#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 1.18 -4.36 0.00 7.64 -1.26 -4.75 113.62 112.07 2or2 n SER 2 Ca 0.00 -0.20 -0.32 0.00 1.01 0.00 0.00 58.87 59.36 2or2 n SER 2 Cb 0.00 0.64 -0.15 0.00 -1.01 0.00 0.00 64.21 63.69 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 -0.87 3.47 0.25 6.43 0.15 -1.26 -4.98 113.70 116.89 2or2 s SER 3 Ca 0.00 -0.38 0.21 0.00 0.70 0.00 0.00 55.95 56.48 2or2 s SER 3 Cb 0.00 -0.80 0.98 0.00 -1.71 0.00 0.00 66.02 64.49 2or2 s SER 3 CO 0.00 0.29 1.65 1.33 1.20 0.00 0.00 173.24 177.71 2or2 n VAL 4 N 2.68 0.95 0.25 4.45 0.24 -1.26 -1.52 118.33 124.12 2or2 n VAL 4 Ca -0.17 0.40 0.09 0.00 -2.04 0.00 0.00 64.34 62.61 2or2 n VAL 4 Cb 0.52 -1.34 0.63 0.00 -1.47 0.00 0.00 33.84 32.17 2or2 n VAL 4 CO 0.00 0.00 0.00 -1.13 -2.14 0.00 0.00 176.83 173.56 2or2 h ASN 5 N 0.00 0.00 0.72 -1.34 -0.73 -2.00 -1.49 115.58 110.73 2or2 h ASN 5 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2or2 h ASN 5 Cb 0.23 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.82 2or2 h ASN 5 CO 0.00 0.12 0.00 -0.33 -0.37 0.00 0.00 177.43 176.85 2or2 h GLU 6 N 0.00 0.00 0.00 6.67 5.08 -1.68 -2.12 114.58 122.52 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 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2or2 h GLU 6 CO 0.02 0.00 0.00 -0.07 -1.00 0.00 0.00 179.01 177.96 2or2 h LEU 7 N 0.00 0.00 -0.17 1.33 3.38 -1.45 -2.58 115.31 115.82 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 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2or2 h LEU 7 CO 0.00 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.91 2or2 n GLU 8 N -2.81 0.11 -2.95 1.13 -0.58 -0.80 -4.41 120.64 110.33 2or2 n GLU 8 Ca 0.00 0.22 -0.44 0.00 -0.42 0.00 0.00 57.16 56.52 2or2 n GLU 8 Cb 0.22 -1.66 -0.04 0.00 -0.57 0.00 0.00 31.44 29.40 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 -3.65 6.31 0.61 1.62 3.84 -0.97 -4.89 114.94 117.80 2or2 s ASN 9 Ca 0.09 -1.42 0.30 0.00 0.21 0.00 0.00 52.86 52.04 2or2 s ASN 9 Cb 0.13 -2.38 1.69 0.00 -0.55 0.00 0.00 41.25 40.14 2or2 s ASN 9 CO 0.44 -1.24 2.06 -0.50 -2.79 0.00 0.00 177.10 175.08 2or2 h TRP 10 N 9.24 0.00 0.00 0.43 -0.00 -1.83 0.57 115.95 124.36 2or2 h TRP 10 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.72 2or2 h TRP 10 Cb 1.06 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.22 2or2 h TRP 10 CO 0.98 0.00 -0.45 0.43 -0.00 0.00 0.00 178.44 179.41 2or2 n SER 11 N -3.60 0.64 -1.45 -3.49 7.64 -1.26 -3.16 113.62 108.94 2or2 n SER 11 Ca 0.02 0.18 0.03 0.00 1.01 0.00 0.00 58.87 60.11 2or2 n SER 11 Cb 0.37 -0.05 0.02 0.00 -1.01 0.00 0.00 64.21 63.54 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 -2.00 0.00 0.33 1.43 5.02 -0.43 -4.85 118.16 117.66 2or2 n LYS 12 Ca 0.04 -1.93 0.22 0.00 -2.02 0.00 0.00 58.31 54.62 2or2 n LYS 12 Cb 0.42 0.01 1.13 0.00 -0.02 0.00 0.00 35.03 36.57 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 0.93 0.00 0.00 2.13 5.08 -1.12 -1.50 115.95 121.47 2or2 h TRP 13 Ca -0.24 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.73 2or2 h TRP 13 Cb 1.86 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 28.02 2or2 h TRP 13 CO 0.16 0.00 -0.11 -1.33 -1.28 0.00 0.00 178.44 175.88 2or2 n MET 14 N -3.08 0.08 -0.17 0.12 2.81 -1.26 -4.10 117.12 111.51 2or2 n MET 14 Ca -0.02 0.05 -0.01 0.00 -1.81 0.00 0.00 57.70 55.91 2or2 n MET 14 Cb 0.11 -1.58 0.08 0.00 -0.71 0.00 0.00 33.22 31.12 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 0.00 0.16 0.00 0.03 4.15 -1.48 -2.33 115.11 115.64 2or2 h GLN 15 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 2or2 h GLN 15 Cb 0.57 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.22 2or2 h GLN 15 CO 0.00 0.10 0.00 -0.35 -1.93 0.00 0.00 178.83 176.65 2or2 n PRO 16 N -5.20 0.37 -2.81 -2.39 -0.04 -1.26 -4.56 135.00 119.11 2or2 n PRO 16 Ca 0.07 0.03 -0.41 0.00 -0.04 0.00 0.00 63.50 63.15 2or2 n PRO 16 Cb 0.29 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.21 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 -2.59 4.75 0.24 0.52 1.01 -0.88 -4.63 121.20 119.62 2or2 s ILE 17 Ca 0.25 1.91 -0.31 0.00 0.00 0.00 0.00 60.65 62.50 2or2 s ILE 17 Cb 0.18 -4.25 -0.14 0.00 0.01 0.00 0.00 42.46 38.27 2or2 s ILE 17 CO 0.41 0.26 1.34 -2.65 0.00 0.00 0.00 174.94 174.31 2or2 n PRO 18 N 3.32 1.88 0.30 2.79 -0.02 -1.26 -4.88 135.00 137.13 2or2 n PRO 18 Ca 0.02 0.67 0.16 0.00 -2.02 0.00 0.00 63.50 62.34 2or2 n PRO 18 Cb 0.50 -2.28 0.92 0.00 -0.02 0.00 0.00 33.50 32.63 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 3.82 0.00 1.16 2.55 5.19 -1.94 -2.36 116.42 124.84 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 0.73 0.04 0.00 -0.46 -3.12 0.00 0.00 179.24 176.42 2or2 n ASN 20 N -3.56 0.54 -4.69 6.45 6.94 -1.26 -0.45 115.26 119.23 2or2 n ASN 20 Ca -0.02 0.57 -0.42 0.00 -0.02 0.00 0.00 54.58 54.68 2or2 n ASN 20 Cb 0.14 -0.71 -0.03 0.00 -2.36 0.00 0.00 39.78 36.82 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 -3.11 3.89 0.43 1.53 -1.09 -0.89 -4.80 121.20 117.16 2or2 s ILE 21 Ca 0.10 1.28 -0.25 0.00 -2.23 0.00 0.00 60.65 59.54 2or2 s ILE 21 Cb 0.13 -3.82 -0.08 0.00 -1.58 0.00 0.00 42.46 37.11 2or2 s ILE 21 CO 0.52 0.02 1.35 -2.84 -1.23 0.00 0.00 174.94 172.75 2or2 s PRO 22 N 2.10 3.82 0.41 2.79 0.02 -1.26 -1.33 135.00 141.55 2or2 s PRO 22 Ca 0.61 2.24 0.12 0.00 0.02 0.00 0.00 61.00 63.99 2or2 s PRO 22 Cb -0.29 -2.69 0.96 0.00 0.02 0.00 0.00 34.50 32.50 2or2 s PRO 22 CO 0.26 -0.64 1.95 -0.07 -0.33 0.00 0.00 177.00 178.16 2or2 h LEU 23 N 2.48 0.46 -1.66 -5.54 3.38 -1.28 -1.41 115.31 111.74 2or2 h LEU 23 Ca -0.50 0.02 0.10 0.00 0.09 0.00 0.00 57.88 57.59 2or2 h LEU 23 Cb 1.26 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.89 2or2 h LEU 23 CO 0.62 0.26 0.40 0.00 0.09 0.00 0.00 178.44 179.81 2or2 h ALA 24 N 1.65 2.04 0.02 1.53 0.00 -1.88 -2.07 119.26 120.55 2or2 h ALA 24 Ca 0.33 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 55.02 2or2 h ALA 24 Cb 0.60 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2or2 h ALA 24 CO -0.11 -0.18 -0.94 -0.09 0.00 0.00 0.00 179.25 177.93 2or2 h ARG 25 N 0.38 0.17 -7.00 0.00 9.65 -1.50 -3.42 114.38 112.68 2or2 h ARG 25 Ca 0.27 -0.22 -0.53 0.00 -1.10 0.00 0.00 59.98 58.41 2or2 h ARG 25 Cb 0.57 0.07 0.10 0.00 -1.39 0.00 0.00 29.97 29.31 2or2 h ARG 25 CO -0.07 0.99 0.59 0.42 2.80 0.00 0.00 179.97 184.69 2or2 s ILE 26 N -3.07 2.53 -0.31 1.20 1.01 -0.78 -4.86 121.20 116.92 2or2 s ILE 26 Ca -0.02 0.43 -0.20 0.00 0.00 0.00 0.00 60.65 60.86 2or2 s ILE 26 Cb 0.10 -3.23 -0.01 0.00 0.01 0.00 0.00 42.46 39.33 2or2 s ILE 26 CO 0.83 0.02 0.60 -0.44 0.00 0.00 0.00 174.94 175.95 2or2 s SER 27 N -0.95 6.46 -0.07 3.58 0.01 -1.26 -4.59 113.70 116.88 2or2 s SER 27 Ca 0.64 0.36 0.03 0.00 1.31 0.00 0.00 55.95 58.29 2or2 s SER 27 Cb -0.37 -2.31 0.01 0.00 0.21 0.00 0.00 66.02 63.55 2or2 s SER 27 CO 0.45 -0.46 -0.17 -0.63 0.41 0.00 0.00 173.24 172.85 2or2 s ILE 28 N 2.54 1.45 0.36 1.44 1.01 -0.80 -4.52 121.20 122.67 2or2 s ILE 28 Ca 0.24 -0.68 -0.24 0.00 0.00 0.00 0.00 60.65 59.97 2or2 s ILE 28 Cb -0.15 -1.28 -0.10 0.00 0.01 0.00 0.00 42.46 40.94 2or2 s ILE 28 CO 0.12 0.42 0.94 -2.84 0.00 0.00 0.00 174.94 173.58 2or2 s PRO 29 N 0.43 4.45 0.13 2.79 0.02 -1.26 -1.32 135.00 140.23 2or2 s PRO 29 Ca -0.13 1.23 -0.02 0.00 0.02 0.00 0.00 61.00 62.10 2or2 s PRO 29 Cb -0.15 -2.59 -0.04 0.00 0.02 0.00 0.00 34.50 31.74 2or2 s PRO 29 CO 0.05 0.18 0.08 0.20 -0.33 0.00 0.00 177.00 177.17 2or2 s GLY 30 N -1.82 0.88 -0.09 0.52 0.00 -0.37 -1.50 107.32 104.94 2or2 s GLY 30 Ca 0.54 -1.38 0.02 0.00 0.00 0.00 0.00 44.72 43.90 2or2 s GLY 30 CO 0.20 -1.30 -0.15 -0.51 0.00 0.00 0.00 173.10 171.34 2or2 s THR 31 N -4.03 2.94 0.12 0.90 -4.23 -0.66 -1.12 115.64 109.56 2or2 s THR 31 Ca 0.22 -0.73 -0.27 0.00 -1.18 0.00 0.00 61.69 59.72 2or2 s THR 31 Cb 0.07 -2.19 -0.07 0.00 1.34 0.00 0.00 72.50 71.66 2or2 s THR 31 CO 0.01 0.56 0.86 -2.28 -0.54 0.00 0.00 174.62 173.22 2or2 s HIS 32 N -0.15 3.83 -1.38 3.99 2.46 0.29 -2.70 115.29 121.63 2or2 s HIS 32 Ca -0.01 1.68 -0.07 0.00 0.47 0.00 0.00 55.06 57.12 2or2 s HIS 32 Cb -0.14 -2.91 0.00 0.00 -0.13 0.00 0.00 32.58 29.41 2or2 s HIS 32 CO 0.03 0.32 0.40 -3.47 -2.47 0.00 0.00 174.74 169.55 2or2 n ASP 33 N 2.39 -1.16 -0.36 9.88 -0.08 -1.24 -4.75 116.55 121.23 2or2 n ASP 33 Ca -0.01 -1.12 0.29 0.00 -1.51 0.00 0.00 54.79 52.44 2or2 n ASP 33 Cb 0.49 -2.55 0.55 0.00 2.34 0.00 0.00 41.12 41.95 2or2 n ASP 33 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2or2 h SER 34 N -1.94 0.40 -0.27 1.67 0.02 -1.59 -2.79 113.55 109.05 2or2 h SER 34 Ca -0.65 0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2or2 h SER 34 Cb 1.38 0.14 0.00 0.00 0.14 0.00 0.00 62.40 64.07 2or2 h SER 34 CO 0.61 -0.18 0.00 0.61 -1.14 0.00 0.00 176.83 176.73 2or2 n GLY 35 N -1.37 1.85 0.44 -3.77 0.00 -1.26 -4.25 105.19 96.83 2or2 n GLY 35 Ca 0.34 -0.40 0.08 0.00 0.00 0.00 0.00 46.02 46.04 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 0.22 0.26 2.61 -2.24 -1.05 -4.40 114.28 109.98 2or2 n THR 36 Ca 0.12 -0.29 0.11 0.00 -2.27 0.00 0.00 64.05 61.73 2or2 n THR 36 Cb 0.60 0.20 0.69 0.00 -2.10 0.00 0.00 70.33 69.72 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 1.63 0.00 0.00 4.78 -0.00 -1.74 -2.65 116.94 118.96 2or2 h PHE 37 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.97 57.92 2or2 h PHE 37 Cb 0.36 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.30 2or2 h PHE 37 CO 0.11 0.12 -0.26 0.87 -0.00 0.00 0.00 178.31 179.15 2or2 h LYS 38 N 0.00 0.00 -0.21 6.09 1.57 -1.83 -3.17 116.57 119.02 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 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2or2 h LYS 38 CO 0.02 0.26 0.00 1.28 -0.57 0.00 0.00 179.45 180.44 2or2 n LEU 39 N -3.30 2.64 -0.01 2.94 4.77 -1.09 -4.61 117.00 118.34 2or2 n LEU 39 Ca 0.01 -1.43 -0.10 0.00 -0.03 0.00 0.00 56.01 54.45 2or2 n LEU 39 Cb 0.51 -0.13 0.04 0.00 -2.33 0.00 0.00 43.42 41.51 2or2 n LEU 39 CO 0.35 0.57 0.47 -0.61 -1.33 0.00 0.00 177.39 176.85 