#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gih n PHE 3 N 0.00 0.38 -0.05 0.66 3.72 -1.26 -3.73 117.46 117.19 2gih n PHE 3 Ca 0.00 0.11 -0.10 0.00 -0.05 0.00 0.00 57.45 57.41 2gih n PHE 3 Cb 0.00 -0.60 -0.15 0.00 -0.94 0.00 0.00 39.48 37.79 2gih n PHE 3 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 2gih n ILE 4 N -1.86 1.53 -0.15 4.37 5.41 -1.26 -4.37 119.36 123.03 2gih n ILE 4 Ca 0.05 -0.81 -0.03 0.00 1.00 0.00 0.00 62.75 62.96 2gih n ILE 4 Cb 0.39 -0.87 0.03 0.00 -0.71 0.00 0.00 39.64 38.48 2gih n ILE 4 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2gih h LYS 5 N 0.00 -0.01 0.09 0.38 3.64 -1.97 -1.53 116.57 117.17 2gih h LYS 5 Ca -0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 2gih h LYS 5 Cb 2.10 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.90 2gih h LYS 5 CO 0.06 -0.01 -0.26 -1.00 -2.27 0.00 0.00 179.45 175.97 2gih h PRO 6 N -0.01 -0.37 0.00 1.90 0.13 -1.76 -2.36 132.00 129.52 2gih h PRO 6 Ca 0.23 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.39 2gih h PRO 6 Cb 0.37 0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.58 2gih h PRO 6 CO -0.50 -0.25 0.00 0.44 -0.23 0.00 0.00 178.00 177.46 2gih n ILE 7 N -3.90 0.00 -1.93 -3.56 -0.00 -1.16 -4.77 119.36 104.03 2gih n ILE 7 Ca -0.04 0.00 -0.39 0.00 -0.00 0.00 0.00 62.75 62.31 2gih n ILE 7 Cb 0.20 -0.66 0.01 0.00 -0.00 0.00 0.00 39.64 39.19 2gih n ILE 7 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.55 176.08 2gih s TYR 8 N -2.00 2.62 0.00 4.28 5.04 -0.59 -1.05 117.35 125.66 2gih s TYR 8 Ca 0.28 1.34 0.00 0.00 -2.44 0.00 0.00 57.07 56.26 2gih s TYR 8 Cb 0.13 -3.79 0.00 0.00 0.35 0.00 0.00 41.96 38.65 2gih s TYR 8 CO 0.22 -2.51 0.00 1.04 -1.34 0.00 0.00 175.55 172.96 2gih n GLN 9 N -0.10 0.00 0.10 4.97 3.00 -1.26 -4.68 117.38 119.41 2gih n GLN 9 Ca 0.05 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.87 2gih n GLN 9 Cb 0.43 0.00 -0.14 0.00 0.00 0.00 0.00 30.24 30.53 2gih n GLN 9 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.06 177.44 2gih h ASP 10 N 0.70 0.46 1.20 1.08 3.04 -1.42 -0.28 116.42 121.20 2gih h ASP 10 Ca 0.00 -0.53 -0.16 0.00 -3.24 0.00 0.00 57.03 53.09 2gih h ASP 10 Cb 0.00 -0.15 -0.02 0.00 -1.04 0.00 0.00 39.33 38.12 2gih h ASP 10 CO 0.00 1.43 -0.78 -0.29 -2.04 0.00 0.00 179.24 177.55 2gih h ILE 11 N 0.08 1.35 0.07 4.15 2.10 -1.73 -1.27 117.51 122.26 2gih h ILE 11 Ca -0.18 -2.90 -0.00 0.00 1.08 0.00 0.00 64.86 62.86 2gih h ILE 11 Cb 2.01 2.66 0.00 0.00 -1.09 0.00 0.00 36.82 40.40 2gih h ILE 11 CO 0.20 0.77 -0.03 -1.13 -1.08 0.00 0.00 178.15 176.87 2gih h ASN 12 N 0.00 -0.08 0.43 2.19 -1.24 -1.82 -1.48 115.58 113.58 2gih h ASN 12 Ca -0.01 -0.28 -0.07 0.00 0.71 0.00 0.00 56.30 