 0.02 0.00 0.00 54.97 53.46 2or2 s GLU 182 Cb -0.02 0.35 -0.01 0.00 0.10 0.00 0.00 34.13 34.55 2or2 s GLU 182 CO 0.83 -0.53 -0.02 0.99 0.02 0.00 0.00 175.26 176.55 2or2 s THR 183 N -3.95 3.54 0.11 3.63 2.01 -1.26 -1.53 115.64 118.20 2or2 s THR 183 Ca 0.33 -0.44 -0.01 0.00 0.31 0.00 0.00 61.69 61.89 2or2 s THR 183 Cb 0.04 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.89 2or2 s THR 183 CO 0.13 0.41 0.03 0.72 -0.69 0.00 0.00 174.62 175.22 2or2 s PHE 184 N 1.46 0.79 -0.04 4.92 -0.12 0.09 -4.96 117.98 120.13 2or2 s PHE 184 Ca 0.05 -1.18 0.03 0.00 -0.05 0.00 0.00 56.93 55.78 2or2 s PHE 184 Cb -0.14 -0.47 0.00 0.00 -0.63 0.00 0.00 43.02 41.78 2or2 s PHE 184 CO -0.02 -0.46 -0.12 0.99 -0.05 0.00 0.00 175.22 175.56 2or2 s THR 185 N -3.99 1.00 0.14 -4.49 2.01 -1.26 -0.40 115.64 108.65 2or2 s THR 185 Ca 0.20 -0.47 -0.04 0.00 0.31 0.00 0.00 61.69 61.69 2or2 s THR 185 Cb 0.08 -0.88 0.01 0.00 0.01 0.00 0.00 72.50 71.72 2or2 s THR 185 CO -0.01 0.31 0.24 1.07 -0.69 0.00 0.00 174.62 175.54 2or2 n THR 186 N 3.33 0.00 -3.92 -0.82 5.66 -0.09 -4.99 114.28 113.46 2or2 n THR 186 Ca -0.19 -0.47 -0.31 0.00 -3.05 0.00 0.00 64.05 60.03 2or2 n THR 186 Cb 0.53 0.37 -0.04 0.00 -1.55 0.00 0.00 70.33 69.65 2or2 n THR 186 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2or2 s THR 187 N -2.64 5.39 0.00 1.09 -4.23 -1.26 -0.46 115.64 113.52 2or2 s THR 187 Ca 0.08 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.19 2or2 s THR 187 Cb -0.01 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.19 2or2 s THR 187 CO 0.06 0.13 0.00 0.52 -0.54 0.00 0.00 174.62 174.79 2or2 n VAL 188 N 0.26 0.00 -3.85 2.29 0.31 0.37 -4.71 118.33 113.01 2or2 n VAL 188 Ca -0.05 0.07 -0.09 0.00 -0.01 0.00 0.00 64.34 64.26 2or2 n VAL 188 Cb 0.51 -1.02 -0.01 0.00 -0.91 0.00 0.00 33.84 32.41 2or2 n VAL 188 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2or2 n ASN 189 N -2.32 1.89 0.22 4.52 3.02 -1.09 -4.53 115.26 116.97 2or2 n ASN 189 Ca 0.00 -1.67 0.07 0.00 -0.03 0.00 0.00 54.58 52.95 2or2 n ASN 189 Cb 0.00 0.03 0.52 0.00 -0.61 0.00 0.00 39.78 39.72 2or2 n ASN 189 CO 0.00 0.00 0.00 0.06 -2.62 0.00 0.00 177.26 174.70 2or2 h GLN 190 N 0.00 0.00 0.00 3.52 -0.00 -1.99 -3.13 115.11 113.51 2or2 h GLN 190 Ca -0.12 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.51 2or2 h GLN 190 Cb 0.42 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.87 2or2 h GLN 190 CO 0.20 0.23 -0.39 0.09 -0.00 0.00 0.00 178.83 178.96 2or2 n ASN 191 N -4.02 1.78 -3.69 0.06 3.02 -1.26 -5.01 115.26 106.14 2or2 n ASN 191 Ca -0.02 -3.44 -0.16 0.00 -0.03 0.00 0.00 54.58 50.93 2or2 n ASN 191 Cb 0.30 -0.47 -0.15 0.00 -0.61 0.00 0.00 39.78 38.85 2or2 n ASN 191 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2or2 s VAL 192 N -2.75 -0.19 0.20 2.41 1.01 -1.18 -4.67 120.40 115.22 2or2 s VAL 192 Ca 0.34 0.30 0.08 0.00 0.00 0.00 0.00 61.98 62.71 2or2 s VAL 192 Cb 0.33 -0.27 -0.04 0.00 0.00 0.00 0.00 36.38 36.40 2or2 s VAL 192 CO -0.05 0.13 -0.01 0.20 0.00 0.00 0.00 175.10 175.37 2or2 s ASN 193 N 1.93 4.68 0.04 3.32 0.01 -0.94 -0.48 114.94 123.49 2or2 s ASN 193 Ca -0.01 -0.47 0.01 0.00 -0.71 0.00 0.00 52.86 51.68 2or2 s ASN 193 Cb -0.12 -0.95 -0.02 0.00 0.41 0.00 0.00 41.25 40.56 2or2 s ASN 193 CO -0.06 0.07 -0.05 0.54 -1.51 0.00 0.00 177.10 176.09 2or2 s VAL 194 N -1.87 0.36 -0.08 1.60 0.11 0.39 0.09 120.40 120.99 2or2 s VAL 194 Ca 0.28 -1.13 0.01 0.00 -2.93 0.00 0.00 61.98 58.21 2or2 s VAL 194 Cb -0.09 -0.61 0.02 0.00 -1.53 0.00 0.00 36.38 34.17 2or2 s VAL 194 CO 0.19 -0.51 -0.09 -0.89 -3.33 0.00 0.00 175.10 170.47 2or2 s THR 195 N -1.76 1.00 -0.06 5.04 2.01 0.07 -0.91 115.64 121.04 2or2 s THR 195 Ca -0.10 -0.34 0.04 0.00 0.31 0.00 0.00 61.69 61.60 2or2 s THR 195 Cb -0.08 -0.98 -0.00 0.00 0.01 0.00 0.00 72.50 71.46 2or2 s THR 195 CO -0.01 0.34 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.39 2or2 s VAL 196 N 1.17 1.53 -0.38 3.82 1.01 0.47 -1.34 120.40 126.68 2or2 s VAL 196 Ca -0.05 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.11 2or2 s VAL 196 Cb -0.14 -1.32 0.07 0.00 0.00 0.00 0.00 36.38 34.98 2or2 s VAL 196 CO -0.02 0.44 0.17 -1.58 0.00 0.00 0.00 175.10 174.11 2or2 s GLN 197 N 0.19 2.49 -0.38 2.72 -0.44 -0.35 -0.73 119.66 123.16 2or2 s GLN 197 Ca -0.08 -1.40 0.13 0.00 -2.50 0.00 0.00 55.36 51.51 2or2 s GLN 197 Cb -0.14 -3.57 0.41 0.00 -1.64 0.00 0.00 33.01 28.07 2or2 s GLN 197 CO 0.04 -0.84 0.91 -3.47 0.50 0.00 0.00 175.29 172.43 2or2 n ASP 198 N 4.80 2.05 -4.49 6.67 2.03 -0.58 -1.60 116.55 125.43 2or2 n ASP 198 Ca -0.10 -3.04 -0.44 0.00 0.52 0.00 0.00 54.79 51.73 2or2 n ASP 198 Cb 0.43 -0.55 -0.01 0.00 -0.72 0.00 0.00 41.12 40.28 2or2 n ASP 198 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2or2 s LYS 199 N -3.02 3.96 0.00 -0.67 1.02 -1.25 -3.29 119.74 116.49 2or2 s LYS 199 Ca 0.36 -2.23 0.27 0.00 0.02 0.00 0.00 55.97 54.39 2or2 s LYS 199 Cb 0.40 -5.16 1.31 0.00 -0.52 0.00 0.00 37.83 33.86 2or2 s LYS 199 CO -0.05 -1.90 1.92 2.48 -0.92 0.00 0.00 175.35 176.88 2or2 n TYR 200 N 6.59 0.00 -2.34 3.18 4.11 -1.26 -4.08 117.16 123.36 2or2 n TYR 200 Ca 0.37 0.00 0.03 0.00 -0.00 0.00 0.00 57.90 58.30 2or2 n TYR 200 Cb 0.45 -0.35 0.02 0.00 -0.00 0.00 0.00 39.34 39.46 2or2 n TYR 200 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.86 177.22 2or2 n LYS 201 N -1.35 0.06 -2.39 -3.48 2.85 -1.26 -1.16 118.16 111.43 2or2 n LYS 201 Ca 0.11 -1.82 -0.25 0.00 -1.05 0.00 0.00 58.31 55.31 2or2 n LYS 201 Cb 0.25 -0.18 0.09 0.00 -0.65 0.00 0.00 35.03 34.54 2or2 n LYS 201 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 177.40 177.49 2or2 s VAL 202 N -0.13 2.27 0.75 0.58 -7.23 -1.26 -4.62 120.40 110.76 2or2 s VAL 202 Ca 0.26 -0.43 -0.11 0.00 -1.81 0.00 0.00 61.98 59.90 2or2 s VAL 202 Cb 0.30 -2.84 0.04 0.00 0.56 0.00 0.00 36.38 34.44 2or2 s VAL 202 CO -0.13 0.00 1.09 0.54 -0.31 0.00 0.00 175.10 176.29 2or2 s ASN 203 N -4.63 4.75 0.17 4.85 2.20 -1.26 -4.59 114.94 116.43 2or2 s ASN 203 Ca 0.64 1.79 -0.18 0.00 -0.94 0.00 0.00 52.86 54.17 2or2 s ASN 203 Cb -0.08 -2.52 0.11 0.00 -2.00 0.00 0.00 41.25 36.76 2or2 s ASN 203 CO 0.44 -1.87 1.64 0.22 -2.94 0.00 0.00 177.10 174.59 2or2 h TYR 204 N -0.93 -0.44 -0.83 1.54 5.03 -1.99 -0.78 116.97 118.57 2or2 h TYR 204 Ca -0.44 0.04 0.00 0.00 2.58 0.00 0.00 58.73 60.92 2or2 h TYR 204 Cb 1.23 0.26 -0.04 0.00 1.55 0.00 0.00 36.73 39.72 2or2 h TYR 204 CO 0.58 -0.26 0.53 -0.44 -1.32 0.00 0.00 178.16 177.25 2or2 h ASP 205 N -0.10 0.97 0.44 -2.11 3.32 -2.00 -1.01 116.42 115.93 2or2 h ASP 205 Ca 0.20 -0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.12 2or2 h ASP 205 Cb 0.41 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 2or2 h ASP 205 CO -0.48 0.72 -0.42 -0.08 -1.72 0.00 0.00 179.24 177.26 2or2 h GLU 206 N 1.12 0.00 0.22 3.56 4.81 -1.80 -1.97 114.58 120.52 2or2 h GLU 206 Ca 0.30 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.52 2or2 h GLU 206 Cb -0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.29 2or2 h GLU 206 CO -0.06 0.42 -0.11 -0.22 -0.73 0.00 0.00 179.01 178.31 2or2 h LYS 207 N 0.00 -0.29 -0.99 1.92 1.63 -0.29 -0.18 116.57 118.37 2or2 h LYS 207 Ca -0.00 0.02 0.06 0.00 -0.85 0.00 0.00 60.65 59.87 2or2 h LYS 207 Cb 0.75 0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 32.38 2or2 h LYS 207 CO 0.05 0.08 0.64 0.28 -3.45 0.00 0.00 179.45 177.06 2or2 h VAL 208 N -0.77 1.11 -0.58 2.00 2.07 -1.20 0.87 116.25 119.75 2or2 h VAL 208 Ca -0.03 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.04 2or2 h VAL 208 Cb 0.51 -0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.07 2or2 h VAL 208 CO 0.05 0.22 0.20 0.50 0.02 0.00 0.00 177.57 178.56 2or2 h LYS 209 N 1.19 0.88 -0.55 1.57 3.64 -1.34 -1.70 116.57 120.26 2or2 h LYS 209 Ca 0.42 -0.18 -0.06 0.00 -1.27 0.00 0.00 60.65 59.57 2or2 h LYS 209 Cb 0.13 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2or2 h LYS 209 CO -0.16 0.78 0.12 0.77 -2.27 0.00 0.00 179.45 178.69 2or2 h SER 210 N 0.80 0.84 -0.12 4.20 0.02 0.18 0.17 113.55 119.63 2or2 h SER 210 Ca 0.19 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2or2 h SER 210 Cb 0.25 