2or2 h GLN 40 N 2.76 0.61 -6.43 3.23 -0.00 -1.45 -3.39 115.11 110.44 2or2 h GLN 40 Ca 0.00 -0.38 -0.61 0.00 -0.00 0.00 0.00 58.65 57.65 2or2 h GLN 40 Cb 0.69 0.04 0.05 0.00 0.00 0.00 0.00 27.48 28.27 2or2 h GLN 40 CO 0.00 1.00 0.71 -1.71 0.00 0.00 0.00 178.83 178.83 2or2 n ASN 41 N -3.97 2.68 0.02 -0.69 2.85 -1.26 -4.80 115.26 110.10 2or2 n ASN 41 Ca -0.03 1.09 0.22 0.00 -0.11 0.00 0.00 54.58 55.75 2or2 n ASN 41 Cb 0.61 -1.35 0.72 0.00 1.24 0.00 0.00 39.78 40.99 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 5.67 0.00 0.00 1.20 0.11 -1.94 0.18 132.00 137.22 2or2 h PRO 42 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 2or2 h PRO 42 Cb 1.28 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 2or2 h PRO 42 CO 0.86 0.00 -0.05 0.97 -0.21 0.00 0.00 178.00 179.57 2or2 h ILE 43 N 0.00 0.65 0.00 4.15 6.09 -1.94 -0.11 117.51 126.35 2or2 h ILE 43 Ca 0.26 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 63.55 2or2 h ILE 43 Cb 1.33 1.12 0.00 0.00 0.47 0.00 0.00 36.82 39.74 2or2 h ILE 43 CO -0.00 0.05 0.00 0.11 -3.07 0.00 0.00 178.15 175.23 2or2 h LYS 44 N 0.00 0.00 -6.33 2.19 1.79 -0.91 -3.47 116.57 109.83 2or2 h LYS 44 Ca -0.00 0.00 -0.47 0.00 -2.18 0.00 0.00 60.65 58.00 2or2 h LYS 44 Cb 0.12 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2or2 h LYS 44 CO 0.01 0.00 -0.86 1.04 -1.08 0.00 0.00 179.45 178.55 2or2 n GLN 45 N -2.47 -3.94 -5.10 3.15 6.02 -0.06 -4.99 117.38 110.00 2or2 n GLN 45 Ca 0.04 0.49 -0.31 0.00 -0.01 0.00 0.00 57.00 57.22 2or2 n GLN 45 Cb 0.40 -4.79 -0.17 0.00 1.02 0.00 0.00 30.24 26.70 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 -3.84 1.88 0.35 5.09 1.01 -1.26 -5.13 120.40 118.49 2or2 s VAL 46 Ca 0.01 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 61.00 2or2 s VAL 46 Cb -0.00 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.69 2or2 s VAL 46 CO 0.86 0.52 0.65 0.00 0.00 0.00 0.00 175.10 177.13 2or2 s ALA 47 N 0.37 3.51 0.00 5.51 0.00 -1.26 -4.41 121.76 125.48 2or2 s ALA 47 Ca -0.17 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.34 2or2 s ALA 47 Cb -0.17 -2.46 0.00 0.00 0.00 0.00 0.00 23.12 20.49 2or2 s ALA 47 CO 0.08 0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.35 2or2 n GLY 48 N -1.19 0.78 3.80 0.00 0.00 -1.26 -5.05 105.19 102.26 2or2 n GLY 48 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.30 3.10 0.00 1.61 1.00 -1.26 -5.00 119.30 118.45 2or2 s MET 49 Ca 0.00 1.13 0.00 0.00 0.00 0.00 0.00 55.69 56.82 2or2 s MET 49 Cb 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 34.83 32.82 2or2 s MET 49 CO 0.00 -0.98 0.13 0.25 0.00 0.00 0.00 175.02 174.42 2or2 n THR 50 N -2.50 0.00 -4.05 2.05 -2.24 -1.26 -4.73 114.28 101.56 2or2 n THR 50 Ca 0.08 -0.23 -0.14 0.00 -2.27 0.00 0.00 64.05 61.49 2or2 n THR 50 Cb 0.53 1.30 -0.14 0.00 -2.10 0.00 0.00 70.33 69.92 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 -0.20 0.27 0.08 -0.78 -1.52 -1.26 0.27 119.66 116.52 2or2 s GLN 51 Ca 0.00 -0.15 0.19 0.00 -1.95 0.00 0.00 55.36 53.45 2or2 s GLN 51 Cb 0.00 -0.24 -0.12 0.00 -0.22 0.00 0.00 33.01 32.42 2or2 s GLN 51 CO 0.00 0.07 0.82 0.39 -0.25 0.00 0.00 175.29 176.31 2or2 n GLU 52 N 2.90 0.62 -4.48 2.91 1.02 -1.26 -3.60 120.64 118.75 2or2 n GLU 52 Ca -0.13 0.15 -0.25 0.00 -0.02 0.00 0.00 57.16 56.91 2or2 n GLU 52 Cb 0.59 -1.78 -0.10 0.00 -0.02 0.00 0.00 31.44 30.13 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 -3.07 2.37 1.10 -0.32 2.02 -1.26 -4.92 117.35 113.26 2or2 s TYR 53 Ca -0.03 -0.39 -0.17 0.00 -0.37 0.00 0.00 57.07 56.11 2or2 s TYR 53 Cb 0.09 -1.18 0.24 0.00 -0.40 0.00 0.00 41.96 40.71 2or2 s TYR 53 CO 0.81 0.65 1.15 0.16 -1.57 0.00 0.00 175.55 176.75 2or2 s ASP 54 N -3.57 1.87 0.23 2.29 1.47 -1.26 -4.68 116.67 113.01 2or2 s ASP 54 Ca 0.31 0.68 -0.07 0.00 1.18 0.00 0.00 52.55 54.66 2or2 s ASP 54 Cb -0.02 -1.00 0.32 0.00 -0.34 0.00 0.00 42.92 41.88 2or2 s ASP 54 CO 0.16 -3.54 1.81 -0.26 0.68 0.00 0.00 175.17 174.02 2or2 h PHE 55 N -2.19 0.80 -0.51 2.11 0.04 -2.00 -1.63 116.94 113.56 2or2 h PHE 55 Ca -0.47 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.25 2or2 h PHE 55 Cb 1.29 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 39.18 2or2 h PHE 55 CO -1.30 0.36 0.01 -0.09 -0.60 0.00 0.00 178.31 176.68 2or2 h ARG 56 N 0.77 0.86 -0.37 1.51 9.65 -1.93 0.33 114.38 125.21 2or2 h ARG 56 Ca 0.35 -0.24 -0.02 0.00 -1.10 0.00 0.00 59.98 58.97 2or2 h ARG 56 Cb 0.26 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.72 2or2 h ARG 56 CO -0.21 0.86 0.15 -0.92 2.80 0.00 0.00 179.97 182.65 2or2 h TYR 57 N 0.80 0.56 -0.32 2.20 5.03 -1.78 0.31 116.97 123.77 2or2 h TYR 57 Ca 0.15 -0.04 0.03 0.00 2.58 0.00 0.00 58.73 61.45 2or2 h TYR 57 Cb 0.47 -0.17 -0.03 0.00 1.55 0.00 0.00 36.73 38.55 2or2 h TYR 57 CO 0.03 0.50 0.13 1.96 -1.32 0.00 0.00 178.16 179.46 2or2 h GLN 58 N 0.45 0.28 -0.49 1.82 4.20 -0.82 -1.54 115.11 119.01 2or2 h GLN 58 Ca 0.12 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 2or2 h GLN 58 Cb 0.18 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 2or2 h GLN 58 CO -0.01 0.19 0.13 0.52 -0.67 0.00 0.00 178.83 178.99 2or2 h MET 59 N 0.29 0.77 0.00 1.46 2.86 -0.63 -2.03 114.93 117.66 2or2 h MET 59 Ca 0.14 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2or2 h MET 59 Cb 0.08 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.63 2or2 h MET 59 CO -0.12 0.74 0.00 -0.25 1.06 0.00 0.00 176.91 178.35 2or2 n ASP 60 N -4.48 0.14 -1.16 1.22 8.00 0.11 -1.39 116.55 118.99 2or2 n ASP 60 Ca 0.01 0.54 0.10 0.00 0.71 0.00 0.00 54.79 56.16 2or2 n ASP 60 Cb 0.21 -0.57 0.27 0.00 -0.02 0.00 0.00 41.12 41.01 2or2 n ASP 60 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2or2 n HIS 61 N -1.66 0.78 0.00 1.24 8.25 -0.61 -4.08 115.22 119.13 2or2 n HIS 61 Ca 0.02 -0.45 0.00 0.00 -0.26 0.00 0.00 57.72 57.03 2or2 n HIS 61 Cb 0.14 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.24 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 1.37 1.47 3.74 -1.41 0.00 -0.49 -4.79 105.19 105.08 2or2 n GLY 62 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.25 3.58 0.00 4.61 0.00 -0.82 -4.50 121.76 122.38 2or2 s ALA 63 Ca 0.00 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.18 2or2 s ALA 63 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.60 2or2 s ALA 63 CO 0.00 -0.64 0.00 0.54 0.00 0.00 0.00 175.76 175.66 2or2 n ARG 64 N 2.48 4.57 -4.61 0.00 5.12 -0.56 -4.26 116.66 119.40 2or2 n ARG 64 Ca 0.06 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.65 2or2 n ARG 64 Cb 0.41 -0.38 -0.13 0.00 -1.16 0.00 0.00 32.46 31.20 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 -0.73 3.46 -0.09 0.55 1.01 -1.09 0.30 121.20 124.60 2or2 s ILE 65 Ca 0.00 -0.52 0.02 0.00 0.00 0.00 0.00 60.65 60.15 2or2 s ILE 65 Cb 0.00 -2.48 0.01 0.00 0.01 0.00 0.00 42.46 40.00 2or2 s ILE 65 CO 0.00 0.51 -0.15 -0.36 0.00 0.00 0.00 174.94 174.94 2or2 s PHE 66 N 0.29 1.90 -0.95 3.97 0.40 -0.07 -1.66 117.98 121.85 2or2 s PHE 66 Ca -0.07 -0.83 -0.17 0.00 -0.60 0.00 0.00 56.93 55.26 2or2 s PHE 66 Cb -0.15 -1.36 0.15 0.00 0.51 0.00 0.00 43.02 42.18 2or2 s PHE 66 CO 0.04 -0.41 1.11 0.34 0.70 0.00 0.00 175.22 177.00 2or2 s ASP 67 N 0.82 6.72 -0.18 1.36 2.15 -1.10 -0.52 116.67 125.91 2or2 s ASP 67 Ca -0.10 -2.29 -0.17 0.00 0.43 0.00 0.00 52.55 50.42 2or2 s ASP 67 Cb -0.16 -2.37 -0.04 0.00 -0.30 0.00 0.00 42.92 40.06 2or2 s ASP 67 CO 0.01 -0.94 0.43 -0.63 -0.17 0.00 0.00 175.17 173.88 2or2 s ILE 68 N 2.09 5.18 -0.25 4.11 -1.09 -0.11 -2.39 121.20 128.74 2or2 s ILE 68 Ca 0.32 0.80 -0.01 0.00 -2.23 0.00 0.00 60.65 59.52 2or2 s ILE 68 Cb -0.05 -3.76 0.03 0.00 -1.58 0.00 0.00 42.46 37.10 2or2 s ILE 68 CO -0.08 0.26 -0.07 -0.13 -1.23 0.00 0.00 174.94 173.68 2or2 s ARG 69 N 1.21 2.71 0.42 2.79 1.81 -1.26 -1.50 118.95 125.13 2or2 s ARG 69 Ca 0.21 -1.05 0.07 0.00 -1.72 0.00 0.00 55.73 53.23 2or2 s ARG 69 Cb -0.15 -2.97 -0.06 0.00 -0.45 0.00 0.00 34.95 31.32 2or2 s ARG 69 CO 0.08 -0.44 0.08 0.20 -0.68 0.00 0.00 175.30 174.55 2or2 s GLY 70 N 1.28 2.48 -0.06 -3.53 0.00 -0.22 -1.16 107.32 106.12 2or2 s GLY 70 Ca -0.01 -2.08 -0.05 0.00 0.00 0.00 0.00 44.72 42.58 2or2 s GLY 70 CO -0.05 -2.04 0.15 -1.60 0.00 0.00 0.00 173.10 169.57 2or2 s ARG 71 N -3.80 0.16 0.05 2.90 3.52 0.26 -0.43 118.95 121.60 2or2 s ARG 71 Ca 0.35 0.26 -0.29 0.00 -0.13 0.00 0.00 55.73 55.92 2or2 s ARG 71 Cb 0.07 0.02 -0.05 0.00 -1.56 0.00 0.00 34.95 33.43 2or2 s ARG 71 CO 0.19 -0.06 0.92 -1.17 -0.81 0.00 0.00 175.30 174.37 2or2 s LEU 72 N 0.36 4.43 0.48 -0.88 2.96 -1.26 -1.64 118.68 123.14 2or2 s LEU 72 Ca -0.02 1.65 0.08 0.00 -0.22 0.00 0.00 54.13 55.62 2or2 s LEU 72 Cb -0.04 -3.49 0.04 0.00 0.50 0.00 0.00 46.19 43.20 2or2 s LEU 72 CO -0.01 -0.12 0.66 0.42 -1.32 0.00 0.00 176.35 175.97 2or2 s THR 73 N 0.39 2.71 -0.57 3.68 -4.23 -0.24 -1.50 115.64 115.88 2or2 s THR 73 Ca 0.47 -0.97 0.24 0.00 -1.18 0.00 0.00 61.69 60.25 2or2 s THR 73 Cb -0.22 -2.74 0.26 0.00 1.34 0.00 0.00 72.50 71.14 2or2 s THR 73 CO 0.27 0.00 1.73 -0.90 -0.54 0.00 0.00 174.62 175.19 2or2 n ASP 74 N -2.02 0.71 -1.27 3.99 5.75 -1.26 -2.01 116.55 120.44 2or2 n ASP 74 Ca 0.10 0.64 0.07 0.00 -0.01 0.00 0.00 54.79 55.59 2or2 n ASP 74 Cb 0.60 -0.80 0.27 0.00 -1.03 0.00 0.00 41.12 40.16 2or2 n ASP 74 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2or2 n ASP 75 N -2.24 3.73 -3.69 -1.12 10.43 -1.26 -4.62 116.55 117.78 2or2 n ASP 75 Ca 0.03 -2.34 -0.23 0.00 2.57 0.00 0.00 54.79 54.83 2or2 n ASP 75 Cb 0.30 -0.50 0.05 0.00 1.84 0.00 0.00 41.12 42.80 2or2 n ASP 75 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 2or2 n ASN 76 N 0.80 -2.45 -4.28 -2.24 3.02 -0.85 -5.01 115.26 104.24 2or2 n ASN 76 Ca 0.20 -0.75 -0.16 0.00 -0.03 0.00 0.00 54.58 53.84 2or2 n ASN 76 Cb 0.71 -4.29 -0.10 0.00 -0.61 0.00 0.00 39.78 35.48 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 -3.52 1.26 -0.22 3.41 -4.23 -1.26 -4.94 115.64 106.14 2or2 s THR 77 Ca 0.18 -2.09 -0.03 0.00 -1.18 0.00 0.00 61.69 58.57 2or2 s THR 77 Cb -0.09 -1.97 