56.65 2gih h ASN 12 Cb 1.60 0.02 -0.01 0.00 0.73 0.00 0.00 38.32 40.66 2gih h ASN 12 CO 0.10 0.25 -0.34 0.77 -1.29 0.00 0.00 177.43 176.92 2gih h SER 13 N -0.41 0.00 1.54 1.15 4.64 -1.04 -1.99 113.55 117.43 2gih h SER 13 Ca -0.01 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.22 2gih h SER 13 Cb 0.36 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 2gih h SER 13 CO 0.02 0.34 -0.47 -0.29 -0.87 0.00 0.00 176.83 175.56 2gih h ILE 14 N 0.00 0.65 0.20 0.95 6.09 -1.17 -3.34 117.51 120.90 2gih h ILE 14 Ca -0.00 -1.94 -0.33 0.00 -1.37 0.00 0.00 64.86 61.22 2gih h ILE 14 Cb 0.65 2.30 0.02 0.00 0.47 0.00 0.00 36.82 40.25 2gih h ILE 14 CO 0.04 0.37 -1.56 -0.07 -3.07 0.00 0.00 178.15 173.87 2gih h LEU 15 N 0.00 0.67 -9.34 2.19 4.07 -0.90 -3.43 115.31 108.57 2gih h LEU 15 Ca -0.01 -0.93 -0.54 0.00 0.08 0.00 0.00 57.88 56.49 2gih h LEU 15 Cb 1.31 -0.22 0.01 0.00 1.08 0.00 0.00 40.66 42.85 2gih h LEU 15 CO 0.05 1.72 1.16 -0.63 -1.08 0.00 0.00 178.44 179.66 2gih s ILE 16 N -2.56 3.17 0.00 1.22 1.01 -0.78 -1.79 121.20 121.47 2gih s ILE 16 Ca -0.14 0.29 0.00 0.00 0.00 0.00 0.00 60.65 60.80 2gih s ILE 16 Cb 0.04 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.33 2gih s ILE 16 CO 0.88 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 176.40 2gih n GLY 17 N 4.34 1.56 3.59 6.18 0.00 -0.90 -4.97 105.19 114.98 2gih n GLY 17 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2gih n GLY 17 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2gih n GLN 18 N -0.16 -0.52 -3.68 1.61 1.13 -0.74 -4.72 117.38 110.30 2gih n GLN 18 Ca 0.00 -0.09 -0.17 0.00 -1.94 0.00 0.00 57.00 54.79 2gih n GLN 18 Cb 0.00 -2.22 -0.16 0.00 0.11 0.00 0.00 30.24 27.97 2gih n GLN 18 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2gih s LYS 19 N -4.34 0.01 -0.04 -1.09 1.02 -1.26 -2.51 119.74 111.53 2gih s LYS 19 Ca 0.64 0.48 -0.00 0.00 0.02 0.00 0.00 55.97 57.11 2gih s LYS 19 Cb -0.22 -0.32 -0.03 0.00 -0.52 0.00 0.00 37.83 36.73 2gih s LYS 19 CO 0.61 -0.29 -0.00 0.14 -0.92 0.00 0.00 175.35 174.88 2gih s VAL 20 N 2.10 4.19 0.42 3.17 -7.23 -0.38 -4.89 120.40 117.79 2gih s VAL 20 Ca 0.02 -0.44 -0.19 0.00 -1.81 0.00 0.00 61.98 59.56 2gih s VAL 20 Cb -0.12 -2.81 -0.10 0.00 0.56 0.00 0.00 36.38 33.91 2gih s VAL 20 CO -0.05 0.49 0.91 -1.59 -0.31 0.00 0.00 175.10 174.56 2gih s LYS 21 N -1.21 4.14 0.00 4.82 0.00 -1.26 -0.39 119.74 125.84 2gih s LYS 21 Ca 0.16 1.00 0.00 0.00 0.00 0.00 0.00 55.97 57.14 2gih s LYS 21 Cb -0.11 -2.22 0.00 0.00 0.00 0.00 0.00 37.83 35.49 2gih s LYS 21 CO 0.06 -0.03 0.00 2.89 0.00 0.00 0.00 175.35 178.27 2gih n ARG 22 N -0.74 3.42 -0.34 1.78 1.85 -1.26 -4.89 116.66 116.47 2gih n ARG 22 Ca 0.06 