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2or2 h SER 210 CO -0.01 0.86 0.07 0.40 -1.14 0.00 0.00 176.83 177.02 2or2 h ILE 211 N 0.78 1.07 -0.66 3.27 2.04 -0.75 -1.37 117.51 121.89 2or2 h ILE 211 Ca 0.17 -0.19 -0.08 0.00 1.00 0.00 0.00 64.86 65.76 2or2 h ILE 211 Cb 0.36 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 2or2 h ILE 211 CO 0.00 0.07 0.10 0.11 0.00 0.00 0.00 178.15 178.43 2or2 h LYS 212 N 0.13 1.11 -0.55 2.37 1.57 -1.14 -1.18 116.57 118.87 2or2 h LYS 212 Ca 0.04 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 2or2 h LYS 212 Cb 0.04 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 2or2 h LYS 212 CO -0.01 1.02 0.29 -0.44 -0.57 0.00 0.00 179.45 179.74 2or2 h ASP 213 N 1.03 0.70 0.10 0.86 3.32 -0.51 0.90 116.42 122.81 2or2 h ASP 213 Ca 0.20 -0.11 -0.11 0.00 0.02 0.00 0.00 57.03 57.03 2or2 h ASP 213 Cb 0.46 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2or2 h ASP 213 CO 0.02 0.61 -0.38 0.74 -1.72 0.00 0.00 179.24 178.51 2or2 h THR 214 N 0.74 1.30 -0.26 0.35 2.02 -1.06 -1.21 112.91 114.78 2or2 h THR 214 Ca 0.19 -1.49 -0.13 0.00 0.77 0.00 0.00 66.41 65.76 2or2 h THR 214 Cb 0.07 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 2or2 h THR 214 CO -0.03 0.46 -0.36 0.24 0.37 0.00 0.00 175.52 176.20 2or2 h MET 215 N 0.32 0.59 -0.64 6.66 2.86 -0.85 -0.73 114.93 123.15 2or2 h MET 215 Ca 0.03 -0.28 -0.05 0.00 -2.06 0.00 0.00 59.70 57.34 2or2 h MET 215 Cb 0.81 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.44 2or2 h MET 215 CO 0.07 0.87 0.22 -0.44 1.06 0.00 0.00 176.91 178.68 2or2 h ASP 216 N 0.50 0.92 -0.39 1.22 3.32 -0.36 0.20 116.42 121.82 2or2 h ASP 216 Ca 0.05 -0.20 -0.08 0.00 0.02 0.00 0.00 57.03 56.82 2or2 h ASP 216 Cb 0.86 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 2or2 h ASP 216 CO 0.07 0.87 -0.05 -0.08 -1.72 0.00 0.00 179.24 178.34 2or2 h GLU 217 N 0.92 0.81 -0.26 3.56 4.81 -1.01 -0.39 114.58 123.02 2or2 h GLU 217 Ca 0.21 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 2or2 h GLU 217 Cb 0.27 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 2or2 h GLU 217 CO -0.01 0.85 0.10 1.15 -0.73 0.00 0.00 179.01 180.37 2or2 h THR 218 N 0.75 1.17 -0.59 0.32 2.02 -0.55 -2.61 112.91 113.42 2or2 h THR 218 Ca 0.14 -0.53 -0.10 0.00 0.77 0.00 0.00 66.41 66.68 2or2 h THR 218 Cb 0.52 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2or2 h THR 218 CO 0.03 0.18 -0.02 0.24 0.37 0.00 0.00 175.52 176.32 2or2 h MET 219 N 0.27 1.06 0.00 6.66 2.86 -0.74 -1.40 114.93 123.63 2or2 h MET 219 Ca 0.09 -0.34 0.00 0.00 -2.06 0.00 0.00 59.70 57.38 2or2 h MET 219 Cb 0.18 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.75 2or2 h MET 219 CO -0.01 1.04 0.00 -0.91 1.06 0.00 0.00 176.91 178.09 2or2 h ASN 220 N 0.96 0.00 -0.27 1.22 2.35 -0.96 -2.02 115.58 116.86 2or2 h ASN 220 Ca 0.17 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.69 2or2 h ASN 220 Cb 0.58 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 38.70 2or2 h ASN 220 CO 0.03 0.00 -0.77 0.59 -1.65 0.00 0.00 177.43 175.63 2or2 n ASN 221 N -2.31 2.49 -0.29 5.81 3.02 -1.00 -4.91 115.26 118.08 2or2 n ASN 221 Ca 0.01 -3.26 0.09 0.00 -0.03 0.00 0.00 54.58 51.38 2or2 n ASN 221 Cb 0.18 -0.43 0.24 0.00 -0.61 0.00 0.00 39.78 39.16 2or2 n ASN 221 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2or2 h SER 222 N 1.55 0.34 -0.65 6.41 4.64 -0.49 -2.04 113.55 123.32 2or2 h SER 222 Ca 0.05 0.13 -0.15 0.00 -0.47 0.00 0.00 61.79 61.34 2or2 h SER 222 Cb 1.36 0.10 -0.09 0.00 -0.31 0.00 0.00 62.40 63.45 2or2 h SER 222 CO 0.26 0.08 0.20 -0.62 -0.87 0.00 0.00 176.83 175.88 2or2 n GLU 223 N -5.00 3.75 -3.05 4.77 -0.58 -1.26 -4.71 120.64 114.57 2or2 n GLU 223 Ca 0.18 -2.81 -0.45 0.00 -0.42 0.00 0.00 57.16 53.66 2or2 n GLU 223 Cb 0.52 -2.16 -0.03 0.00 -0.57 0.00 0.00 31.44 29.20 2or2 n GLU 223 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2or2 s ASP 224 N -0.82 6.48 0.09 1.62 -1.08 -0.77 -4.87 116.67 117.31 2or2 s ASP 224 Ca 0.50 -1.88 0.18 0.00 -0.52 0.00 0.00 52.55 50.84 2or2 s ASP 224 Cb 0.40 -2.34 0.76 0.00 -1.46 0.00 0.00 42.92 40.28 2or2 s ASP 224 CO 0.13 -1.03 1.56 0.18 0.52 0.00 0.00 175.17 176.53 2or2 n LEU 225 N 6.14 0.23 -1.53 -1.34 4.77 -1.26 -2.82 117.00 121.18 2or2 n LEU 225 Ca 0.10 0.55 0.11 0.00 -0.03 0.00 0.00 56.01 56.74 2or2 n LEU 225 Cb 0.46 -0.52 0.35 0.00 -2.33 0.00 0.00 43.42 41.38 2or2 n LEU 225 CO 0.51 -0.34 0.81 0.59 -1.33 0.00 0.00 177.39 177.63 2or2 n ASN 226 N -1.75 4.50 -4.22 -1.43 4.13 -1.26 -4.53 115.26 110.70 2or2 n ASN 226 Ca 0.03 -2.27 -0.33 0.00 1.68 0.00 0.00 54.58 53.69 2or2 n ASN 226 Cb 0.20 -0.55 -0.15 0.00 -1.54 0.00 0.00 39.78 37.73 2or2 n ASN 226 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 2or2 s HIS 227 N -1.51 2.80 -0.08 3.10 2.46 -1.13 -2.22 115.29 118.71 2or2 s HIS 227 Ca 0.51 -1.22 -0.13 0.00 0.47 0.00 0.00 55.06 54.70 2or2 s HIS 227 Cb 0.30 -1.93 -0.05 0.00 -0.13 0.00 0.00 32.58 30.78 2or2 s HIS 227 CO 0.29 -0.59 0.32 -1.17 -2.47 0.00 0.00 174.74 171.12 2or2 s LEU 228 N 1.06 4.37 -0.13 8.88 2.96 0.11 -4.75 118.68 131.19 2or2 s LEU 228 Ca -0.01 0.71 0.01 0.00 -0.22 0.00 0.00 54.13 54.62 2or2 s LEU 228 Cb -0.14 -2.43 0.02 0.00 0.50 0.00 0.00 46.19 44.14 2or2 s LEU 228 CO -0.04 0.25 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.77 2or2 s TYR 229 N -0.45 2.12 -0.14 5.38 2.02 -1.26 -0.75 117.35 124.28 2or2 s TYR 229 Ca 0.20 -1.12 0.02 0.00 -0.37 0.00 0.00 57.07 55.80 2or2 s TYR 229 Cb -0.14 -1.55 0.01 0.00 -0.40 0.00 0.00 41.96 39.88 2or2 s TYR 229 CO 0.08 -0.60 -0.21 0.42 -1.57 0.00 0.00 175.55 173.67 2or2 s ILE 230 N 1.29 1.99 -0.29 2.71 1.01 -0.45 -0.56 121.20 126.91 2or2 s ILE 230 Ca 0.00 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.73 2or2 s ILE 230 Cb -0.14 -1.77 0.08 0.00 0.01 0.00 0.00 42.46 40.65 2or2 s ILE 230 CO -0.07 0.54 0.02 0.21 0.00 0.00 0.00 174.94 175.64 2or2 s ASN 231 N 0.83 4.16 -0.23 3.58 3.84 0.55 -1.22 114.94 126.46 2or2 s ASN 231 Ca -0.07 -1.59 -0.25 0.00 0.21 0.00 0.00 52.86 51.16 2or2 s ASN 231 Cb -0.15 -1.22 -0.00 0.00 -0.55 0.00 0.00 41.25 39.32 2or2 s ASN 231 CO -0.02 -0.33 0.85 -0.36 -2.79 0.00 0.00 177.10 174.45 2or2 s PHE 232 N 1.32 3.33 -1.21 0.43 0.40 -0.63 -1.55 117.98 120.06 2or2 s PHE 232 Ca 0.03 1.19 0.25 0.00 -0.60 0.00 0.00 56.93 57.80 2or2 s PHE 232 Cb -0.18 -3.07 0.45 0.00 0.51 0.00 0.00 43.02 40.73 2or2 s PHE 232 CO -0.12 -0.38 1.37 0.25 0.70 0.00 0.00 175.22 177.04 2or2 n THR 233 N 5.18 0.00 -2.10 0.64 -2.24 0.12 -4.82 114.28 111.05 2or2 n THR 233 Ca 0.06 -0.04 -0.38 0.00 -2.27 0.00 0.00 64.05 61.42 2or2 n THR 233 Cb 0.48 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 2or2 n THR 233 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2or2 s SER 234 N -2.87 6.03 -0.07 3.42 1.04 -1.24 -4.86 113.70 115.15 2or2 s SER 234 Ca 0.14 2.49 -0.08 0.00 0.48 0.00 0.00 55.95 58.99 2or2 s SER 234 Cb 0.18 -2.62 0.02 0.00 0.10 0.00 0.00 66.02 63.70 2or2 s SER 234 CO 0.67 -1.03 0.21 -0.22 0.98 0.00 0.00 173.24 173.86 2or2 s LEU 235 N -2.96 1.20 -0.02 2.42 2.96 -1.26 -4.66 118.68 116.36 2or2 s LEU 235 Ca 0.63 0.36 0.10 0.00 -0.22 0.00 0.00 54.13 55.01 2or2 s LEU 235 Cb -0.34 0.75 0.18 0.00 0.50 0.00 0.00 46.19 47.29 2or2 s LEU 235 CO 0.41 -0.12 1.08 -1.54 -1.32 0.00 0.00 176.35 174.86 2or2 n SER 236 N 2.76 0.58 -1.33 3.68 3.41 -0.31 -3.89 113.62 118.53 2or2 n SER 236 Ca -0.14 -2.17 -0.19 0.00 -0.26 0.00 0.00 58.87 56.11 2or2 n SER 236 Cb 0.58 -0.27 -0.04 0.00 -0.26 0.00 0.00 64.21 64.23 2or2 n SER 236 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2or2 n SER 237 N -0.00 0.26 0.00 4.04 7.64 -1.25 -4.58 113.62 119.73 2or2 n SER 237 Ca 0.04 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.16 2or2 n SER 237 Cb 0.84 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 2or2 n SER 237 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2or2 n GLY 238 N 2.08 0.71 0.00 0.23 0.00 -1.26 -4.81 105.19 102.14 2or2 n GLY 238 Ca 0.15 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.90 2or2 n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2or2 n GLY 239 N -0.76 0.30 0.00 -0.02 0.00 -1.26 -5.02 105.19 98.42 2or2 n GLY 239 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2or2 n GLY 239 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2or2 n THR 240 N 0.00 0.00 0.06 2.61 -1.04 -1.26 -4.77 114.28 109.88 2or2 n THR 240 Ca 0.00 0.00 0.21 0.00 -2.04 0.00 0.00 64.05 62.22 2or2 n THR 240 Cb 0.00 -0.08 0.71 0.00 -1.82 0.00 0.00 70.33 69.14 2or2 n THR 240 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2or2 h ALA 241 N 0.00 2.20 -3.48 2.41 0.00 -2.00 -3.32 119.26 115.06 2or2 h ALA 241 Ca 0.00 -0.02 -0.57 0.00 0.00 0.00 0.00 54.91 54.32 2or2 h ALA 241 Cb 0.14 0.04 -0.39 0.00 0.00 0.00 0.00 17.79 17.58 2or2 h ALA 241 CO 0.00 -0.80 -0.78 0.00 0.00 0.00 0.00 179.25 177.68 2or2 s ALA 242 N -4.57 1.56 -1.41 0.00 0.00 -1.26 -5.03 121.76 111.05 2or2 s ALA 242 Ca -0.04 -1.07 -0.15 0.00 0.00 0.00 0.00 51.96 50.70 2or2 s ALA 242 Cb 0.15 -1.32 0.04 0.00 0.00 0.00 0.00 23.12 21.98 2or2 s ALA 242 CO 0.52 -1.18 2.15 -1.71 0.00 0.00 0.00 175.76 175.55 2or2 n ASN 243 N 4.83 3.96 0.10 0.00 5.15 -1.25 -4.73 115.26 123.33 2or2 n ASN 243 Ca -0.11 -2.84 0.13 0.00 -0.60 0.00 0.00 54.58 51.16 2or2 n ASN 243 Cb 0.45 -1.65 0.43 0.00 -0.53 0.00 0.00 39.78 38.48 2or2 n ASN 243 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2or2 n SER 244 N 6.51 0.75 -0.25 1.20 3.41 -1.26 -4.28 113.62 119.70 2or2 n SER 244 Ca 0.51 0.59 0.05 0.00 -0.26 0.00 0.00 58.87 59.76 2or2 n SER 244 Cb 0.40 -0.78 0.18 0.00 -0.26 0.00 0.00 64.21 63.75 2or2 n SER 244 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2or2 h PRO 245 N 0.00 0.38 -0.32 4.33 0.13 -1.85 -1.29 132.00 133.38 2or2 h PRO 245 Ca 0.00 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 65.06 2or2 h PRO 245 Cb 0.67 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.70 2or2 h PRO 245 CO 0.00 0.25 0.01 -0.92 -0.23 0.00 0.00 178.00 177.11 2or2 h TYR 246 N 0.39 0.60 -0.22 1.56 3.20 -1.86 -0.70 116.97 119.94 2or2 h TYR 246 Ca 0.41 -0.10 0.05 0.00 3.14 0.00 0.00 58.73 62.23 2or2 h TYR 246 Cb 0.64 -0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.70 2or2 h TYR 246 CO -0.19 0.67 -0.11 -0.92 -1.64 0.00 0.00 178.16 175.97 2or2 h TYR 247 N 0.36 -0.26 -0.45 -3.82 3.20 -1.65 0.44 116.97 114.78 2or2 h TYR 247 Ca 0.09 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.95 2or2 h TYR 247 Cb 0.42 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 2or2 h TYR 247 CO 0.03 -0.17 0.15 1.88 -1.64 0.00 0.00 178.16 178.41 2or2 h TYR 248 N -0.08 0.71 -0.32 -3.82 0.05 -1.19 -2.82 116.97 109.50 2or2 h TYR 248 Ca 0.12 -0.07 -0.03 0.00 0.05 0.00 0.00 58.73 58.80 2or2 h TYR 248 Cb 0.27 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 37.78 2or2 h TYR 248 CO -0.28 0.63 0.07 0.00 -1.05 0.00 0.00 178.16 177.54 2or2 h ALA 249 N 1.00 1.54 0.00 3.88 0.00 -0.74 0.31 119.26 125.25 2or2 h ALA 249 Ca 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2or2 h ALA 249 Cb 0.25 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2or2 h ALA 249 CO -0.01 0.35 -0.03 0.66 0.00 0.00 0.00 179.25 180.22 2or2 h SER 250 N 0.45 0.00 0.00 0.00 4.64 -0.65 -0.35 113.55 117.64 2or2 h SER 250 Ca 0.11 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.04 2or2 h SER 250 Cb 0.18 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.21 2or2 h SER 250 CO -0.00 0.03 -2.35 -1.22 -0.87 0.00 0.00 176.83 172.42 2or2 n TYR 251 N -3.44 0.00 -0.16 4.77 4.01 -0.70 -4.50 117.16 117.14 2or2 n TYR 251 Ca -0.02 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.62 2or2 n TYR 251 Cb 0.14 -0.88 -0.00 0.00 -0.31 0.00 0.00 39.34 38.29 2or2 n TYR 251 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 2or2 h ILE 252 N -0.51 1.23 -0.07 -0.72 2.04 -0.32 -2.35 117.51 116.82 2or2 h ILE 252 Ca -0.58 -0.80 0.03 0.00 1.00 0.00 0.00 64.86 64.51 2or2 h ILE 252 Cb 1.65 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 38.61 2or2 h ILE 252 CO -0.25 0.29 -0.11 0.78 0.00 0.00 0.00 178.15 178.86 2or2 h ASN 253 N 0.59 -0.33 -0.57 1.72 -0.26 -1.28 0.20 115.58 115.65 2or2 h ASN 253 Ca 0.14 0.06 -0.09 0.00 -0.56 0.00 