0.00 0.00 1.34 0.00 0.00 72.50 71.78 2or2 s THR 77 CO 0.79 -0.64 -0.06 -0.63 -0.54 0.00 0.00 174.62 173.54 2or2 s ILE 78 N -3.27 3.15 0.24 2.99 1.01 -1.26 -1.08 121.20 122.97 2or2 s ILE 78 Ca 0.20 -0.63 0.09 0.00 0.00 0.00 0.00 60.65 60.31 2or2 s ILE 78 Cb 0.02 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 2or2 s ILE 78 CO 0.03 0.40 -0.00 0.68 0.00 0.00 0.00 174.94 176.05 2or2 s VAL 79 N 1.43 3.53 0.16 2.92 -7.23 -0.65 -1.32 120.40 119.24 2or2 s VAL 79 Ca 0.05 -1.76 -0.26 0.00 -1.81 0.00 0.00 61.98 58.20 2or2 s VAL 79 Cb -0.14 -2.85 -0.08 0.00 0.56 0.00 0.00 36.38 33.87 2or2 s VAL 79 CO -0.05 -0.29 0.80 -0.76 -0.31 0.00 0.00 175.10 174.49 2or2 s LEU 80 N -3.44 4.59 0.19 1.32 1.43 0.23 -0.58 118.68 122.43 2or2 s LEU 80 Ca 0.30 1.67 0.02 0.00 -1.03 0.00 0.00 54.13 55.09 2or2 s LEU 80 Cb -0.07 -3.33 -0.05 0.00 0.03 0.00 0.00 46.19 42.77 2or2 s LEU 80 CO 0.19 0.18 0.01 -1.00 0.23 0.00 0.00 176.35 175.96 2or2 s HIS 81 N -1.02 1.31 -0.36 0.29 3.76 -0.30 -1.81 115.29 117.15 2or2 s HIS 81 Ca 0.37 -1.01 0.00 0.00 -0.15 0.00 0.00 55.06 54.27 2or2 s HIS 81 Cb -0.23 -0.75 0.13 0.00 1.11 0.00 0.00 32.58 32.84 2or2 s HIS 81 CO 0.27 -0.19 0.20 -1.58 -0.85 0.00 0.00 174.74 172.59 2or2 s HIS 82 N -3.62 1.02 0.00 1.40 2.46 -0.31 -4.66 115.29 111.57 2or2 s HIS 82 Ca 0.26 -1.73 0.00 0.00 0.47 0.00 0.00 55.06 54.06 2or2 s HIS 82 Cb 0.06 -1.18 0.00 0.00 -0.13 0.00 0.00 32.58 31.33 2or2 s HIS 82 CO 0.06 -0.82 0.00 0.41 -2.47 0.00 0.00 174.74 171.91 2or2 n GLY 83 N 4.11 2.15 0.05 1.59 0.00 -1.26 -1.81 105.19 110.01 2or2 n GLY 83 Ca 0.08 -0.44 0.15 0.00 0.00 0.00 0.00 46.02 45.81 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 13.20 0.62 -2.85 1.61 -0.04 -1.26 -4.61 135.00 141.66 2or2 n PRO 84 Ca 0.00 -0.10 -0.41 0.00 -0.04 0.00 0.00 63.50 62.95 2or2 n PRO 84 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.93 2or2 n PRO 84 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2or2 s LEU 85 N -2.45 4.32 0.02 1.53 1.43 -0.75 -5.04 118.68 117.74 2or2 s LEU 85 Ca 0.31 1.43 -0.30 0.00 -1.03 0.00 0.00 54.13 54.54 2or2 s LEU 85 Cb 0.20 -3.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.03 2or2 s LEU 85 CO 0.45 -0.24 1.01 -0.47 0.23 0.00 0.00 176.35 177.33 2or2 s TYR 86 N 1.13 3.65 -2.33 0.29 5.04 -1.26 -1.17 117.35 122.71 2or2 s TYR 86 Ca 0.45 1.66 0.27 0.00 -2.44 0.00 0.00 57.07 57.01 2or2 s TYR 86 Cb -0.19 -3.15 0.80 0.00 0.35 0.00 0.00 41.96 39.77 2or2 s TYR 86 CO 0.22 -0.15 1.60 1.28 -1.34 0.00 0.00 175.55 177.16 2or2 n LEU 87 N 3.74 1.58 -2.22 6.97 4.77 -0.75 -4.94 117.00 126.16 2or2 n LEU 87 Ca 0.06 -0.51 -0.18 0.00 -0.03 0.00 0.00 56.01 55.35 2or2 n LEU 87 Cb 0.50 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2or2 n LEU 87 CO 0.52 0.27 -0.16 -1.22 -1.33 0.00 0.00 177.39 175.47 2or2 n TYR 88 N 0.08 -1.11 -3.99 -1.77 4.02 -1.26 -4.66 117.16 108.46 2or2 n TYR 88 Ca 0.16 0.14 -0.14 0.00 -0.01 0.00 0.00 57.90 58.05 2or2 n TYR 88 Cb 0.39 -3.70 -0.14 0.00 -0.02 0.00 0.00 39.34 35.87 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 -2.96 0.18 0.36 -0.72 1.01 -1.26 -5.04 120.40 111.98 2or2 s VAL 89 Ca 0.08 -0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.04 2or2 s VAL 89 Cb -0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.15 2or2 s VAL 89 CO 0.10 0.05 0.21 0.42 0.00 0.00 0.00 175.10 175.88 2or2 s THR 90 N -0.03 2.95 0.19 3.92 -4.23 -1.26 -0.60 115.64 116.57 2or2 s THR 90 Ca 0.01 -1.58 -0.09 0.00 -1.18 0.00 0.00 61.69 58.85 2or2 s THR 90 Cb -0.01 -3.02 0.07 0.00 1.34 0.00 0.00 72.50 70.88 2or2 s THR 90 CO -0.00 -0.12 1.65 0.25 -0.54 0.00 0.00 174.62 175.86 2or2 h LEU 91 N 1.39 1.05 -1.22 4.79 5.85 -1.52 -2.46 115.31 123.19 2or2 h LEU 91 Ca -0.43 -0.29 0.01 0.00 0.84 0.00 0.00 57.88 58.00 2or2 h LEU 91 Cb 1.25 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 2or2 h LEU 91 CO 0.62 1.09 0.51 0.45 -0.34 0.00 0.00 178.44 180.78 2or2 h HIS 92 N 0.98 0.99 -0.23 1.25 3.86 -1.96 -0.75 115.15 119.28 2or2 h HIS 92 Ca 0.18 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.42 2or2 h HIS 92 Cb 0.54 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.67 2or2 h HIS 92 CO 0.04 0.63 0.13 1.49 0.86 0.00 0.00 177.93 181.08 2or2 h GLU 93 N 1.06 0.27 -0.16 2.45 4.81 -1.84 0.25 114.58 121.42 2or2 h GLU 93 Ca 0.29 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 2or2 h GLU 93 Cb -0.12 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 2or2 h GLU 93 CO -0.06 0.18 0.05 0.35 -0.73 0.00 0.00 179.01 178.80 2or2 h PHE 94 N 0.28 0.26 -0.78 0.92 3.57 -1.08 -2.48 116.94 117.63 2or2 h PHE 94 Ca 0.09 -0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.62 2or2 h PHE 94 Cb -0.00 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.61 2or2 h PHE 94 CO -0.08 0.37 0.47 0.82 -2.23 0.00 0.00 178.31 177.66 2or2 h ILE 95 N 0.08 1.04 -0.55 1.41 2.04 -0.88 -0.56 117.51 120.08 2or2 h ILE 95 Ca 0.05 -0.30 -0.06 0.00 1.00 0.00 0.00 64.86 65.55 2or2 h ILE 95 Cb 0.23 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 2or2 h ILE 95 CO -0.00 0.16 0.10 0.78 0.00 0.00 0.00 178.15 179.19 2or2 h ASN 96 N 0.88 0.82 -0.54 1.72 2.35 -0.85 0.13 115.58 120.08 2or2 h ASN 96 Ca 0.34 -0.17 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 2or2 h ASN 96 Cb 0.14 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 2or2 h ASN 96 CO -0.16 0.82 0.03 -0.33 -1.65 0.00 0.00 177.43 176.14 2or2 h GLU 97 N 0.83 0.93 -0.53 0.81 4.39 -0.88 -1.14 114.58 118.99 2or2 h GLU 97 Ca 0.17 -0.28 -0.09 0.00 0.34 0.00 0.00 59.36 59.50 2or2 h GLU 97 Cb 0.35 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 2or2 h GLU 97 CO 0.01 0.93 -0.03 0.00 -1.16 0.00 0.00 179.01 178.76 2or2 h ALA 98 N 0.96 0.95 -0.46 3.43 0.00 -0.71 -1.65 119.26 121.78 2or2 h ALA 98 Ca 0.16 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2or2 h ALA 98 Cb 0.49 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2or2 h ALA 98 CO 0.02 0.63 0.22 0.87 0.00 0.00 0.00 179.25 180.99 2or2 h LYS 99 N 0.84 0.67 -0.56 0.00 1.57 -0.41 -0.72 116.57 117.97 2or2 h LYS 99 Ca 0.15 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 2or2 h LYS 99 Cb 0.54 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 2or2 h LYS 99 CO 0.03 0.57 0.04 0.37 -0.57 0.00 0.00 179.45 179.89 2or2 h GLN 100 N 0.60 0.96 -0.55 3.15 5.75 -1.05 -0.89 115.11 123.07 2or2 h GLN 100 Ca 0.16 -0.29 -0.00 0.00 -0.15 0.00 0.00 58.65 58.37 2or2 h GLN 100 Cb 0.13 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.55 2or2 h GLN 100 CO -0.02 0.94 0.34 0.35 -2.65 0.00 0.00 178.83 177.79 2or2 h PHE 101 N 0.84 0.72 -0.09 3.99 3.57 -1.08 -0.61 116.94 124.29 2or2 h PHE 101 Ca 0.16 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 2or2 h PHE 101 Cb 0.49 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2or2 h PHE 101 CO 0.04 0.49 -0.34 -0.07 -2.23 0.00 0.00 178.31 176.20 2or2 h LEU 102 N 0.74 0.18 -0.26 0.59 3.38 -0.94 0.24 115.31 119.24 2or2 h LEU 102 Ca 0.20 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 2or2 h LEU 102 Cb -0.02 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2or2 h LEU 102 CO -0.04 0.51 -0.15 0.50 0.09 0.00 0.00 178.44 179.36 2or2 h LYS 103 N 0.15 0.55 -0.02 1.13 3.64 -0.69 -1.58 116.57 119.75 2or2 h LYS 103 Ca 0.02 -0.25 -0.15 0.00 -1.27 0.00 0.00 60.65 59.00 2or2 h LYS 103 Cb 0.68 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 2or2 h LYS 103 CO 0.05 0.82 -0.65 -0.44 -2.27 0.00 0.00 179.45 176.96 2or2 h ASP 104 N 0.28 0.12 -2.08 4.20 3.32 -0.84 -3.36 116.42 118.06 2or2 h ASP 104 Ca 0.05 -0.08 -0.58 0.00 0.02 0.00 0.00 57.03 56.45 2or2 h ASP 104 Cb 0.67 -0.04 -0.40 0.00 0.22 0.00 0.00 39.33 39.78 2or2 h ASP 104 CO 0.04 0.74 -0.89 0.59 -1.72 0.00 0.00 179.24 178.00 2or2 n ASN 105 N -3.80 1.71 0.09 6.45 3.02 0.81 -4.96 115.26 118.58 2or2 n ASN 105 Ca -0.02 -3.02 0.05 0.00 -0.03 0.00 0.00 54.58 51.57 2or2 n ASN 105 Cb 0.65 -0.65 0.28 0.00 -0.61 0.00 0.00 39.78 39.44 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 1.14 0.07 0.23 3.52 -0.04 -0.60 -1.58 135.00 137.73 2or2 n PRO 106 Ca 0.25 0.53 0.14 0.00 -0.04 0.00 0.00 63.50 64.37 2or2 n PRO 106 Cb 0.48 -1.82 0.39 0.00 -0.04 0.00 0.00 33.50 32.51 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 -2.30 3.54 4.64 -1.93 -3.07 113.55 114.42 2or2 h SER 107 Ca 0.00 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.88 2or2 h SER 107 Cb 0.21 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.34 2or2 h SER 107 CO 0.00 0.00 -0.05 -1.61 -0.87 0.00 0.00 176.83 174.30 2or2 s GLU 108 N -3.37 2.50 0.08 4.77 0.41 -0.61 -4.44 118.70 118.04 2or2 s GLU 108 Ca 0.05 -0.89 0.03 0.00 -0.41 0.00 0.00 54.97 53.75 2or2 s GLU 108 Cb 0.07 -2.51 -0.03 0.00 -1.78 0.00 0.00 34.13 29.88 2or2 s GLU 108 CO 0.60 -0.73 -0.09 -0.08 -0.49 0.00 0.00 175.26 174.48 2or2 s THR 109 N -2.74 0.76 -0.14 3.63 -1.32 -1.26 -0.15 115.64 114.42 2or2 s THR 109 Ca 0.58 -1.52 0.02 0.00 -1.21 0.00 0.00 61.69 59.56 2or2 s THR 109 Cb -0.10 -1.19 0.01 0.00 -1.51 0.00 0.00 72.50 69.71 2or2 s THR 109 CO 0.38 -0.57 -0.21 -0.63 -2.21 0.00 0.00 174.62 171.38 2or2 s ILE 110 N -2.36 2.11 -0.31 5.08 -1.09 -1.02 -4.84 121.20 118.78 2or2 s ILE 110 Ca 0.02 -0.96 -0.11 0.00 -2.23 0.00 0.00 60.65 57.36 2or2 s ILE 110 Cb -0.03 -1.85 -0.03 0.00 -1.58 0.00 0.00 42.46 38.97 2or2 s ILE 110 CO -0.01 0.55 0.20 -0.63 -1.23 0.00 0.00 174.94 173.82 2or2 s ILE 111 N 0.83 5.17 -0.37 2.92 1.01 0.15 0.25 121.20 131.15 2or2 s ILE 111 Ca -0.07 -0.09 -0.08 0.00 0.00 0.00 0.00 60.65 60.42 2or2 s ILE 111 Cb -0.15 -3.57 0.06 0.00 0.01 0.00 0.00 42.46 38.81 2or2 s ILE 111 CO -0.02 0.12 0.18 -0.32 0.00 0.00 0.00 174.94 174.89 2or2 s MET 112 N 1.72 2.60 -0.06 2.79 1.75 0.54 -0.90 119.30 127.75 2or2 s MET 112 Ca 0.06 -1.30 -0.28 0.00 -1.25 0.00 0.00 55.69 52.92 2or2 s MET 112 Cb -0.17 -3.61 -0.02 0.00 2.84 0.00 0.00 34.83 33.87 2or2 s MET 112 CO 0.10 -0.79 0.94 0.45 -0.65 0.00 0.00 175.02 175.06 2or2 s SER 113 N 1.69 7.23 -0.14 1.11 0.15 0.32 -1.29 113.70 122.78 2or2 s SER 113 