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.85 2gih n ARG 22 Cb 0.54 0.00 0.04 0.00 -1.05 0.00 0.00 32.46 31.99 2gih n ARG 22 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2gih n SER 29 N 0.00 3.42 -0.04 2.89 7.64 -1.26 -4.97 113.62 121.30 2gih n SER 29 Ca 0.00 -2.42 -0.14 0.00 1.01 0.00 0.00 58.87 57.32 2gih n SER 29 Cb 0.00 -0.63 -0.11 0.00 -1.01 0.00 0.00 64.21 62.46 2gih n SER 29 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2gih h GLY 30 N 3.22 0.03 1.85 0.23 0.00 -2.05 -3.06 103.07 103.29 2gih h GLY 30 Ca 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2gih h GLY 30 CO 0.28 0.04 0.00 -2.39 0.00 0.00 0.00 176.54 174.47 2gih n HIS 31 N -4.73 0.00 -3.50 5.60 -0.00 -1.26 -4.93 115.22 106.40 2gih n HIS 31 Ca -0.09 0.00 -0.23 0.00 -0.00 0.00 0.00 57.72 57.40 2gih n HIS 31 Cb 0.36 -0.42 0.04 0.00 -0.00 0.00 0.00 29.99 29.96 2gih n HIS 31 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2gih n ALA 32 N -1.42 -2.55 -3.39 1.59 0.00 -1.16 -5.01 120.51 108.57 2gih n ALA 32 Ca 0.08 -0.12 -0.03 0.00 0.00 0.00 0.00 53.44 53.37 2gih n ALA 32 Cb 0.24 -3.87 -0.05 0.00 0.00 0.00 0.00 19.45 15.77 2gih n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gih s ALA 33 N -3.34 -1.71 -0.24 0.00 0.00 -1.26 -4.95 121.76 110.26 2gih s ALA 33 Ca 0.36 1.63 0.14 0.00 0.00 0.00 0.00 51.96 54.09 2gih s ALA 33 Cb -0.11 -1.82 0.63 0.00 0.00 0.00 0.00 23.12 21.83 2gih s ALA 33 CO 0.82 -1.14 1.58 0.41 0.00 0.00 0.00 175.76 177.43 2gih n GLY 34 N 5.41 3.90 0.39 0.00 0.00 -1.26 -4.70 105.19 108.92 2gih n GLY 34 Ca -0.05 -1.04 0.20 0.00 0.00 0.00 0.00 46.02 45.13 2gih n GLY 34 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2gih h GLU 35 N 2.27 0.48 0.00 1.61 3.07 -1.95 -1.25 114.58 118.80 2gih h GLU 35 Ca 0.09 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 2gih h GLU 35 Cb 1.78 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 29.58 2gih h GLU 35 CO 0.41 0.32 0.08 -1.35 -1.40 0.00 0.00 179.01 177.07 2gih h PRO 36 N 0.49 0.00 -0.12 2.33 0.11 -1.97 0.61 132.00 133.45 2gih h PRO 36 Ca 0.59 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.69 2gih h PRO 36 Cb 1.32 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 2gih h PRO 36 CO -0.33 0.00 0.03 0.74 -0.21 0.00 0.00 178.00 178.22 2gih h PHE 37 N 0.00 0.16 -0.28 0.65 -1.00 -1.62 -1.36 116.94 113.50 2gih h PHE 37 Ca 0.00 -0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.82 2gih h PHE 37 Cb 0.16 -0.05 -0.04 0.00 3.61 0.00 0.00 35.95 39.63 2gih h PHE 37 CO 0.00 0.15 0.06 1.49 -1.61 0.00 0.00 178.31 178.41 2gih h GLU 38 N 0.17 0.17 -0.61 1.51 4.22 -1.07 -2.03 114.58 116.94 2gih h GLU 38 Ca 0.04 -0.01 0.11 0.00 0.08 0.00 0.00 59.36 59.59 2gih h GLU 38 Cb 