0.00 56.30 55.85 2or2 h ASN 253 Cb 0.31 0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 37.71 2or2 h ASN 253 CO 0.00 -0.15 -0.01 -0.65 -1.06 0.00 0.00 177.43 175.57 2or2 h PRO 254 N -0.15 1.01 -0.09 0.81 0.11 -1.76 -1.34 132.00 130.59 2or2 h PRO 254 Ca 0.06 -0.33 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 2or2 h PRO 254 Cb 0.24 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.26 2or2 h PRO 254 CO -0.16 1.01 0.04 1.49 -0.21 0.00 0.00 178.00 180.17 2or2 h GLU 255 N 0.90 0.14 -0.19 1.05 4.81 -1.19 -0.49 114.58 119.61 2or2 h GLU 255 Ca 0.16 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.22 2or2 h GLU 255 Cb 0.55 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 2or2 h GLU 255 CO 0.03 0.26 -0.49 0.82 -0.73 0.00 0.00 179.01 178.90 2or2 h ILE 256 N -0.01 1.32 -0.67 2.32 1.08 -0.98 -0.38 117.51 120.19 2or2 h ILE 256 Ca 0.03 -1.71 -0.04 0.00 -0.39 0.00 0.00 64.86 62.76 2or2 h ILE 256 Cb 0.17 1.70 -0.03 0.00 -3.07 0.00 0.00 36.82 35.59 2or2 h ILE 256 CO -0.00 0.53 0.27 0.00 -0.69 0.00 0.00 178.15 178.26 2or2 h ALA 257 N 1.06 0.87 -0.39 1.87 0.00 -1.15 -0.75 119.26 120.76 2or2 h ALA 257 Ca 0.02 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.62 2or2 h ALA 257 Cb 1.00 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2or2 h ALA 257 CO 0.09 0.48 -0.30 -0.97 0.00 0.00 0.00 179.25 178.55 2or2 h ASN 258 N 0.94 0.90 -0.74 0.00 -0.73 -0.89 -1.27 115.58 113.79 2or2 h ASN 258 Ca 0.22 -0.37 -0.01 0.00 1.87 0.00 0.00 56.30 58.01 2or2 h ASN 258 Cb 0.20 -0.25 -0.04 0.00 0.27 0.00 0.00 38.32 38.51 2or2 h ASN 258 CO -0.02 1.13 0.42 -0.78 -0.37 0.00 0.00 177.43 177.82 2or2 h ASP 259 N 0.73 0.92 0.05 1.15 3.58 -0.65 -0.14 116.42 122.06 2or2 h ASP 259 Ca 0.08 -0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 2or2 h ASP 259 Cb 0.86 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.68 2or2 h ASP 259 CO 0.08 0.73 -0.03 0.40 -2.88 0.00 0.00 179.24 177.55 2or2 h ILE 260 N 1.02 1.14 -0.86 2.25 2.04 -1.00 -2.11 117.51 119.99 2or2 h ILE 260 Ca 0.26 -0.63 0.10 0.00 1.00 0.00 0.00 64.86 65.60 2or2 h ILE 260 Cb 0.01 1.55 -0.08 0.00 -0.74 0.00 0.00 36.82 37.56 2or2 h ILE 260 CO -0.05 0.16 0.50 0.50 0.00 0.00 0.00 178.15 179.26 2or2 h LYS 261 N -0.35 0.79 -0.02 2.37 3.64 -0.96 -0.72 116.57 121.32 2or2 h LYS 261 Ca -0.01 -0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 59.20 2or2 h LYS 261 Cb 0.31 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 2or2 h LYS 261 CO 0.01 0.52 -0.58 1.96 -2.27 0.00 0.00 179.45 179.09 2or2 h GLN 262 N 0.82 0.07 0.00 1.90 1.08 -0.96 -3.05 115.11 114.96 2or2 h GLN 262 Ca 0.42 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.57 2or2 h GLN 262 Cb 0.40 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 2or2 h GLN 262 CO -0.26 0.63 -0.49 0.87 -0.95 0.00 0.00 178.83 178.63 2or2 h LYS 263 N 0.05 0.00 -6.83 1.46 1.57 -0.80 -3.48 116.57 108.53 2or2 h LYS 263 Ca -0.01 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.20 2or2 h LYS 263 Cb 1.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.34 2or2 h LYS 263 CO 0.08 0.00 -1.00 -1.71 -0.57 0.00 0.00 179.45 176.25 2or2 n ASN 264 N -2.48 -3.99 -4.81 0.86 2.85 -0.33 -4.91 115.26 102.44 2or2 n ASN 264 Ca 0.03 -1.26 -0.30 0.00 -0.11 0.00 0.00 54.58 52.95 2or2 n ASN 264 Cb 0.48 -1.95 0.09 0.00 1.24 0.00 0.00 39.78 39.65 2or2 n ASN 264 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 2or2 s PRO 265 N -7.21 2.12 0.00 1.20 0.04 -1.26 -4.98 135.00 124.91 2or2 s PRO 265 Ca 0.46 0.61 0.22 0.00 0.04 0.00 0.00 61.00 62.33 2or2 s PRO 265 Cb -0.24 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.29 2or2 s PRO 265 CO 0.96 -1.59 1.00 0.25 0.04 0.00 0.00 177.00 177.66 2or2 n THR 266 N -3.41 0.00 -3.64 1.26 -2.24 -1.26 -4.65 114.28 100.34 2or2 n THR 266 Ca 0.07 -0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.80 2or2 n THR 266 Cb 0.56 0.86 -0.07 0.00 -2.10 0.00 0.00 70.33 69.58 2or2 n THR 266 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2or2 s ARG 267 N -2.99 0.56 0.00 -0.78 3.52 -1.25 -4.64 118.95 113.36 2or2 s ARG 267 Ca 0.09 0.95 0.00 0.00 -0.13 0.00 0.00 55.73 56.64 2or2 s ARG 267 Cb 0.16 0.12 0.00 0.00 -1.56 0.00 0.00 34.95 33.67 2or2 s ARG 267 CO 0.83 -0.12 0.24 1.33 -0.81 0.00 0.00 175.30 176.78 2or2 n VAL 268 N 3.96 0.00 -1.91 7.11 0.24 -1.26 -4.06 118.33 122.41 2or2 n VAL 268 Ca -0.19 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 2or2 n VAL 268 Cb 0.58 1.06 0.00 0.00 -1.47 0.00 0.00 33.84 34.01 2or2 n VAL 268 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2or2 n GLY 269 N 0.41 -1.86 3.42 7.63 0.00 -1.26 -4.72 105.19 108.82 2or2 n GLY 269 Ca 0.00 -1.75 -0.44 0.00 0.00 0.00 0.00 46.02 43.83 2or2 n GLY 269 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2or2 s TRP 270 N 0.00 3.02 -0.47 1.61 0.52 0.28 -1.95 118.94 121.95 2or2 s TRP 270 Ca 0.00 -0.69 -0.18 0.00 0.02 0.00 0.00 56.10 55.25 2or2 s TRP 270 Cb 0.00 -3.73 0.05 0.00 -1.15 0.00 0.00 33.47 28.64 2or2 s TRP 270 CO 0.00 -1.15 0.51 0.08 0.02 0.00 0.00 176.95 176.41 2or2 s VAL 271 N 2.69 5.03 -0.34 4.03 1.01 -0.25 -0.33 120.40 132.25 2or2 s VAL 271 Ca 0.14 -0.60 -0.15 0.00 0.00 0.00 0.00 61.98 61.36 2or2 s VAL 271 Cb -0.21 -4.18 -0.01 0.00 0.00 0.00 0.00 36.38 31.98 2or2 s VAL 271 CO 0.10 -0.63 0.38 -0.63 0.00 0.00 0.00 175.10 174.31 2or2 s ILE 272 N 2.22 5.16 0.33 2.22 -1.09 -0.60 -0.86 121.20 128.57 2or2 s ILE 272 Ca 0.11 0.10 0.10 0.00 -2.23 0.00 0.00 60.65 58.73 2or2 s ILE 272 Cb -0.20 -3.83 -0.06 0.00 -1.58 0.00 0.00 42.46 36.79 2or2 s ILE 272 CO 0.11 -0.09 -0.11 0.00 -1.23 0.00 0.00 174.94 173.61 2or2 s GLN 273 N 2.05 1.80 0.36 2.79 -2.07 -0.26 -0.70 119.66 123.63 2or2 s GLN 273 Ca 0.12 -1.89 0.00 0.00 -1.82 0.00 0.00 55.36 51.78 2or2 s GLN 273 Cb -0.16 -1.73 -0.03 0.00 -1.09 0.00 0.00 33.01 29.99 2or2 s GLN 273 CO 0.12 0.18 0.56 -0.51 -1.32 0.00 0.00 175.29 174.32 2or2 s ASP 274 N -3.59 6.28 -0.71 12.60 1.01 -1.26 -0.85 116.67 130.15 2or2 s ASP 274 Ca 0.32 0.46 -0.09 0.00 0.71 0.00 0.00 52.55 53.95 2or2 s ASP 274 Cb 0.01 -2.03 0.01 0.00 1.01 0.00 0.00 42.92 41.92 2or2 s ASP 274 CO 0.16 -0.32 0.63 -1.22 0.21 0.00 0.00 175.17 174.64 2or2 n TYR 275 N -1.81 -2.41 -2.72 4.23 4.02 0.14 -4.93 117.16 113.68 2or2 n TYR 275 Ca -0.04 0.98 -0.42 0.00 -0.01 0.00 0.00 57.90 58.40 2or2 n TYR 275 Cb 0.56 -2.86 -0.03 0.00 -0.02 0.00 0.00 39.34 37.00 2or2 n TYR 275 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2or2 s ILE 276 N -2.66 4.79 0.00 -0.72 1.01 -1.26 -4.94 121.20 117.41 2or2 s ILE 276 Ca 0.09 1.97 0.00 0.00 0.00 0.00 0.00 60.65 62.72 2or2 s ILE 276 Cb -0.01 -4.28 0.00 0.00 0.01 0.00 0.00 42.46 38.17 2or2 s ILE 276 CO 0.86 -0.01 0.00 -0.46 0.00 0.00 0.00 174.94 175.33 2or2 n ASN 277 N 5.17 0.00 -0.42 3.58 0.23 -1.26 -4.66 115.26 117.90 2or2 n ASN 277 Ca 0.08 -0.66 0.08 0.00 -0.53 0.00 0.00 54.58 53.55 2or2 n ASN 277 Cb 0.48 0.00 0.18 0.00 -2.08 0.00 0.00 39.78 38.37 2or2 n ASN 277 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2or2 n GLU 278 N 0.00 1.71 0.09 -3.83 1.02 -1.26 -4.77 120.64 113.60 2or2 n GLU 278 Ca 0.00 -2.82 -0.16 0.00 -0.02 0.00 0.00 57.16 54.16 2or2 n GLU 278 Cb 0.00 -1.62 -0.09 0.00 -0.02 0.00 0.00 31.44 29.71 2or2 n GLU 278 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2or2 h LYS 279 N 0.62 0.39 -6.25 3.49 3.64 -1.97 -3.47 116.57 113.02 2or2 h LYS 279 Ca 0.02 -0.52 -0.46 0.00 -1.27 0.00 0.00 60.65 58.42 2or2 h LYS 279 Cb 1.15 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 33.13 2or2 h LYS 279 CO 0.08 1.20 -0.40 -1.58 -2.27 0.00 0.00 179.45 176.47 2or2 s TRP 280 N -2.98 3.15 -0.05 1.91 0.51 -1.26 -5.12 118.94 115.11 2or2 s TRP 280 Ca -0.06 -0.18 -0.02 0.00 -2.12 0.00 0.00 56.10 53.73 2or2 s TRP 280 Cb 0.08 -1.79 0.04 0.00 -0.81 0.00 0.00 33.47 30.98 2or2 s TRP 280 CO 0.88 0.19 0.10 0.45 -0.51 0.00 0.00 176.95 178.06 2or2 s SER 281 N -4.06 0.16 1.04 2.95 0.15 -1.26 -4.00 113.70 108.68 2or2 s SER 281 Ca 0.40 0.19 -0.15 0.00 0.70 0.00 0.00 55.95 57.09 2or2 s SER 281 Cb -0.08 0.07 0.21 0.00 -1.71 0.00 0.00 66.02 64.51 2or2 s SER 281 CO 0.29 -0.16 1.13 -2.84 