Ca 0.01 1.50 0.01 0.00 0.70 0.00 0.00 55.95 58.17 2or2 s SER 113 Cb -0.21 -2.53 0.02 0.00 -1.71 0.00 0.00 66.02 61.59 2or2 s SER 113 CO 0.03 -0.32 -0.15 -0.22 1.20 0.00 0.00 173.24 173.78 2or2 s LEU 114 N 1.43 1.70 0.08 3.45 2.96 -0.76 -0.93 118.68 126.61 2or2 s LEU 114 Ca 0.47 -0.48 0.08 0.00 -0.22 0.00 0.00 54.13 53.99 2or2 s LEU 114 Cb -0.19 -1.17 -0.03 0.00 0.50 0.00 0.00 46.19 45.30 2or2 s LEU 114 CO 0.22 -0.04 -0.22 -0.75 -1.32 0.00 0.00 176.35 174.24 2or2 s LYS 115 N 1.37 1.31 -0.63 1.98 2.20 -0.56 -1.10 119.74 124.31 2or2 s LYS 115 Ca 0.02 -1.11 -0.26 0.00 -0.36 0.00 0.00 55.97 54.26 2or2 s LYS 115 Cb -0.13 -1.56 0.04 0.00 -1.51 0.00 0.00 37.83 34.67 2or2 s LYS 115 CO -0.09 0.38 1.13 0.21 -0.36 0.00 0.00 175.35 176.62 2or2 s LYS 116 N -1.63 3.33 0.16 4.03 2.20 -1.26 -1.06 119.74 125.50 2or2 s LYS 116 Ca 0.08 -0.15 0.01 0.00 -0.36 0.00 0.00 55.97 55.56 2or2 s LYS 116 Cb -0.10 -4.10 -0.03 0.00 -1.51 0.00 0.00 37.83 32.10 2or2 s LYS 116 CO 0.03 -1.79 1.36 1.49 -0.36 0.00 0.00 175.35 176.09 2or2 h GLU 117 N 9.63 0.23 -3.08 4.03 4.57 -1.05 -3.47 114.58 125.44 2or2 h GLU 117 Ca -0.27 -0.26 -0.13 0.00 -1.18 0.00 0.00 59.36 57.53 2or2 h GLU 117 Cb 1.06 0.07 -0.21 0.00 -0.16 0.00 0.00 28.75 29.51 2or2 h GLU 117 CO 1.19 0.98 -0.31 -0.47 -1.18 0.00 0.00 179.01 179.22 2or2 s TYR 118 N -3.20 -0.19 0.47 0.92 5.04 -1.24 -4.53 117.35 114.62 2or2 s TYR 118 Ca -0.03 0.33 -0.22 0.00 -2.44 0.00 0.00 57.07 54.70 2or2 s TYR 118 Cb 0.10 0.08 -0.10 0.00 0.35 0.00 0.00 41.96 42.39 2or2 s TYR 118 CO 0.84 -0.34 0.78 -1.91 -1.34 0.00 0.00 175.55 173.57 2or2 n GLU 119 N 1.59 0.90 -1.52 4.97 4.07 -1.26 -4.60 120.64 124.79 2or2 n GLU 119 Ca -0.20 0.33 -0.36 0.00 -0.06 0.00 0.00 57.16 56.87 2or2 n GLU 119 Cb 0.56 -1.83 0.09 0.00 -0.06 0.00 0.00 31.44 30.20 2or2 n GLU 119 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2or2 n ASP 120 N 0.59 1.67 -4.73 4.31 8.00 -1.26 -4.75 116.55 120.36 2or2 n ASP 120 Ca 0.11 0.75 -0.41 0.00 0.71 0.00 0.00 54.79 55.95 2or2 n ASP 120 Cb 0.42 -1.53 -0.04 0.00 -0.02 0.00 0.00 41.12 39.94 2or2 n ASP 120 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2or2 s MET 121 N -3.59 4.59 0.54 -1.24 -1.94 -0.56 -4.98 119.30 112.12 2or2 s MET 121 Ca 0.79 1.68 -0.22 0.00 -1.71 0.00 0.00 55.69 56.23 2or2 s MET 121 Cb -0.35 -3.30 -0.05 0.00 2.01 0.00 0.00 34.83 33.13 2or2 s MET 121 CO 0.44 0.06 1.35 1.63 -0.01 0.00 0.00 175.02 178.49 2or2 n LYS 122 N 2.60 1.71 -0.11 2.03 4.76 -1.26 -3.28 118.16 124.61 2or2 n LYS 122 Ca 0.03 0.63 0.00 0.00 -2.87 0.00 0.00 58.31 56.10 2or2 n LYS 122 Cb 0.47 -2.56 0.00 0.00 -1.84 0.00 0.00 35.03 31.10 2or2 n LYS 122 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2or2 n GLY 123 N 0.76 0.80 3.78 0.72 0.00 -1.26 -4.68 105.19 105.31 2or2 n GLY 123 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.09 3.37 0.02 4.61 0.00 -1.20 -4.84 121.76 121.64 2or2 s ALA 124 Ca 0.00 0.38 -0.09 0.00 0.00 0.00 0.00 51.96 52.26 2or2 s ALA 124 Cb 0.00 -3.01 -0.04 0.00 0.00 0.00 0.00 23.12 20.07 2or2 s ALA 124 CO 0.00 0.26 1.14 0.93 0.00 0.00 0.00 175.76 178.09 2or2 h GLU 125 N 3.82 -0.21 0.00 0.00 4.39 -1.88 -3.46 114.58 117.24 2or2 h GLU 125 Ca -0.47 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.24 2or2 h GLU 125 Cb 1.20 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 2or2 h GLU 125 CO 0.66 -0.14 0.00 0.41 -1.16 0.00 0.00 179.01 178.78 2or2 n GLY 126 N -1.13 3.42 3.86 -3.84 0.00 -1.26 -5.15 105.19 101.09 2or2 n GLY 126 Ca -0.02 -1.72 -0.26 0.00 0.00 0.00 0.00 46.02 44.02 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 -0.07 4.60 0.09 1.61 1.04 -1.26 -4.94 113.70 114.76 2or2 s SER 127 Ca 0.00 -1.20 -0.24 0.00 0.48 0.00 0.00 55.95 54.98 2or2 s SER 127 Cb 0.00 0.19 -0.14 0.00 0.10 0.00 0.00 66.02 66.16 2or2 s SER 127 CO 0.00 -0.95 1.72 0.15 0.98 0.00 0.00 173.24 175.14 2or2 h PHE 128 N 0.93 -0.15 -0.50 5.02 3.04 -1.98 0.18 116.94 123.47 2or2 h PHE 128 Ca -0.39 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.52 2or2 h PHE 128 Cb 1.29 0.06 -0.02 0.00 2.56 0.00 0.00 35.95 39.84 2or2 h PHE 128 CO 0.93 -0.09 0.14 0.66 -2.02 0.00 0.00 178.31 177.92 2or2 h SER 129 N -0.15 0.74 -0.56 0.41 4.64 -1.92 -0.61 113.55 116.10 2or2 h SER 129 Ca -0.00 -0.22 -0.11 0.00 -0.47 0.00 0.00 61.79 60.99 2or2 h SER 129 Cb 0.13 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 2or2 h SER 129 CO 0.00 0.77 -0.07 0.77 -0.87 0.00 0.00 176.83 177.43 2or2 h SER 130 N 0.68 1.03 -0.27 4.97 4.64 -1.85 -1.20 113.55 121.55 2or2 h SER 130 Ca 0.16 -0.32 -0.07 0.00 -0.47 0.00 0.00 61.79 61.09 2or2 h SER 130 Cb 0.30 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 2or2 h SER 130 CO -0.00 1.12 -0.09 0.74 -0.87 0.00 0.00 176.83 177.72 2or2 h THR 131 N 0.93 1.29 -0.06 2.95 2.02 -0.87 -0.76 112.91 118.41 2or2 h THR 131 Ca 0.15 -1.15 0.00 0.00 0.77 0.00 0.00 66.41 66.19 2or2 h THR 131 Cb 0.63 1.48 -0.00 0.00 -1.74 0.00 0.00 68.15 68.52 2or2 h THR 131 CO 0.04 0.36 0.04 0.15 0.37 0.00 0.00 175.52 176.48 2or2 h PHE 132 N 0.28 0.08 -0.34 3.16 3.57 -1.01 0.22 116.94 122.90 2or2 h PHE 132 Ca 0.06 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.48 2or2 h PHE 132 Cb 0.59 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.28 2or2 h PHE 132 CO 0.06 0.07 -0.17 0.93 -2.23 0.00 0.00 178.31 176.97 2or2 h GLU 133 N 0.06 0.61 0.14 1.11 5.08 -1.20 0.85 114.58 121.23 2or2 h GLU 133 Ca 0.02 -0.21 -0.25 0.00 -1.00 0.00 0.00 59.36 57.93 2or2 h GLU 133 Cb 0.02 -0.05 0.03 0.00 0.50 0.00 0.00 28.75 29.24 2or2 h GLU 133 CO -0.00 0.75 -1.06 -0.22 -1.00 0.00 0.00 179.01 177.47 2or2 h LYS 134 N 0.55 0.47 -0.00 2.33 3.64 -1.00 -2.84 116.57 119.73 2or2 h LYS 134 Ca 0.09 -0.70 0.00 0.00 -1.27 0.00 0.00 60.65 58.78 2or2 h LYS 134 Cb 0.60 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 2or2 h LYS 134 CO 0.04 1.31 -0.84 0.09 -2.27 0.00 0.00 179.45 177.78 2or2 n ASN 135 N -3.95 1.17 0.05 4.20 3.02 0.05 -4.62 115.26 115.19 2or2 n ASN 135 Ca -0.14 -1.04 0.00 0.00 -0.03 0.00 0.00 54.58 53.37 2or2 n ASN 135 Cb 0.91 0.81 0.00 0.00 -0.61 0.00 0.00 39.78 40.90 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 -1.18 -0.70 -0.05 3.10 4.02 0.09 -4.88 117.16 117.56 2or2 n TYR 136 Ca 0.05 0.12 0.10 0.00 -0.01 0.00 0.00 57.90 58.16 2or2 n TYR 136 Cb 0.36 0.25 0.48 0.00 -0.02 0.00 0.00 39.34 40.42 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 0.45 -0.01 -0.72 3.57 -1.08 -2.37 116.94 116.79 2or2 h PHE 137 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2or2 h PHE 137 Cb 0.23 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.82 2or2 h PHE 137 CO 0.00 0.23 0.10 -0.24 -2.23 0.00 0.00 178.31 176.18 2or2 h VAL 138 N 0.44 0.06 -2.86 1.41 3.04 -1.76 -3.43 116.25 113.15 2or2 h VAL 138 Ca 0.24 0.00 -0.54 0.00 -1.01 0.00 0.00 66.70 65.39 2or2 h VAL 138 Cb 0.37 0.90 0.07 0.00 -2.01 0.00 0.00 31.29 30.62 2or2 h VAL 138 CO -0.06 0.00 0.91 -0.67 -1.01 0.00 0.00 177.57 176.73 2or2 n ASP 139 N -3.11 3.76 0.17 3.17 -0.08 -0.89 -4.86 116.55 114.70 2or2 n ASP 139 Ca -0.02 1.10 0.10 0.00 -1.51 0.00 0.00 54.79 54.46 2or2 n ASP 139 Cb 0.17 -1.56 0.55 0.00 2.34 0.00 0.00 41.12 42.62 2or2 n ASP 139 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2or2 h PRO 140 N 5.70 0.00 0.00 -0.67 0.11 -1.91 -1.95 132.00 133.28 2or2 h PRO 140 Ca -0.45 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 2or2 h PRO 140 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2or2 h PRO 140 CO 0.87 0.00 -0.19 0.97 -0.21 0.00 0.00 178.00 179.44 2or2 h ILE 141 N 0.00 0.63 -3.35 4.15 6.09 -1.90 -3.41 117.51 119.72 2or2 h ILE 141 Ca 0.00 -0.85 -0.60 0.00 -1.37 0.00 0.00 64.86 62.04 2or2 h ILE 141 Cb 0.17 1.55 -0.09 0.00 0.47 0.00 0.00 36.82 38.91 2or2 h ILE 141 CO 0.00 0.19 0.36 -0.36 -3.07 0.00 0.00 178.15 175.27 2or2 s PHE 142 N -3.98 3.31 0.15 2.19 0.08 -0.73 -0.25 117.98 118.75 2or2 s PHE 142 Ca -0.02 1.04 -0.31 0.00 0.12 0.00 0.00 56.93 57.76 2or2 s PHE 142 Cb 0.12 -2.97 -0.10 0.00 -0.57 0.00 0.00 43.02 39.50 2or2 s PHE 142 CO 0.62 -0.36 1.59 -1.17 -0.10 0.00 0.00 175.22 175.80 2or2 s LEU 143 N 2.67 4.37 0.00 -0.37 2.96 -0.80 -4.91 118.68 122.60 2or2 s LEU 143 Ca 0.32 2.59 0.24 0.00 -0.22 0.00 0.00 54.13 57.06 2or2 s LEU 143 Cb -0.15 -3.59 0.31 0.00 0.50 0.00 0.00 46.19 43.26 2or2 s LEU 143 CO 0.08 -0.84 1.34 0.29 -1.32 0.00 0.00 176.35 175.90 2or2 n LYS 144 N 4.31 2.43 -2.80 1.98 4.76 -1.26 -3.63 118.16 123.95 2or2 n LYS 144 Ca 0.14 -2.13 -0.23 0.00 -2.87 0.00 0.00 58.31 53.23 2or2 n LYS 144 Cb 0.39 -1.49 0.02 0.00 -1.84 0.00 0.00 35.03 32.11 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 -1.74 3.44 0.00 -0.18 -4.23 -1.26 -2.69 115.64 108.98 2or2 s THR 145 Ca 0.34 -0.52 0.00 0.00 -1.18 0.00 0.00 61.69 60.33 2or2 s THR 145 Cb 0.22 -3.29 0.00 0.00 1.34 0.00 0.00 72.50 70.77 2or2 s THR 145 CO 0.31 -0.21 0.00 -0.62 -0.54 0.00 0.00 174.62 173.56 2or2 n GLU 146 N -2.23 1.39 0.00 3.99 1.02 -1.26 -1.82 120.64 121.72 2or2 n GLU 146 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2or2 n GLU 146 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.00 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 2.81 -0.43 3.25 0.62 0.00 -1.26 -3.91 105.19 106.27 2or2 n GLY 147 Ca 0.00 -1.09 -0.43 0.00 0.00 0.00 0.00 46.02 44.50 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 -0.97 5.04 -4.47 1.61 5.15 -1.26 -4.94 115.26 115.42 2or2 n ASN 148 Ca 0.00 -3.00 -0.61 0.00 -0.60 0.00 0.00 54.58 50.37 2or2 n ASN 148 Cb 0.00 -1.57 -0.09 0.00 -0.53 0.00 0.00 39.78 37.59 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 4.50 0.00 -3.58 -1.44 5.41 -1.25 -4.75 119.36 118.25 2or2 n ILE 149 Ca 0.41 0.00 -0.33 0.00 1.00 0.00 0.00 62.75 63.83 2or2 n ILE 149 Cb 0.41 -0.19 -0.05 0.00 -0.71 0.00 0.00 39.64 39.10 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 1.14 3.71 0.31 0.38 1.02 -1.26 -0.83 119.74 124.20 2or2 s LYS 150 Ca 0.94 0.08 0.04 0.00 0.02 0.00 0.00 55.97 57.05 2or2 s LYS 150 Cb -1.32 -2.85 0.66 0.00 -0.52 0.00 0.00 