0.07 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.20 2gih h GLU 38 CO -0.00 0.11 0.15 0.87 -2.18 0.00 0.00 179.01 177.96 2gih h LYS 39 N 0.17 0.28 0.00 1.92 1.79 -1.37 -1.70 116.57 117.67 2gih h LYS 39 Ca 0.13 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.58 2gih h LYS 39 Cb 0.13 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 2gih h LYS 39 CO -0.16 0.19 0.00 1.37 -1.08 0.00 0.00 179.45 179.76 2gih h LEU 40 N 0.29 0.00 -0.38 2.94 8.10 -1.39 -0.58 115.31 124.29 2gih h LEU 40 Ca 0.32 0.00 -0.16 0.00 0.11 0.00 0.00 57.88 58.15 2gih h LEU 40 Cb 0.46 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.68 2gih h LEU 40 CO -0.39 0.00 -0.40 0.58 -4.11 0.00 0.00 178.44 174.12 2gih h VAL 41 N 0.00 1.27 -0.43 0.15 2.07 -0.66 -1.42 116.25 117.23 2gih h VAL 41 Ca 0.00 -1.58 -0.06 0.00 0.82 0.00 0.00 66.70 65.88 2gih h VAL 41 Cb 0.81 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 2gih h VAL 41 CO 0.00 0.53 0.02 0.22 0.02 0.00 0.00 177.57 178.36 2gih h TYR 42 N 0.76 0.71 -0.68 1.57 3.20 -0.94 -1.24 116.97 120.35 2gih h TYR 42 Ca 0.06 -0.08 0.02 0.00 3.14 0.00 0.00 58.73 61.87 2gih h TYR 42 Cb 1.00 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 39.03 2gih h TYR 42 CO 0.06 0.66 0.43 -0.22 -1.64 0.00 0.00 178.16 177.45 2gih h LYS 43 N 0.64 0.83 0.53 1.82 3.64 -0.21 0.14 116.57 123.96 2gih h LYS 43 Ca 0.13 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.44 2gih h LYS 43 Cb 0.37 -0.19 0.01 0.00 -0.41 0.00 0.00 32.23 32.01 2gih h LYS 43 CO 0.01 0.55 -0.25 0.35 -2.27 0.00 0.00 179.45 177.84 2gih h PHE 44 N 0.85 -0.66 -0.81 1.91 3.57 -0.82 -3.18 116.94 117.80 2gih h PHE 44 Ca 0.27 -0.02 0.16 0.00 3.53 0.00 0.00 57.97 61.91 2gih h PHE 44 Cb -0.01 0.22 -0.06 0.00 2.79 0.00 0.00 35.95 38.89 2gih h PHE 44 CO -0.04 -0.34 0.54 -0.07 -2.23 0.00 0.00 178.31 176.17 2gih h LEU 45 N -1.09 0.43 -0.86 0.59 3.38 -1.11 -0.11 115.31 116.55 2gih h LEU 45 Ca -0.07 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2gih h LEU 45 Cb 0.61 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2gih h LEU 45 CO 0.12 0.21 0.00 0.50 0.09 0.00 0.00 178.44 179.36 2gih h LYS 46 N 0.45 0.00 0.00 1.13 1.63 -0.77 -1.00 116.57 118.01 2gih h LYS 46 Ca 0.41 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 60.05 2gih h LYS 46 Cb 0.92 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.52 2gih h LYS 46 CO -0.15 0.00 -1.27 0.39 -3.45 0.00 0.00 179.45 174.98 2gih n GLU 47 N -2.76 0.53 0.26 1.90 1.02 -0.16 -3.70 120.64 117.72 2gih n GLU 47 Ca 0.02 0.40 0.15 0.00 -0.02 0.00 0.00 57.16 57.71 2gih n GLU 47 Cb 0.33 -1.59 0.55 0.00 -0.02 0.00 0.00 31.44 30.71 2gih n GLU 47 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2gih