1.20 0.00 0.00 173.24 172.86 2or2 s PRO 282 N 1.35 0.10 -0.26 5.44 0.02 -1.26 -4.87 135.00 135.52 2or2 s PRO 282 Ca -0.06 0.21 -0.17 0.00 0.02 0.00 0.00 61.00 60.99 2or2 s PRO 282 Cb -0.12 -1.73 -0.03 0.00 0.02 0.00 0.00 34.50 32.64 2or2 s PRO 282 CO -0.05 -2.88 0.47 -0.51 -0.33 0.00 0.00 177.00 173.70 2or2 s LEU 283 N -6.46 4.05 0.14 -5.54 1.43 -1.26 -4.61 118.68 106.43 2or2 s LEU 283 Ca 0.67 0.45 -0.25 0.00 -1.03 0.00 0.00 54.13 53.98 2or2 s LEU 283 Cb -0.14 -2.59 0.00 0.00 0.03 0.00 0.00 46.19 43.49 2or2 s LEU 283 CO 0.56 -0.25 1.61 0.25 0.23 0.00 0.00 176.35 178.75 2or2 h LEU 284 N 8.69 -0.94 -1.67 1.79 5.85 -1.91 -1.54 115.31 125.58 2or2 h LEU 284 Ca -0.30 0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.62 2or2 h LEU 284 Cb 1.15 0.41 -0.03 0.00 0.37 0.00 0.00 40.66 42.57 2or2 h LEU 284 CO 0.69 -0.33 0.31 0.10 -0.34 0.00 0.00 178.44 178.87 2or2 h TYR 285 N -0.34 0.41 -0.27 1.25 -0.00 -1.94 -0.74 116.97 115.34 2or2 h TYR 285 Ca 0.11 0.01 -0.18 0.00 -0.00 0.00 0.00 58.73 58.68 2or2 h TYR 285 Cb 0.52 -0.14 0.00 0.00 -0.00 0.00 0.00 36.73 37.11 2or2 h TYR 285 CO -0.42 0.23 -0.53 1.96 -0.00 0.00 0.00 178.16 179.41 2or2 h GLN 286 N 0.42 0.84 -0.09 0.10 4.20 -1.66 -1.86 115.11 117.05 2or2 h GLN 286 Ca 0.19 -0.54 -0.09 0.00 0.06 0.00 0.00 58.65 58.27 2or2 h GLN 286 Cb 0.25 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2or2 h GLN 286 CO -0.05 1.17 -0.37 0.93 -0.67 0.00 0.00 178.83 179.84 2or2 h GLU 287 N 0.60 0.19 -0.21 1.46 4.39 -0.58 -1.13 114.58 119.30 2or2 h GLU 287 Ca 0.01 -0.08 -0.04 0.00 0.34 0.00 0.00 59.36 59.59 2or2 h GLU 287 Cb 1.14 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.77 2or2 h GLU 287 CO 0.12 0.54 -0.00 0.28 -1.16 0.00 0.00 179.01 178.79 2or2 h VAL 288 N 0.17 1.26 -0.73 3.13 2.07 -1.05 -2.56 116.25 118.53 2or2 h VAL 288 Ca 0.02 -0.89 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 2or2 h VAL 288 Cb 0.74 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 2or2 h VAL 288 CO 0.06 0.27 0.35 0.40 0.02 0.00 0.00 177.57 178.67 2or2 h ILE 289 N 0.14 1.23 0.00 4.57 2.04 -1.02 -2.34 117.51 122.13 2or2 h ILE 289 Ca 0.06 -0.67 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 2or2 h ILE 289 Cb 0.41 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 2or2 h ILE 289 CO 0.01 0.28 -0.07 0.03 0.00 0.00 0.00 178.15 178.40 2or2 h ARG 290 N 1.04 0.00 0.00 2.37 3.08 -1.06 -2.44 114.38 117.37 2or2 h ARG 290 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 2or2 h ARG 290 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2or2 h ARG 290 CO -0.03 0.07 0.00 0.00 -1.07 0.00 0.00 179.97 178.94 2or2 n ALA 291 N -2.16 2.04 0.62 0.04 0.00 -0.88 -1.99 120.51 118.18 2or2 n ALA 291 Ca -0.01 -0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.45 2or2 n ALA 291 Cb 0.27 -1.23 0.27 0.00 0.00 0.00 0.00 19.45 18.75 2or2 n ALA 291 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2or2 n ASN 292 N -0.99 2.81 -0.11 0.00 3.02 -0.92 -3.90 115.26 115.17 2or2 n ASN 292 Ca 0.11 -1.90 0.14 0.00 -0.03 0.00 0.00 54.58 52.89 2or2 n ASN 292 Cb 0.05 -0.21 0.51 0.00 -0.61 0.00 0.00 39.78 39.52 2or2 n ASN 292 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 2or2 h LYS 293 N 3.60 0.38 0.00 3.52 2.10 -1.63 -0.25 116.57 124.30 2or2 h LYS 293 Ca 0.00 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.61 2or2 h LYS 293 Cb 0.80 -0.09 -0.00 0.00 -0.90 0.00 0.00 32.23 32.04 2or2 h LYS 293 CO 0.00 0.25 -0.07 0.66 -2.00 0.00 0.00 179.45 178.29 2or2 h SER 294 N 0.39 0.00 1.21 7.07 4.64 -1.86 -2.60 113.55 122.40 2or2 h SER 294 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2or2 h SER 294 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2or2 h SER 294 CO -0.09 0.07 -0.34 -0.07 -0.87 0.00 0.00 176.83 175.53 2or2 h LEU 295 N 0.00 0.00 0.00 5.97 3.38 -1.36 -3.53 115.31 119.77 2or2 h LEU 295 Ca -0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2or2 h LEU 295 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2or2 h LEU 295 CO 0.01 0.05 0.00 -0.38 0.09 0.00 0.00 178.44 178.21