37.83 33.80 2or2 s LYS 150 CO 0.65 0.46 1.84 1.25 -0.92 0.00 0.00 175.35 178.63 2or2 h LEU 151 N 3.05 0.83 -0.96 3.17 5.85 -1.22 -1.92 115.31 124.11 2or2 h LEU 151 Ca -0.47 0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.39 2or2 h LEU 151 Cb 1.17 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 42.02 2or2 h LEU 151 CO 0.70 0.42 0.60 1.23 -0.34 0.00 0.00 178.44 181.04 2or2 h GLY 152 N 0.87 1.51 1.81 3.75 0.00 -1.02 -0.09 103.07 109.90 2or2 h GLY 152 Ca 0.49 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 2or2 h GLY 152 CO -0.26 0.22 -0.24 -0.55 0.00 0.00 0.00 176.54 175.71 2or2 h ASP 153 N 1.01 0.00 1.10 0.19 3.32 -1.63 -3.30 116.42 117.11 2or2 h ASP 153 Ca 0.45 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.34 2or2 h ASP 153 Cb 0.34 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 2or2 h ASP 153 CO -0.23 0.05 -0.94 0.00 -1.72 0.00 0.00 179.24 176.41 2or2 h ALA 154 N 1.95 0.59 -2.01 3.45 0.00 -0.69 -3.45 119.26 119.09 2or2 h ALA 154 Ca -0.00 -0.75 -0.62 0.00 0.00 0.00 0.00 54.91 53.53 2or2 h ALA 154 Cb 1.04 0.03 0.07 0.00 0.00 0.00 0.00 17.79 18.93 2or2 h ALA 154 CO 0.01 0.94 0.49 0.54 0.00 0.00 0.00 179.25 181.23 2or2 n ARG 155 N -3.17 1.60 -0.96 0.00 1.74 -0.16 -1.01 116.66 114.70 2or2 n ARG 155 Ca -0.03 0.57 0.00 0.00 -0.77 0.00 0.00 57.85 57.62 2or2 n ARG 155 Cb 0.84 -2.18 0.00 0.00 -1.02 0.00 0.00 32.46 30.10 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 2.33 0.44 3.38 -0.13 0.00 0.79 -4.97 105.19 107.03 2or2 n GLY 156 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.54 1.46 -0.21 1.61 -0.14 -0.18 -4.98 119.74 116.76 2or2 s LYS 157 Ca 0.00 -1.76 -0.09 0.00 -1.36 0.00 0.00 55.97 52.76 2or2 s LYS 157 Cb 0.00 -0.78 -0.04 0.00 -1.68 0.00 0.00 37.83 35.32 2or2 s LYS 157 CO 0.00 -0.09 0.11 0.42 -0.76 0.00 0.00 175.35 175.03 2or2 s ILE 158 N -3.31 5.07 -0.27 2.17 1.01 0.66 -2.43 121.20 124.10 2or2 s ILE 158 Ca 0.31 0.07 -0.09 0.00 0.00 0.00 0.00 60.65 60.94 2or2 s ILE 158 Cb 0.06 -3.33 -0.03 0.00 0.01 0.00 0.00 42.46 39.17 2or2 s ILE 158 CO 0.11 0.40 0.12 -0.69 0.00 0.00 0.00 174.94 174.89 2or2 s VAL 159 N 0.73 4.71 0.10 2.92 1.01 0.14 -1.90 120.40 128.10 2or2 s VAL 159 Ca 0.06 -0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.68 2or2 s VAL 159 Cb -0.13 -3.24 -0.06 0.00 0.00 0.00 0.00 36.38 32.96 2or2 s VAL 159 CO 0.02 0.28 0.94 -0.22 0.00 0.00 0.00 175.10 176.12 2or2 s LEU 160 N 1.67 4.49 -0.34 3.92 2.96 -1.26 -0.34 118.68 129.78 2or2 s LEU 160 Ca 0.06 1.75 0.03 0.00 -0.22 0.00 0.00 54.13 55.76 2or2 s LEU 160 Cb -0.16 -3.54 0.10 0.00 0.50 0.00 0.00 46.19 43.09 2or2 s LEU 160 CO 0.07 -0.05 0.06 -0.22 -1.32 0.00 0.00 176.35 174.88 2or2 s LEU 161 N -0.02 4.79 0.09 -0.68 0.20 -0.41 0.09 118.68 122.75 2or2 s LEU 161 Ca 0.46 -2.14 -0.31 0.00 0.69 0.00 0.00 54.13 52.83 2or2 s LEU 161 Cb -0.23 -1.65 -0.07 0.00 -0.43 0.00 0.00 46.19 43.82 2or2 s LEU 161 CO 0.29 -0.39 1.26 -0.54 -0.29 0.00 0.00 176.35 176.68 2or2 s LYS 162 N 0.92 4.40 -0.09 1.98 1.02 -0.83 -1.83 119.74 125.32 2or2 s LYS 162 Ca 0.10 1.88 0.13 0.00 0.02 0.00 0.00 55.97 58.11 2or2 s LYS 162 Cb -0.19 -3.30 0.24 0.00 -0.52 0.00 0.00 37.83 34.05 2or2 s LYS 162 CO -0.08 -0.30 1.12 0.54 -0.92 0.00 0.00 175.35 175.72 2or2 n ARG 163 N 3.77 0.86 -4.26 1.68 1.74 -0.26 -3.88 116.66 116.31 2or2 n ARG 163 Ca 0.09 -2.20 -0.21 0.00 -0.77 0.00 0.00 57.85 54.77 2or2 n ARG 163 Cb 0.45 -1.12 -0.12 0.00 -1.02 0.00 0.00 32.46 30.65 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 -1.89 1.58 0.51 -1.55 -0.85 -1.23 -4.34 117.35 109.58 2or2 s TYR 164 Ca 0.24 -0.47 0.03 0.00 -0.52 0.00 0.00 57.07 56.35 2or2 s TYR 164 Cb 0.22 -0.84 0.03 0.00 0.38 0.00 0.00 41.96 41.75 2or2 s TYR 164 CO -0.01 0.18 0.71 -1.54 -1.52 0.00 0.00 175.55 173.38 2or2 s SER 165 N -2.16 5.41 0.00 -0.18 1.04 -1.26 -4.58 113.70 111.97 2or2 s SER 165 Ca 0.07 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.38 2or2 s SER 165 Cb -0.08 -0.83 0.00 0.00 0.10 0.00 0.00 66.02 65.21 2or2 s SER 165 CO 0.04 -1.01 0.00 0.61 0.98 0.00 0.00 173.24 173.86 2or2 n GLY 166 N -2.19 0.77 3.66 7.32 0.00 -1.26 -4.67 105.19 108.82 2or2 n GLY 166 Ca 0.08 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.64 2or2 n GLY 166 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2or2 n SER 167 N 0.00 2.57 -0.08 1.61 2.88 -1.26 -4.83 113.62 114.52 2or2 n SER 167 Ca 0.00 1.14 0.02 0.00 -1.33 0.00 0.00 58.87 58.70 2or2 n SER 167 Cb 0.00 -1.40 0.03 0.00 -0.75 0.00 0.00 64.21 62.10 2or2 n SER 167 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2or2 n ASN 168 N 2.24 1.37 -4.07 -3.46 3.02 -1.26 -5.04 115.26 108.06 2or2 n ASN 168 Ca 0.13 -2.01 -0.20 0.00 -0.03 0.00 0.00 54.58 52.47 2or2 n ASN 168 Cb 0.30 -0.12 -0.15 0.00 -0.61 0.00 0.00 39.78 39.21 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 -1.06 0.88 0.51 3.52 0.41 -1.26 -5.14 118.70 116.55 2or2 s GLU 169 Ca 0.07 -0.45 -0.19 0.00 -0.41 0.00 0.00 54.97 53.98 2or2 s GLU 169 Cb 0.06 -0.85 -0.08 0.00 -1.78 0.00 0.00 34.13 31.48 2or2 s GLU 169 CO 0.01 0.23 1.05 -1.12 -0.49 0.00 0.00 175.26 174.93 2or2 s SER 170 N -0.41 6.22 0.00 -0.19 0.01 -1.26 -5.00 113.70 113.07 2or2 s SER 170 Ca 0.03 1.92 0.00 0.00 1.31 0.00 0.00 55.95 59.22 2or2 s SER 170 Cb -0.05 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2or2 s SER 170 CO -0.00 -0.86 0.00 0.61 0.41 0.00 0.00 173.24 173.40 2or2 n GLY 171 N -0.35 4.45 7.00 3.44 0.00 -1.09 -4.69 105.19 113.94 2or2 n GLY 171 Ca 0.09 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.91 0.02 3.76 -0.02 0.00 -0.76 -4.76 105.19 102.52 2or2 n GLY 172 Ca 0.00 -0.95 -0.36 0.00 0.00 0.00 0.00 46.02 44.71 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 3.47 0.60 1.61 2.02 0.11 -4.61 117.35 120.56 2or2 s TYR 173 Ca 0.00 0.49 -0.19 0.00 -0.37 0.00 0.00 57.07 57.00 2or2 s TYR 173 Cb 0.00 -2.20 -0.03 0.00 -0.40 0.00 0.00 41.96 39.33 2or2 s TYR 173 CO 0.00 0.36 1.20 -0.80 -1.57 0.00 0.00 175.55 174.74 2or2 s ASN 174 N 0.11 5.15 0.39 2.29 0.01 -1.26 -1.96 114.94 119.67 2or2 s ASN 174 Ca 0.13 2.37 -0.27 0.00 -0.71 0.00 0.00 52.86 54.39 2or2 s ASN 174 Cb -0.12 -2.60 -0.09 0.00 0.41 0.00 0.00 41.25 38.85 2or2 s ASN 174 CO 0.02 -1.62 1.34 0.21 -1.51 0.00 0.00 177.10 175.54 2or2 s ASN 175 N -1.64 6.37 0.14 -1.22 3.04 -1.25 -4.63 114.94 115.75 2or2 s ASN 175 Ca 0.77 2.75 -0.01 0.00 0.04 0.00 0.00 52.86 56.41 2or2 s ASN 175 Cb -0.30 -2.65 -0.04 0.00 -1.54 0.00 0.00 41.25 36.72 2or2 s ASN 175 CO 0.34 -0.82 0.07 0.72 -3.04 0.00 0.00 177.10 174.36 2or2 s PHE 176 N -1.21 0.93 -0.22 0.43 -0.12 -1.26 -4.99 117.98 111.54 2or2 s PHE 176 Ca 0.55 -1.25 -0.37 0.00 -0.05 0.00 0.00 56.93 55.80 2or2 s PHE 176 Cb -0.40 -0.50 -0.14 0.00 -0.63 0.00 0.00 43.02 41.35 2or2 s PHE 176 CO 0.53 -0.53 1.85 0.98 -0.05 0.00 0.00 175.22 178.00 2or2 n TYR 177 N -0.13 2.12 -3.60 3.49 9.36 -1.26 -4.93 117.16 122.21 2or2 n TYR 177 Ca -0.04 0.29 -0.28 0.00 3.32 0.00 0.00 57.90 61.20 2or2 n TYR 177 Cb 0.64 -2.55 -0.11 0.00 -0.63 0.00 0.00 39.34 36.69 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 4.19 2.01 0.69 2.98 -0.11 -1.26 -4.92 118.94 122.53 2or2 s TRP 178 Ca 0.98 -2.66 -0.16 0.00 1.22 0.00 0.00 56.10 55.48 2or2 s TRP 178 Cb -0.90 -1.63 0.02 0.00 -1.50 0.00 0.00 33.47 29.46 2or2 s TRP 178 CO 0.59 -0.73 1.20 -1.25 -4.62 0.00 0.00 176.95 172.14 2or2 s PRO 179 N -0.38 2.38 0.18 5.86 0.04 -1.26 -4.97 135.00 136.84 2or2 s PRO 179 Ca 0.28 1.76 -0.30 0.00 0.04 0.00 0.00 61.00 62.78 2or2 s PRO 179 Cb -0.03 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.57 2or2 s PRO 179 CO -0.16 -1.65 1.05 0.34 0.04 0.00 0.00 177.00 176.62 2or2 s ASP 180 N -1.96 7.36 -1.39 6.66 2.15 -1.26 -4.19 116.67 124.03 2or2 s ASP 180 Ca 0.75 2.03 -0.03 0.00 0.43 0.00 0.00 52.55 55.73 2or2 s ASP 180 Cb -0.29 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.73 2or2 s ASP 180 CO 0.42 -0.14 0.41 -3.20 -0.17 0.00 0.00 175.17 172.49 2or2 n ASN 181 N 2.26 -0.71 -4.07 -0.34 5.15 -1.25 -4.97 115.26 111.33 2or2 n ASN 181 Ca 0.02 -1.05 -0.10 0.00 -0.60 0.00 0.00 54.58 52.84 2or2 n ASN 181 Cb 0.47 -2.85 -0.08 0.00 -0.53 0.00 0.00 39.78 36.79 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 -6.64 1.25 -0.26 1.20 2.02 -1.20 -4.65 118.70 110.43 2or2 s GLU 182 Ca 0.06 -1.38 -0.07 0.00 0.02 0.00 0.00 54.97 53.60 2or2 s GLU 182 Cb -0.02 0.35 -0.02 0.00 0.10 0.00 0.00 34.13 34.54 2or2 s GLU 182 CO 0.90 -0.46 0.06 0.99 0.02 0.00 0.00 175.26 176.78 2or2 s THR 183 N -4.05 4.16 0.16 3.63 2.01 -1.26 -1.83 115.64 118.47 2or2 s THR 183 Ca 0.27 -0.31 -0.01 0.00 0.31 0.00 0.00 61.69 61.95 2or2 s THR 183 Cb 0.04 -2.99 -0.04 0.00 0.01 0.00 0.00 72.50 69.52 2or2 s THR 183 CO 0.07 0.29 0.08 0.72 -0.69 0.00 0.00 174.62 175.09 2or2 s PHE 184 N 1.58 1.01 -0.02 4.92 -0.12 0.12 -4.97 117.98 120.50 2or2 s PHE 184 Ca 0.06 -1.28 0.02 0.00 -0.05 0.00 0.00 56.93 55.68 2or2 s PHE 184 Cb -0.15 -0.53 0.00 0.00 -0.63 0.00 0.00 43.02 41.70 2or2 s PHE 184 CO 0.03 -0.54 -0.08 0.99 -0.05 0.00 0.00 175.22 175.57 2or2 s THR 185 N -4.06 0.68 0.00 -4.49 2.01 -1.26 -0.23 115.64 108.29 2or2 s THR 185 Ca 0.30 -0.32 0.00 0.00 0.31 0.00 0.00 61.69 61.98 2or2 s THR 185 Cb 0.07 -0.61 0.00 0.00 0.01 0.00 0.00 72.50 71.98 2or2 s THR 185 CO 0.06 0.21 0.00 1.07 -0.69 0.00 0.00 174.62 175.27 2or2 n THR 186 N 3.23 0.00 -4.72 -0.82 5.66 0.75 -4.98 114.28 113.40 2or2 n THR 186 Ca -0.17 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.55 2or2 n THR 186 Cb 0.55 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.19 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 -2.75 1.92 -0.15 1.09 -4.23 -1.26 0.17 115.64 110.43 2or2 s THR 187 Ca 0.00 -1.34 -0.14 0.00 -1.18 0.00 0.00 61.69 59.02 2or2 s THR 187 Cb 0.00 -1.66 -0.05 0.00 1.34 0.00 0.00 72.50 72.13 2or2 s THR 187 CO 0.00 0.25 -0.28 0.52 -0.54 0.00 0.00 174.62 174.57 2or2 n VAL 188 N 1.70 1.25 -4.32 2.29 0.31 -0.14 -4.75 118.33 114.67 2or2 n VAL 188 Ca -0.17 0.20 -0.15 0.00 -0.01 0.00 0.00 64.34 64.21 2or2 n VAL 188 Cb 