h ASN 48 N -1.00 0.00 -2.03 1.62 4.21 -1.38 -3.33 115.58 113.67 2gih h ASN 48 Ca -0.24 0.00 -0.50 0.00 1.21 0.00 0.00 56.30 56.77 2gih h ASN 48 Cb 1.07 0.00 -0.40 0.00 -1.12 0.00 0.00 38.32 37.86 2gih h ASN 48 CO -0.15 0.05 -1.09 0.18 -1.29 0.00 0.00 177.43 175.14 2gih n LEU 49 N -3.15 1.60 -0.12 1.61 4.77 -0.38 -5.02 117.00 116.32 2gih n LEU 49 Ca 0.01 -5.12 -0.14 0.00 -0.03 0.00 0.00 56.01 50.73 2gih n LEU 49 Cb 0.37 0.45 -0.10 0.00 -2.33 0.00 0.00 43.42 41.81 2gih n LEU 49 CO 0.30 2.29 0.50 -1.28 -1.33 0.00 0.00 177.39 177.86 2gih h SER 50 N 2.99 -1.84 -0.20 -1.43 0.87 -1.68 -2.63 113.55 109.63 2gih h SER 50 Ca 0.10 0.24 -0.03 0.00 -1.23 0.00 0.00 61.79 60.87 2gih h SER 50 Cb 0.88 0.75 -0.02 0.00 -0.44 0.00 0.00 62.40 63.57 2gih h SER 50 CO 0.57 -0.42 0.04 -0.90 -0.53 0.00 0.00 176.83 175.58 2gih n ASP 51 N -5.39 2.60 0.00 6.23 5.75 -1.26 -3.76 116.55 120.72 2gih n ASP 51 Ca -0.04 -2.32 0.00 0.00 -0.01 0.00 0.00 54.79 52.42 2gih n ASP 51 Cb 0.35 -0.57 0.00 0.00 -1.03 0.00 0.00 41.12 39.87 2gih n ASP 51 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2gih n LEU 52 N 0.16 0.00 -4.68 -2.12 4.32 -1.11 -4.88 117.00 108.68 2gih n LEU 52 Ca 0.10 0.00 -0.41 0.00 -0.02 0.00 0.00 56.01 55.68 2gih n LEU 52 Cb 0.60 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.36 2gih n LEU 52 CO 0.12 0.00 0.58 -0.89 -1.22 0.00 0.00 177.39 175.98 2gih s THR 53 N -1.30 4.91 -0.04 -5.08 2.01 -1.01 -0.95 115.64 114.18 2gih s THR 53 Ca 0.00 1.65 -0.03 0.00 0.31 0.00 0.00 61.69 63.62 2gih s THR 53 Cb 0.00 -4.14 0.02 0.00 0.01 0.00 0.00 72.50 68.39 2gih s THR 53 CO 0.00 0.08 0.10 -0.36 -0.69 0.00 0.00 174.62 173.75 2gih s PHE 54 N 1.79 -0.10 0.39 4.92 0.08 -0.05 -4.98 117.98 120.03 2gih s PHE 54 Ca 0.40 0.30 -0.24 0.00 0.12 0.00 0.00 56.93 57.51 2gih s PHE 54 Cb -0.17 -0.04 -0.09 0.00 -0.57 0.00 0.00 43.02 42.14 2gih s PHE 54 CO 0.15 -0.09 1.04 0.15 -0.10 0.00 0.00 175.22 176.37 2gih s LYS 55 N 0.56 4.21 0.28 0.44 -0.14 -1.26 0.96 119.74 124.79 2gih s LYS 55 Ca -0.04 1.51 0.01 0.00 -1.36 0.00 0.00 55.97 56.08 2gih s LYS 55 Cb -0.06 -2.58 0.66 0.00 -1.68 0.00 0.00 37.83 34.17 2gih s LYS 55 CO -0.02 -0.10 1.67 0.37 -0.76 0.00 0.00 175.35 176.51 2gih h GLN 56 N 2.59 0.27 -0.05 1.68 4.15 -1.77 0.22 115.11 122.20 2gih h GLN 56 Ca -0.48 -0.02 -0.12 0.00 0.77 0.00 0.00 58.65 58.80 2gih h GLN 56 Cb 1.21 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.83 2gih h GLN 56 CO 0.63 0.18 -0.53 0.10 -1.93 0.00 0.00 178.83 177.27 2gih h TYR 57 N 0.28 0.18 -0.37 3.99 -0.00 -1.91 -2.79 116.97 116.35 2gih h TYR 57 Ca 0.52 -0.06 -0.08 0.00 0.00 0.00 0.00 58.73 59.12 2gih h TYR 57 Cb 1.00 -0.03 -0.02 0.00 0.00 0.00 0.00 36.73 37.68 