0.53 -2.22 -0.03 0.00 -0.91 0.00 0.00 33.84 31.21 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 -4.15 1.98 -0.05 4.52 3.02 -1.21 -4.62 115.26 114.75 2or2 n ASN 189 Ca -0.11 -2.10 0.16 0.00 -0.03 0.00 0.00 54.58 52.49 2or2 n ASN 189 Cb 0.42 0.33 0.88 0.00 -0.61 0.00 0.00 39.78 40.80 2or2 n ASN 189 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2or2 n GLN 190 N -0.56 1.00 0.00 3.52 0.00 -1.26 -2.93 117.38 117.16 2or2 n GLN 190 Ca -0.07 -0.10 0.04 0.00 0.00 0.00 0.00 57.00 56.87 2or2 n GLN 190 Cb 0.32 -1.50 0.01 0.00 0.00 0.00 0.00 30.24 29.07 2or2 n GLN 190 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2or2 n ASN 191 N -0.91 1.26 -3.70 2.61 3.02 -1.26 -5.00 115.26 111.28 2or2 n ASN 191 Ca 0.22 -1.13 -0.16 0.00 -0.03 0.00 0.00 54.58 53.48 2or2 n ASN 191 Cb 0.15 0.29 -0.16 0.00 -0.61 0.00 0.00 39.78 39.45 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 -0.93 -0.15 0.16 2.41 1.01 -1.15 -4.71 120.40 117.04 2or2 s VAL 192 Ca 0.07 0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.37 2or2 s VAL 192 Cb 0.06 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 36.18 2or2 s VAL 192 CO 0.15 0.13 0.31 0.20 0.00 0.00 0.00 175.10 175.89 2or2 s ASN 193 N 1.82 6.36 -0.00 3.32 0.01 0.17 -0.97 114.94 125.65 2or2 s ASN 193 Ca -0.01 0.26 -0.01 0.00 -0.71 0.00 0.00 52.86 52.39 2or2 s ASN 193 Cb -0.12 -1.95 -0.00 0.00 0.41 0.00 0.00 41.25 39.59 2or2 s ASN 193 CO -0.05 0.03 0.02 -0.69 -1.51 0.00 0.00 177.10 174.90 2or2 s VAL 194 N -1.77 0.02 -0.11 1.60 1.01 0.13 0.30 120.40 121.58 2or2 s VAL 194 Ca 0.36 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.23 2or2 s VAL 194 Cb -0.11 -0.07 0.01 0.00 0.00 0.00 0.00 36.38 36.21 2or2 s VAL 194 CO 0.29 -0.07 -0.15 -0.89 0.00 0.00 0.00 175.10 174.27 2or2 s THR 195 N -0.20 1.52 -0.07 3.92 2.01 0.13 -0.18 115.64 122.77 2or2 s THR 195 Ca -0.02 -0.66 0.03 0.00 0.31 0.00 0.00 61.69 61.35 2or2 s THR 195 Cb -0.02 -1.39 0.01 0.00 0.01 0.00 0.00 72.50 71.12 2or2 s THR 195 CO -0.00 0.44 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.54 2or2 s VAL 196 N 0.98 1.31 -0.40 3.82 1.01 0.68 -1.40 120.40 126.40 2or2 s VAL 196 Ca -0.07 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 2or2 s VAL 196 Cb -0.15 -1.18 0.06 0.00 0.00 0.00 0.00 36.38 35.12 2or2 s VAL 196 CO -0.02 0.39 0.23 -1.58 0.00 0.00 0.00 175.10 174.13 2or2 s GLN 197 N 0.60 2.64 -0.35 2.72 -0.44 -0.42 -0.70 119.66 123.71 2or2 s GLN 197 Ca -0.15 -1.36 0.15 0.00 -2.50 0.00 0.00 55.36 51.50 2or2 s GLN 197 Cb -0.16 -3.73 0.43 0.00 -1.64 0.00 0.00 33.01 27.91 2or2 s GLN 197 CO 0.05 -0.87 0.93 -3.47 0.50 0.00 0.00 175.29 172.43 2or2 n ASP 198 N 4.92 1.88 -4.50 6.67 2.03 -0.76 -1.64 116.55 125.14 2or2 n ASP 198 Ca -0.11 -2.93 -0.43 0.00 0.52 0.00 0.00 54.79 51.84 2or2 n ASP 198 Cb 0.44 -0.54 -0.02 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 -3.07 3.70 0.00 -0.67 1.02 -1.26 -3.24 119.74 116.23 2or2 s LYS 199 Ca 0.33 -1.68 0.29 0.00 0.02 0.00 0.00 55.97 54.93 2or2 s LYS 199 Cb 0.43 -5.15 1.21 0.00 -0.52 0.00 0.00 37.83 33.80 2or2 s LYS 199 CO -0.02 -1.97 1.88 2.48 -0.92 0.00 0.00 175.35 176.80 2or2 n TYR 200 N 7.42 0.00 -2.69 3.18 4.11 -1.26 -4.23 117.16 123.69 2or2 n TYR 200 Ca 0.31 0.00 -0.08 0.00 -0.00 0.00 0.00 57.90 58.14 2or2 n TYR 200 Cb 0.49 -0.35 0.03 0.00 -0.00 0.00 0.00 39.34 39.51 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 -1.34 1.24 -4.13 -3.48 2.85 -1.26 -1.51 118.16 110.53 2or2 n LYS 201 Ca 0.10 -3.27 -0.23 0.00 -1.05 0.00 0.00 58.31 53.87 2or2 n LYS 201 Cb 0.30 -1.28 -0.06 0.00 -0.65 0.00 0.00 35.03 33.34 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 -3.18 3.31 0.77 0.58 -7.23 -1.26 -4.82 120.40 108.57 2or2 s VAL 202 Ca 0.27 -1.70 -0.15 0.00 -1.81 0.00 0.00 61.98 58.59 2or2 s VAL 202 Cb 0.44 -3.00 0.02 0.00 0.56 0.00 0.00 36.38 34.40 2or2 s VAL 202 CO 0.03 -0.25 0.91 -0.46 -0.31 0.00 0.00 175.10 175.02 2or2 n ASN 203 N -1.11 0.13 -0.19 4.85 0.23 -1.26 -4.69 115.26 113.22 2or2 n ASN 203 Ca -0.04 0.60 -0.00 0.00 -0.53 0.00 0.00 54.58 54.61 2or2 n ASN 203 Cb 0.60 -1.39 0.10 0.00 -2.08 0.00 0.00 39.78 37.02 2or2 n ASN 203 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 2or2 h TYR 204 N -0.57 0.25 -0.73 -2.53 5.03 -1.99 -1.42 116.97 115.02 2or2 h TYR 204 Ca -0.46 0.03 -0.04 0.00 2.58 0.00 0.00 58.73 60.84 2or2 h TYR 204 Cb 1.32 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 39.55 2or2 h TYR 204 CO 0.41 0.01 0.28 -0.44 -1.32 0.00 0.00 178.16 177.10 2or2 h ASP 205 N 0.30 1.00 0.14 -2.11 3.32 -2.00 -1.58 116.42 115.48 2or2 h ASP 205 Ca 0.30 -0.15 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 2or2 h ASP 205 Cb 0.42 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 2or2 h ASP 205 CO -0.36 0.89 -0.42 -0.08 -1.72 0.00 0.00 179.24 177.55 2or2 h GLU 206 N 1.06 0.36 0.38 3.56 4.81 -1.79 -2.05 114.58 120.90 2or2 h GLU 206 Ca 0.24 -0.18 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 2or2 h GLU 206 Cb 0.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.60 2or2 h GLU 206 CO -0.02 0.72 -0.18 -0.22 -0.73 0.00 0.00 179.01 178.58 2or2 h LYS 207 N 0.30 -0.49 -0.68 1.92 1.63 -0.72 0.98 116.57 119.51 2or2 h LYS 207 Ca 0.02 0.03 0.05 0.00 -0.85 0.00 0.00 60.65 59.91 2or2 h LYS 207 Cb 0.87 0.11 -0.05 0.00 -0.60 0.00 0.00 32.23 32.56 2or2 h LYS 207 CO 0.07 -0.23 0.39 0.28 -3.45 0.00 0.00 179.45 176.51 2or2 h VAL 208 N -0.67 0.99 -0.57 2.00 2.07 -1.28 0.29 116.25 119.08 2or2 h VAL 208 Ca -0.05 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2or2 h VAL 208 Cb 0.48 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 2or2 h VAL 208 CO 0.09 0.13 0.33 0.50 0.02 0.00 0.00 177.57 178.64 2or2 h LYS 209 N 0.73 0.78 -0.72 1.57 3.64 -1.26 -1.31 116.57 119.99 2or2 h LYS 209 Ca 0.30 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.55 2or2 h LYS 209 Cb 0.16 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 2or2 h LYS 209 CO -0.17 0.58 0.26 0.77 -2.27 0.00 0.00 179.45 178.62 2or2 h SER 210 N 0.76 1.02 -0.07 4.20 0.02 0.05 0.23 113.55 119.77 2or2 h SER 210 Ca 0.20 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2or2 h SER 210 Cb 0.01 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.28 2or2 h SER 210 CO -0.04 0.94 0.03 0.40 -1.14 0.00 0.00 176.83 177.02 2or2 h ILE 211 N 1.04 1.12 -0.49 3.27 2.04 -0.71 -1.75 117.51 122.03 2or2 h ILE 211 Ca 0.24 -0.34 -0.09 0.00 1.00 0.00 0.00 64.86 65.66 2or2 h ILE 211 Cb 0.26 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 2or2 h ILE 211 CO -0.01 0.10 -0.07 0.11 0.00 0.00 0.00 178.15 178.28 2or2 h LYS 212 N -0.03 0.87 -0.11 2.37 1.57 -1.04 -1.00 116.57 119.20 2or2 h LYS 212 Ca 0.02 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 2or2 h LYS 212 Cb 0.13 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 2or2 h LYS 212 CO -0.00 0.91 0.04 -0.44 -0.57 0.00 0.00 179.45 179.39 2or2 h ASP 213 N 0.79 0.15 -0.13 0.86 3.32 -0.43 0.18 116.42 121.17 2or2 h ASP 213 Ca 0.14 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 2or2 h ASP 213 Cb 0.57 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 2or2 h ASP 213 CO 0.03 0.29 -0.08 0.74 -1.72 0.00 0.00 179.24 178.51 2or2 h THR 214 N -0.00 1.21 -0.22 0.35 2.02 -1.26 -1.17 112.91 113.83 2or2 h THR 214 Ca 0.03 -0.87 -0.17 0.00 0.77 0.00 0.00 66.41 66.17 2or2 h THR 214 Cb 0.19 1.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 2or2 h THR 214 CO -0.00 0.29 -0.57 -0.03 0.37 0.00 0.00 175.52 175.58 2or2 h MET 215 N 0.41 0.68 -0.48 6.66 1.85 -0.86 -1.20 114.93 121.99 2or2 h MET 215 Ca 0.08 -0.44 -0.04 0.00 -0.61 0.00 0.00 59.70 58.69 2or2 h MET 215 Cb 0.40 0.06 -0.02 0.00 0.43 0.00 0.00 31.60 32.47 2or2 h MET 215 CO 0.02 1.06 0.13 -0.44 -0.40 0.00 0.00 176.91 177.28 2or2 h ASP 216 N 0.52 0.73 -0.54 1.39 3.32 -0.18 -1.04 116.42 120.62 2or2 h ASP 216 Ca 0.01 -0.23 0.02 0.00 0.02 0.00 0.00 57.03 56.85 2or2 h ASP 216 Cb 1.14 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.46 2or2 h ASP 216 CO 0.11 0.76 0.33 -0.08 -1.72 0.00 0.00 179.24 178.64 2or2 h GLU 217 N 0.66 0.63 -0.38 3.56 4.81 -1.10 0.41 114.58 123.18 2or2 h GLU 217 Ca 0.15 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 2or2 h GLU 217 Cb 0.31 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 2or2 h GLU 217 CO -0.00 0.42 0.18 1.15 -0.73 0.00 0.00 179.01 180.03 2or2 h THR 218 N 0.65 0.97 -0.94 0.32 2.02 -0.86 -1.01 112.91 114.06 2or2 h THR 218 Ca 0.21 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.26 2or2 h THR 218 Cb 0.01 0.56 -0.05 0.00 -1.74 0.00 0.00 68.15 66.93 2or2 h THR 218 CO -0.09 0.07 0.59 0.24 0.37 0.00 0.00 175.52 176.70 2or2 h MET 219 N 0.37 1.26 0.00 6.66 2.86 -0.55 -1.35 114.93 124.19 2or2 h MET 219 Ca 0.16 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2or2 h MET 219 Cb 0.07 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 31.46 2or2 h MET 219 CO -0.12 0.87 0.00 -0.91 1.06 0.00 0.00 176.91 177.81 2or2 h ASN 220 N 1.29 0.00 -0.43 1.22 2.35 -0.10 -2.68 115.58 117.22 2or2 h ASN 220 Ca 0.34 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.77 2or2 h ASN 220 Cb -0.09 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 38.03 2or2 h ASN 220 CO -0.07 0.00 -0.68 0.59 -1.65 0.00 0.00 177.43 175.62 2or2 n ASN 221 N -2.68 3.57 0.10 5.81 3.02 -0.46 -4.84 115.26 119.78 2or2 n ASN 221 Ca 0.02 -3.82 0.17 0.00 -0.03 0.00 0.00 54.58 50.92 2or2 n ASN 221 Cb 0.30 -0.42 0.70 0.00 -0.61 0.00 0.00 39.78 39.75 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 1.68 0.00 -0.66 6.41 4.64 -0.92 -2.19 113.55 122.52 2or2 h SER 222 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2or2 h SER 222 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2or2 h SER 222 CO 0.44 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.78 2or2 n GLU 223 N -4.30 3.16 -2.89 4.77 4.71 -1.26 -4.79 120.64 120.04 2or2 n GLU 223 Ca 0.05 -2.71 -0.44 0.00 -0.01 0.00 0.00 57.16 54.06 2or2 n GLU 223 Cb 0.43 -1.68 -0.02 0.00 -1.01 0.00 0.00 31.44 29.16 2or2 n GLU 223 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2or2 s ASP 224 N -0.99 6.70 0.37 1.62 -1.08 -0.82 -4.84 116.67 117.62 2or2 s ASP 224 Ca 0.47 -2.16 0.26 0.00 -0.52 0.00 0.00 52.55 50.61 2or2 s ASP 224 Cb 0.27 -2.42 1.32 0.00 -1.46 0.00 0.00 42.92 40.64 2or2 s ASP 224 CO 0.28 -1.05 1.79 -0.07 0.52 0.00 0.00 175.17 176.64 2or2 h LEU 225 N 10.55 0.00 -1.55 -1.34 3.38 -1.87 -2.35 115.31 122.13 2or2 h LEU 225 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2or2 h LEU 225 Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2or2 h LEU 225 CO 1.17 0.00 0.00 0.59 0.09 0.00 0.00 178.44 180.29 2or2 n ASN 226 N -2.42 2.40 -4.42 -0.43 3.02 -1.26 -4.57 115.26 107.57 2or2 n ASN 226 Ca -0.01 -1.80 -0.35 0.00 -0.03 0.00 0.00 54.58 52.40 2or2 n ASN 226 Cb 0.10 -0.01 -0.13 0.00 -0.61 0.00 0.00 39.78 39.13 2or2 n ASN 226 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2or2 s HIS 227 N -1.97 3.01 -0.18 3.10 2.46 -0.89 -0.66 115.29 120.16 2or2 s HIS 227 Ca 0.32 -0.56 -0.12 0.00 0.47 0.00 0.00 55.06 55.18 2or2 s HIS 227 Cb 0.20 -2.08 -0.05 0.00 -0.13 0.00 0.00 32.58 30.53 2or2 s HIS 227 CO 0.31 -0.30 0.22 -1.17 -2.47 0.00 0.00 174.74 171.34 2or2 s LEU 228 N 1.06 4.22 -0.19 8.88 2.96 0.15 -4.72 118.68 131.03 2or2 s LEU 228 Ca 0.02 0.37 -0.00 0.00 -0.22 0.00 0.00 54.13 54.29 2or2 s LEU 228 Cb -0.14 -2.25 0.01 0.00 0.50 0.00 0.00 46.19 44.31 2or2 s LEU 228 CO 0.01 0.12 -0.16 -0.31 -1.32 0.00 0.00 176.35 174.69 2or2 s TYR 229 N 0.51 2.81 -0.17 5.38 2.02 -1.26 -0.69 117.35 125.95 2or2 s TYR 229 Ca 0.13 -1.43 0.01 0.00 -0.37 0.00 0.00 57.07 55.41 2or2 s TYR 229 Cb -0.12 -1.95 0.01 0.00 -0.40 0.00 0.00 41.96 39.50 2or2 s TYR 229 CO 0.02 -0.72 -0.18 0.42 -1.57 0.00 0.00 175.55 173.52 2or2 s ILE 230 N 1.27 2.26 -0.29 2.71 1.01 -0.49 0.04 121.20 127.72 2or2 s ILE 230 Ca 0.04 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.82 2or2 s ILE 230 Cb -0.14 -1.95 0.08 0.00 0.01 0.00 0.00 42.46 40.47 2or2 s ILE 230 CO -0.09 0.53 0.00 0.21 0.00 0.00 0.00 174.94 175.59 2or2 s ASN 231 N 1.12 4.29 -0.27 3.58 3.84 0.56 -1.30 114.94 126.76 2or2 s ASN 231 Ca 0.00 -1.63 -0.25 0.00 0.21 0.00 0.00 52.86 51.20 2or2 s ASN 231 Cb -0.14 -1.33 -0.00 0.00 -0.55 0.00 0.00 41.25 39.22 2or2 s ASN 231 CO -0.07 -0.31 0.86 -0.36 -2.79 0.00 0.00 177.10 174.43 2or2 s PHE 232 N 1.22 3.27 -0.96 0.43 0.40 -0.65 -1.21 117.98 120.48 2or2 s PHE 232 Ca 0.02 1.08 0.25 0.00 -0.60 0.00 0.00 56.93 57.69 2or2 s PHE 232 Cb -0.19 -3.17 0.48 0.00 0.51 0.00 0.00 43.02 40.65 2or2 s PHE 232 CO -0.10 -0.48 1.39 0.25 0.70 0.00 0.00 175.22 176.98 2or2 n THR 233 N 5.39 0.03 -2.17 0.64 -2.24 0.24 -4.81 114.28 111.36 2or2 n THR 233 Ca 0.06 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.44 2or2 n THR 233 Cb 0.47 0.23 -0.00 0.00 -2.10 0.00 0.00 70.33 68.93 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 -3.12 6.13 -0.10 3.42 1.04 -1.25 -4.86 113.70 114.97 2or2 s SER 234 Ca 0.10 2.43 -0.07 0.00 0.48 0.00 0.00 55.95 58.89 2or2 s SER 234 Cb 0.17 -2.61 0.03 0.00 0.10 0.00 0.00 66.02 63.71 2or2 s SER 234 CO 0.71 -0.95 0.25 -0.22 0.98 0.00 0.00 173.24 174.01 2or2 s LEU 235 N -2.90 0.75 -0.07 2.42 2.96 -1.26 -4.68 118.68 115.90 2or2 s LEU 235 Ca 0.62 0.52 0.10 0.00 -0.22 0.00 0.00 54.13 55.16 2or2 s LEU 235 Cb -0.32 0.82 0.15 0.00 0.50 0.00 0.00 46.19 47.35 2or2 s LEU 235 CO 0.39 -0.12 1.06 -1.54 -1.32 0.00 0.00 176.35 174.82 2or2 n SER 236 N 3.52 1.37 -4.60 3.68 3.41 -0.57 -3.91 113.62 116.52 2or2 n SER 236 Ca -0.18 -2.54 -0.63 0.00 -0.26 0.00 0.00 58.87 55.27 2or2 n SER 236 Cb 0.56 -0.30 -0.09 0.00 -0.26 0.00 0.00 64.21 64.12 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 -0.79 0.48 0.00 4.04 7.64 -1.23 -4.73 113.62 119.03 2or2 n SER 237 Ca 0.08 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.14 2or2 n SER 237 Cb 0.63 -0.90 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 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 2.49 3.21 3.36 0.23 0.00 -1.26 -4.75 105.19 108.48 2or2 n GLY 238 Ca 0.24 -1.71 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 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 -0.36 -2.60 0.32 -0.02 0.00 -1.26 -4.81 105.19 96.46 2or2 n GLY 239 Ca 0.00 -1.25 0.18 0.00 0.00 0.00 0.00 46.02 44.95 2or2 n GLY 239 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2or2 h THR 240 N -2.87 0.31 -0.65 2.61 2.02 -1.98 -2.06 112.91 110.29 2or2 h THR 240 Ca -0.56 0.00 0.09 0.00 0.77 0.00 0.00 66.41 66.71 2or2 h THR 240 Cb 1.32 0.99 -0.07 0.00 -1.74 0.00 0.00 68.15 68.65 2or2 h THR 240 CO 0.42 0.00 0.28 0.00 0.37 0.00 0.00 175.52 176.59 2or2 h ALA 241 N 1.98 0.86 -2.87 6.16 0.00 -2.01 -3.28 119.26 120.10 2or2 h ALA 241 Ca 0.00 0.07 -0.78 0.00 0.00 0.00 0.00 54.91 54.21 2or2 h ALA 241 Cb 0.03 0.01 -0.27 0.00 0.00 0.00 0.00 17.79 17.56 2or2 h ALA 241 CO -0.00 -0.13 0.04 0.00 0.00 0.00 0.00 179.25 179.17 2or2 s ALA 242 N -6.08 4.04 -0.87 0.00 0.00 -0.78 -4.97 121.76 113.11 2or2 s ALA 242 Ca -0.13 -3.35 -0.25 0.00 0.00 0.00 0.00 51.96 48.24 2or2 s ALA 242 Cb 0.17 -3.39 -0.19 0.00 0.00 0.00 0.00 23.12 19.71 2or2 s ALA 242 CO 0.75 -2.25 1.92 -1.71 0.00 0.00 0.00 175.76 174.47 2or2 n ASN 243 N 3.83 2.21 -0.44 0.00 5.15 -1.24 -4.68 115.26 120.08 2or2 n ASN 243 Ca 0.14 -2.61 0.14 0.00 -0.60 0.00 0.00 54.58 51.64 2or2 n ASN 243 Cb 0.45 -1.39 0.47 0.00 -0.53 0.00 0.00 39.78 38.78 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 13.21 1.45 -0.32 1.20 3.41 -1.26 -4.42 113.62 126.89 2or2 n SER 244 Ca 0.45 -1.37 0.04 0.00 -0.26 0.00 0.00 58.87 57.73 2or2 n SER 244 Cb 0.44 0.04 0.18 0.00 -0.26 0.00 0.00 64.21 64.61 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 2.17 0.87 -0.46 4.33 0.13 -1.84 -0.67 132.00 136.53 2or2 h PRO 245 Ca 0.00 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 65.01 2or2 h PRO 245 Cb 0.52 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.44 2or2 h PRO 245 CO 0.00 0.58 0.01 -0.92 -0.23 0.00 0.00 178.00 177.44 2or2 h TYR 246 N 0.90 0.88 -0.14 1.56 3.20 -1.85 -0.42 116.97 121.10 2or2 h TYR 246 Ca 0.42 -0.15 0.03 0.00 3.14 0.00 0.00 58.73 62.18 2or2 h TYR 246 Cb 0.35 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.36 2or2 h TYR 246 CO -0.04 0.85 -0.07 -0.92 -1.64 0.00 0.00 178.16 176.33 2or2 h TYR 247 N 0.66 -0.18 -0.53 -3.82 3.20 -1.61 -0.06 116.97 114.64 2or2 h TYR 247 Ca 0.13 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 2or2 h TYR 247 Cb 0.49 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 2or2 h TYR 247 CO 0.04 -0.12 0.16 1.88 -1.64 0.00 0.00 178.16 178.47 2or2 h TYR 248 N -0.07 0.86 -0.51 -3.82 0.05 -1.05 -2.85 116.97 109.59 2or2 h TYR 248 Ca 0.08 -0.09 -0.02 0.00 0.05 0.00 0.00 58.73 58.75 2or2 h TYR 248 Cb 0.18 -0.25 -0.02 0.00 1.01 0.00 0.00 36.73 37.65 2or2 h TYR 248 CO -0.21 0.74 0.23 0.00 -1.05 0.00 0.00 178.16 177.88 2or2 h ALA 249 N 1.02 1.46 0.00 3.88 0.00 -0.75 0.12 119.26 124.99 2or2 h ALA 249 Ca 0.17 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2or2 h ALA 249 Cb 0.29 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2or2 h ALA 249 CO -0.00 0.43 -0.02 0.66 0.00 0.00 0.00 179.25 180.31 2or2 h SER 250 N 0.71 0.00 0.00 0.00 4.64 -0.76 -0.36 113.55 117.78 2or2 h SER 250 Ca 0.18 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 61.09 2or2 h SER 250 Cb 0.09 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.12 2or2 h SER 250 CO -0.02 0.02 -2.43 -1.22 -0.87 0.00 0.00 176.83 172.32 2or2 n TYR 251 N -3.37 0.00 -0.08 4.77 4.01 -0.79 -4.50 117.16 117.21 2or2 n TYR 251 Ca -0.02 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.61 2or2 n TYR 251 Cb 0.14 -0.94 -0.04 0.00 -0.31 0.00 0.00 39.34 38.19 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 -0.50 1.20 -0.19 -0.72 2.04 -0.68 -2.16 117.51 116.50 2or2 h ILE 252 Ca -0.61 -0.65 0.04 0.00 1.00 0.00 0.00 64.86 64.64 2or2 h ILE 252 Cb 1.70 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 38.91 2or2 h ILE 252 CO -0.25 0.21 -0.08 0.78 0.00 0.00 0.00 178.15 178.80 2or2 h ASN 253 N 0.22 -0.28 -0.48 1.72 2.35 -1.28 0.12 115.58 117.95 2or2 h ASN 253 Ca 0.08 0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.79 2or2 h ASN 253 Cb 0.26 0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 2or2 h ASN 253 CO -0.00 -0.11 -0.14 -0.65 -1.65 0.00 0.00 177.43 174.87 2or2 h PRO 254 N -0.06 0.95 -0.07 0.81 0.11 -1.76 -1.78 132.00 130.19 2or2 h PRO 254 Ca 0.10 -0.38 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2or2 h PRO 254 Cb 0.21 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.27 2or2 h PRO 254 CO -0.23 1.04 0.05 1.49 -0.21 0.00 0.00 178.00 180.13 2or2 h GLU 255 N 0.80 0.09 -0.19 1.05 4.57 -1.00 -0.78 114.58 119.12 2or2 h GLU 255 Ca 0.12 -0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.15 2or2 h GLU 255 Cb 0.71 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 2or2 h GLU 255 CO 0.05 0.07 -0.46 0.82 -1.18 0.00 0.00 179.01 178.31 2or2 h ILE 256 N 0.09 1.32 -0.56 2.32 1.08 -0.78 -1.77 117.51 119.21 2or2 h ILE 256 Ca 0.03 -1.67 -0.07 0.00 -0.39 0.00 0.00 64.86 62.76 2or2 h ILE 256 Cb -0.00 1.68 -0.02 0.00 -3.07 0.00 0.00 36.82 35.40 2or2 h ILE 256 CO -0.01 0.52 0.06 0.00 -0.69 0.00 0.00 178.15 178.03 2or2 h ALA 257 N 1.11 1.05 -0.42 1.87 0.00 -1.14 -1.41 119.26 120.32 2or2 h ALA 257 Ca 0.02 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 2or2 h ALA 257 Cb 0.96 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2or2 h ALA 257 CO 0.08 0.60 -0.29 -0.91 0.00 0.00 0.00 179.25 178.74 2or2 h ASN 258 N 0.85 0.98 -0.56 0.00 2.35 -0.99 -1.59 115.58 116.62 2or2 h ASN 258 Ca 0.17 -0.43 0.02 0.00 -0.55 0.00 0.00 56.30 55.51 2or2 h ASN 258 Cb 0.43 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 2or2 h ASN 258 CO 0.01 1.20 0.35 -0.78 -1.65 0.00 0.00 177.43 176.56 2or2 h ASP 259 N 0.76 0.58 -0.24 5.81 3.58 -0.93 -0.55 116.42 125.44 2or2 h ASP 259 Ca 0.08 -0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.50 2or2 h ASP 259 Cb 0.87 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.78 2or2 h ASP 259 CO 0.08 0.41 0.05 0.40 -2.88 0.00 0.00 179.24 177.30 2or2 h ILE 260 N 0.70 1.22 -0.88 2.25 2.04 -1.19 -1.97 117.51 119.69 2or2 h ILE 260 Ca 0.22 -0.74 0.04 0.00 1.00 0.00 0.00 64.86 65.38 2or2 h ILE 260 Cb -0.02 1.25 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 2or2 h ILE 260 CO -0.08 0.23 0.56 0.50 0.00 0.00 0.00 178.15 179.37 2or2 h LYS 261 N 0.20 1.05 -0.20 2.37 3.64 -0.90 0.19 116.57 122.91 2or2 h LYS 261 Ca 0.07 -0.06 -0.18 0.00 -1.27 0.00 0.00 60.65 59.21 2or2 h LYS 261 Cb 0.31 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 2or2 h LYS 261 CO 0.00 0.69 -0.60 -0.56 -2.27 0.00 0.00 179.45 176.72 2or2 h GLN 262 N 1.08 0.67 0.00 1.90 3.07 -1.03 -3.21 115.11 117.58 2or2 h GLN 262 Ca 0.36 -0.45 -0.10 0.00 0.09 0.00 0.00 58.65 58.54 2or2 h GLN 262 Cb 0.05 0.06 -0.01 0.00 0.08 0.00 0.00 27.48 27.65 2or2 h GLN 262 CO -0.13 1.07 -0.49 0.87 0.09 0.00 0.00 178.83 180.24 2or2 h LYS 263 N 0.50 0.00 -6.60 0.06 1.57 -1.02 -3.48 116.57 107.60 2or2 h LYS 263 Ca -0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 2or2 h LYS 263 Cb 1.18 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.50 2or2 h LYS 263 CO 0.12 0.49 -0.97 -1.71 -0.57 0.00 0.00 179.45 176.81 2or2 n ASN 264 N -3.24 -4.01 -4.76 0.86 2.85 0.64 -4.92 115.26 102.69 2or2 n ASN 264 Ca 0.02 -1.15 -0.30 0.00 -0.11 0.00 0.00 54.58 53.04 2or2 n ASN 264 Cb 0.72 -2.53 0.12 0.00 1.24 0.00 0.00 39.78 39.32 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 -6.73 1.67 0.00 1.20 0.04 -1.26 -4.97 135.00 124.95 2or2 s PRO 265 Ca 0.41 0.78 0.24 0.00 0.04 0.00 0.00 61.00 62.48 2or2 s PRO 265 Cb -0.19 -1.86 0.38 0.00 0.04 0.00 0.00 34.50 32.87 2or2 s PRO 265 CO 0.92 -1.95 1.32 0.25 0.04 0.00 0.00 177.00 177.59 2or2 n THR 266 N -3.68 0.00 -3.64 1.26 -2.24 -1.26 -4.71 114.28 100.02 2or2 n THR 266 Ca 0.07 -0.08 -0.07 0.00 -2.27 0.00 0.00 64.05 61.71 2or2 n THR 266 Cb 0.55 0.58 -0.07 0.00 -2.10 0.00 0.00 70.33 69.30 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 -2.76 0.52 0.00 -0.78 3.52 -1.26 -4.71 118.95 113.48 2or2 s ARG 267 Ca 0.16 0.76 0.00 0.00 -0.13 0.00 0.00 55.73 56.52 2or2 s ARG 267 Cb 0.18 0.17 0.00 0.00 -1.56 0.00 0.00 34.95 33.74 2or2 s ARG 267 CO 0.66 -0.09 0.21 1.33 -0.81 0.00 0.00 175.30 176.59 2or2 n VAL 268 N 3.20 0.00 -2.45 7.11 0.24 -1.26 -3.80 118.33 121.36 2or2 n VAL 268 Ca -0.16 -0.36 0.00 0.00 -2.04 0.00 0.00 64.34 61.77 2or2 n VAL 268 Cb 0.57 1.16 0.00 0.00 -1.47 0.00 0.00 33.84 34.10 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 0.31 -1.87 3.39 7.63 0.00 -1.26 -4.68 105.19 108.72 2or2 n GLY 269 Ca 0.00 -1.65 -0.44 0.00 0.00 0.00 0.00 46.02 43.92 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 2.92 -0.56 1.61 0.52 0.11 -1.91 118.94 121.62 2or2 s TRP 270 Ca 0.00 -0.87 -0.20 0.00 0.02 0.00 0.00 56.10 55.05 2or2 s TRP 270 Cb 0.00 -4.09 0.07 0.00 -1.15 0.00 0.00 33.47 28.30 2or2 s TRP 270 CO 0.00 -1.39 0.75 0.08 0.02 0.00 0.00 176.95 176.41 2or2 s VAL 271 N 3.03 4.69 -0.34 4.03 1.01 -0.44 -0.32 120.40 132.07 2or2 s VAL 271 Ca 0.14 -0.48 -0.18 0.00 0.00 0.00 0.00 61.98 61.47 2or2 s VAL 271 Cb -0.22 -4.45 -0.01 0.00 0.00 0.00 0.00 36.38 31.70 2or2 s VAL 271 CO 0.07 -1.04 0.50 -0.63 0.00 0.00 0.00 175.10 174.00 2or2 s ILE 272 N 3.09 5.03 0.32 2.22 -1.09 -0.35 -1.24 121.20 129.18 2or2 s ILE 272 Ca 0.18 0.40 0.10 0.00 -2.23 0.00 0.00 60.65 59.09 2or2 s ILE 272 Cb -0.19 -3.94 -0.06 0.00 -1.58 0.00 0.00 42.46 36.69 2or2 s ILE 272 CO 0.11 -0.17 -0.11 0.00 -1.23 0.00 0.00 174.94 173.54 2or2 s GLN 273 N 2.37 1.82 0.35 2.79 -2.07 -0.27 -0.59 119.66 124.05 2or2 s GLN 273 Ca 0.19 -1.86 0.01 0.00 -1.82 0.00 0.00 55.36 51.88 2or2 s GLN 273 Cb -0.15 -1.76 -0.03 0.00 -1.09 0.00 0.00 33.01 29.97 2or2 s GLN 273 CO 0.13 0.20 0.55 -0.51 -1.32 0.00 0.00 175.29 174.34 2or2 s ASP 274 N -3.60 6.27 -0.71 12.60 1.01 -1.26 -0.55 116.67 130.43 2or2 s ASP 274 Ca 0.32 0.43 -0.09 0.00 0.71 0.00 0.00 52.55 53.92 2or2 s ASP 274 Cb -0.00 -1.99 0.01 0.00 1.01 0.00 0.00 42.92 41.95 2or2 s ASP 274 CO 0.16 -0.31 0.63 -1.22 0.21 0.00 0.00 175.17 174.64 2or2 n TYR 275 N -1.79 -2.44 -2.82 4.23 4.02 0.14 -4.94 117.16 113.55 2or2 n TYR 275 Ca -0.04 0.99 -0.42 0.00 -0.01 0.00 0.00 57.90 58.42 2or2 n TYR 275 Cb 0.56 -2.91 -0.04 0.00 -0.02 0.00 0.00 39.34 36.93 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 -2.67 4.82 0.00 -0.72 1.01 -1.26 -4.95 121.20 117.43 2or2 s ILE 276 Ca 0.09 1.74 0.00 0.00 0.00 0.00 0.00 60.65 62.48 2or2 s ILE 276 Cb -0.01 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.27 2or2 s ILE 276 CO 0.86 -0.05 0.00 -0.46 0.00 0.00 0.00 174.94 175.29 2or2 n ASN 277 N 5.66 0.00 -0.25 3.58 0.23 -1.26 -4.69 115.26 118.53 2or2 n ASN 277 Ca 0.07 -0.41 0.09 0.00 -0.53 0.00 0.00 54.58 53.79 2or2 n ASN 277 Cb 0.48 0.00 0.16 0.00 -2.08 0.00 0.00 39.78 38.34 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 1.38 0.09 -3.83 1.02 -1.26 -4.78 120.64 113.25 2or2 n GLU 278 Ca 0.00 -2.82 -0.19 0.00 -0.02 0.00 0.00 57.16 54.13 2or2 n GLU 278 Cb 0.00 -1.53 -0.11 0.00 -0.02 0.00 0.00 31.44 29.77 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 0.34 0.50 -6.33 3.49 3.64 -1.97 -3.47 116.57 112.77 2or2 h LYS 279 Ca -0.00 -0.68 -0.45 0.00 -1.27 0.00 0.00 60.65 58.25 2or2 h LYS 279 Cb 1.00 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2or2 h LYS 279 CO 0.00 1.29 -0.34 -1.58 -2.27 0.00 0.00 179.45 176.55 2or2 s TRP 280 N -2.96 3.31 -0.05 1.91 0.51 -1.26 -5.12 118.94 115.28 2or2 s TRP 280 Ca -0.07 -0.03 -0.02 0.00 -2.12 0.00 0.00 56.10 53.86 2or2 s TRP 280 Cb 0.07 -1.84 0.03 0.00 -0.81 0.00 0.00 33.47 30.92 2or2 s TRP 280 CO 0.91 0.16 0.09 0.45 -0.51 0.00 0.00 176.95 178.04 2or2 s SER 281 N -4.08 0.31 1.04 2.95 0.15 -1.26 -4.01 113.70 108.79 2or2 s SER 281 Ca 0.40 0.16 -0.15 0.00 0.70 0.00 0.00 55.95 57.07 2or2 s SER 281 Cb -0.09 0.04 0.21 0.00 -1.71 0.00 0.00 66.02 64.47 2or2 s SER 281 CO 0.31 -0.17 1.13 -2.84 1.20 0.00 0.00 173.24 172.87 2or2 s PRO 282 N 1.47 0.09 -0.27 5.44 0.02 -1.26 -4.90 135.00 135.59 2or2 s PRO 282 Ca -0.05 0.16 -0.15 0.00 0.02 0.00 0.00 61.00 60.99 2or2 s PRO 282 Cb -0.12 -1.73 -0.04 0.00 0.02 0.00 0.00 34.50 32.63 2or2 s PRO 282 CO -0.04 -2.88 0.36 -0.51 -0.33 0.00 0.00 177.00 173.60 2or2 s LEU 283 N -6.45 4.04 0.14 -5.54 1.43 -1.26 -4.62 118.68 106.42 2or2 s LEU 283 Ca 0.68 0.28 -0.29 0.00 -1.03 0.00 0.00 54.13 53.77 2or2 s LEU 283 Cb -0.13 -2.41 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 2or2 s LEU 283 CO 0.55 -0.17 1.58 0.25 0.23 0.00 0.00 176.35 178.79 2or2 h LEU 284 N 8.55 -1.38 -1.32 1.79 5.85 -1.92 -1.33 115.31 125.55 2or2 h LEU 284 Ca -0.32 0.19 0.10 0.00 0.84 0.00 0.00 57.88 58.69 2or2 h LEU 284 Cb 1.16 0.57 -0.06 0.00 0.37 0.00 0.00 40.66 42.71 2or2 h LEU 284 CO 0.64 -0.42 0.53 0.10 -0.34 0.00 0.00 178.44 178.96 2or2 h TYR 285 N -0.45 0.81 -0.33 1.25 -0.00 -1.94 -0.26 116.97 116.05 2or2 h TYR 285 Ca 0.09 0.02 -0.03 0.00 -0.00 0.00 0.00 58.73 58.81 2or2 h TYR 285 Cb 0.62 -0.26 -0.01 0.00 -0.00 0.00 0.00 36.73 37.07 2or2 h TYR 285 CO -0.53 0.37 0.10 0.37 -0.00 0.00 0.00 178.16 178.47 2or2 h GLN 286 N 0.75 0.51 -0.16 0.10 4.15 -1.62 -1.34 115.11 117.50 2or2 h GLN 286 Ca 0.38 -0.11 -0.10 0.00 0.77 0.00 0.00 58.65 59.60 2or2 h GLN 286 Cb 0.46 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 2or2 h GLN 286 CO -0.15 0.54 -0.32 0.93 -1.93 0.00 0.00 178.83 177.90 2or2 h GLU 287 N 0.37 0.32 -0.58 1.69 4.39 -0.42 -1.49 114.58 118.86 2or2 h GLU 287 Ca 0.11 -0.13 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 2or2 h GLU 287 Cb 0.25 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.86 2or2 h GLU 287 CO -0.00 0.61 0.21 0.28 -1.16 0.00 0.00 179.01 178.94 2or2 h VAL 288 N 0.28 1.23 -0.36 3.13 2.07 -0.78 -2.46 116.25 119.35 2or2 h VAL 288 Ca 0.04 -0.75 -0.05 0.00 0.82 0.00 0.00 66.70 66.75 2or2 h VAL 288 Cb 0.71 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 2or2 h VAL 288 CO 0.05 0.29 0.02 0.40 0.02 0.00 0.00 177.57 178.35 2or2 h ILE 289 N 0.80 1.25 0.00 4.57 2.04 -0.91 -2.84 117.51 122.43 2or2 h ILE 289 Ca 0.19 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 65.11 2or2 h ILE 289 Cb 0.24 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2or2 h ILE 289 CO -0.01 0.31 0.00 0.03 0.00 0.00 0.00 178.15 178.48 2or2 h ARG 290 N 0.45 0.00 0.00 2.37 3.08 -1.09 -1.80 114.38 117.39 2or2 h ARG 290 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2or2 h ARG 290 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.48 2or2 h ARG 290 CO 0.02 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.92 2or2 n ALA 291 N -1.97 2.17 0.12 0.04 0.00 -0.94 -2.02 120.51 117.91 2or2 n ALA 291 Ca -0.01 -0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.44 2or2 n ALA 291 Cb 0.13 -1.26 0.23 0.00 0.00 0.00 0.00 19.45 18.54 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 -0.93 3.51 -0.26 0.00 3.02 -0.68 -4.03 115.26 115.88 2or2 n ASN 292 Ca 0.12 -1.98 0.12 0.00 -0.03 0.00 0.00 54.58 52.81 2or2 n ASN 292 Cb 0.06 -0.30 0.38 0.00 -0.61 0.00 0.00 39.78 39.31 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 4.22 0.67 0.00 3.52 2.10 -1.62 -0.88 116.57 124.58 2or2 h LYS 293 Ca 0.00 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 2or2 h LYS 293 Cb 0.96 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 32.14 2or2 h LYS 293 CO 0.00 0.44 0.00 -1.13 -2.00 0.00 0.00 179.45 176.76 2or2 n SER 294 N -4.55 0.65 0.18 7.07 3.41 -1.26 -2.73 113.62 116.38 2or2 n SER 294 Ca 0.17 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.52 2or2 n SER 294 Cb 0.46 -0.77 0.17 0.00 -0.26 0.00 0.00 64.21 63.80 2or2 n SER 294 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2or2 h LEU 295 N 0.00 0.00 0.00 1.04 3.38 -1.48 -3.54 115.31 114.71 2or2 h LEU 295 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2or2 h LEU 295 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2or2 h LEU 295 CO 0.00 0.00 0.00 -0.38 0.09 0.00 0.00 178.44 178.15