2gih h TYR 57 CO -0.23 0.65 -0.09 1.49 -0.00 0.00 0.00 178.16 179.98 2gih h GLU 58 N 0.11 0.62 -0.35 0.10 4.81 -0.95 -2.28 114.58 116.65 2gih h GLU 58 Ca 0.00 -0.18 -0.13 0.00 -0.13 0.00 0.00 59.36 58.92 2gih h GLU 58 Cb 0.98 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 2gih h GLU 58 CO 0.08 0.71 -0.30 -0.92 -0.73 0.00 0.00 179.01 177.84 2gih h TYR 59 N 0.58 0.87 -0.15 0.92 5.03 -0.96 -2.38 116.97 120.88 2gih h TYR 59 Ca 0.11 -0.22 -0.15 0.00 2.58 0.00 0.00 58.73 61.04 2gih h TYR 59 Cb 0.50 -0.20 -0.01 0.00 1.55 0.00 0.00 36.73 38.57 2gih h TYR 59 CO 0.02 0.96 -0.55 -0.07 -1.32 0.00 0.00 178.16 177.20 2gih h LEU 60 N 0.64 0.49 -0.27 2.82 3.38 -1.34 -0.68 115.31 120.35 2gih h LEU 60 Ca 0.07 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2gih h LEU 60 Cb 0.82 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2gih h LEU 60 CO 0.07 0.94 0.15 0.78 0.09 0.00 0.00 178.44 180.47 2gih h ASN 61 N 0.34 0.34 0.00 -0.43 2.35 -1.31 -1.88 115.58 114.98 2gih h ASN 61 Ca 0.01 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.67 2gih h ASN 61 Cb 1.07 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.35 2gih h ASN 61 CO 0.10 0.33 -0.00 -0.78 -1.65 0.00 0.00 177.43 175.42 2gih h ASP 62 N 0.33 -0.00 -0.10 5.81 1.82 -1.26 0.26 116.42 123.27 2gih h ASP 62 Ca 0.10 -0.09 0.03 0.00 -0.39 0.00 0.00 57.03 56.67 2gih h ASP 62 Cb 0.06 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.07 2gih h ASP 62 CO -0.02 0.09 0.07 0.25 -1.61 0.00 0.00 179.24 178.03 2gih h LEU 63 N -0.10 0.00 0.00 2.28 5.85 -1.02 -1.24 115.31 121.09 2gih h LEU 63 Ca -0.00 0.00 -0.24 0.00 0.84 0.00 0.00 57.88 58.48 2gih h LEU 63 Cb 0.10 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 2gih h LEU 63 CO 0.00 0.00 -1.40 -0.26 -0.34 0.00 0.00 178.44 176.44 2gih h PHE 64 N 0.00 0.00 0.00 1.25 -1.00 -0.99 -3.34 116.94 112.86 2gih h PHE 64 Ca 0.05 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.79 2gih h PHE 64 Cb 0.19 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.74 2gih h PHE 64 CO 0.00 0.90 -0.20 0.52 -1.61 0.00 0.00 178.31 177.92 2gih h MET 65 N 0.00 0.00 -0.51 1.51 2.86 0.38 -3.17 114.93 116.00 2gih h MET 65 Ca -0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2gih h MET 65 Cb 1.84 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.50 2gih h MET 65 CO 0.09 0.20 0.00 1.63 1.06 0.00 0.00 176.91 179.88 2gih n LYS 66 N -3.19 2.22 -2.98 1.72 4.01 -0.55 -4.26 118.16 115.14 2gih n LYS 66 Ca 0.02 -1.81 -0.14 0.00 -0.51 0.00 0.00 58.31 55.87 2gih n LYS 66 Cb 0.56 -1.41 0.02 0.00 -0.51 0.00 0.00 35.03 33.68 2gih n LYS 66 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2gih n ASN 67 N 0.94 -0.15 -0.27 4.39 4.13 -1.20 -4.99 115.26 118.12 2gih n ASN 67 Ca 0.17 -3.14 0.02 0.00 1.68 0.00 0.00 54.58 53.30 2gih n ASN 67 Cb 0.44 0.20 0.23 0.00 -1.54 0.00 0.00 39.78 39.12 2gih n ASN 67 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2gih h PRO 68 N 2.95 1.02 0.00 3.52 0.13 -1.74 -1.66 132.00 136.21 2gih h PRO 68 Ca 0.00 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2gih h PRO 68 Cb 1.05 -0.23 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2gih h PRO 68 CO 0.36 0.67 0.00 0.00 -0.23 0.00 0.00 178.00 178.81 2gih n ALA 69 N -2.41 1.27 -2.62 -0.56 0.00 -1.26 -4.46 120.51 110.46 2gih n ALA 69 Ca 0.11 0.13 -0.39 0.00 0.00 0.00 0.00 53.44 53.29 2gih n ALA 69 Cb 0.11 -1.30 -0.11 0.00 0.00 0.00 0.00 19.45 18.15 2gih n ALA 69 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2gih s ILE 70 N -3.39 5.13 0.41 0.00 1.01 -0.63 -5.07 121.20 118.67 2gih s ILE 70 Ca 0.00 -0.16 0.05 0.00 0.00 0.00 0.00 60.65 60.54 2gih s ILE 70 Cb 0.07 -3.58 -0.02 0.00 0.01 0.00 0.00 42.46 38.94 2gih s ILE 70 CO 0.24 0.08 0.17 0.27 0.00 0.00 0.00 174.94 175.70 2gih s ILE 71 N 1.71 0.41 0.00 2.92 -0.00 -1.26 -4.83 121.20 120.14 2gih s ILE 71 Ca 0.06 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 58.71 2gih s ILE 71 Cb -0.17 -2.32 0.00 0.00 -0.00 0.00 0.00 42.46 39.97 2gih s ILE 71 CO 0.10 0.00 0.00 0.61 -0.00 0.00 0.00 174.94 175.65 2gih n GLY 72 N -0.89 -1.65 0.22 6.27 0.00 -1.26 -4.20 105.19 103.68 2gih n GLY 72 Ca -0.04 -1.38 -0.03 0.00 0.00 0.00 0.00 46.02 44.57 2gih n GLY 72 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 2gih h HIS 73 N 0.00 0.42 -0.15 1.61 2.07 -1.84 -2.28 115.15 114.98 2gih h HIS 73 Ca 0.00 -0.10 -0.03 0.00 -2.85 0.00 0.00 60.37 57.39 2gih h HIS 73 Cb 0.00 -0.10 -0.00 0.00 2.57 0.00 0.00 27.41 29.88 2gih h HIS 73 CO 0.00 0.65 -0.03 0.93 -3.07 0.00 0.00 177.93 176.41 2gih h GLU 74 N 0.32 0.29 -0.12 5.12 3.07 -1.95 -2.80 114.58 118.51 2gih h GLU 74 Ca 0.04 -0.11 -0.20 0.00 -0.50 0.00 0.00 59.36 58.59 2gih h GLU 74 Cb 0.72 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 28.63 2gih h GLU 74 CO 0.06 0.56 -0.71 0.00 -1.40 0.00 0.00 179.01 177.52 2gih h ALA 75 N 0.72 0.25 0.00 3.43 0.00 -1.73 -3.15 119.26 118.78 2gih h ALA 75 Ca 0.04 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 2gih h ALA 75 Cb 0.45 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2gih h ALA 75 CO 0.01 0.58 -0.07 0.00 0.00 0.00 0.00 179.25 179.77 2gih h ARG 76 N 0.38 0.00 -0.22 0.00 3.08 -1.48 -1.74 114.38 114.40 2gih h ARG 76 Ca -0.05 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.82 2gih h ARG 76 Cb 1.35 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.39 2gih h ARG 76 CO 0.15 0.07 -0.56 1.88 -1.07 0.00 0.00 179.97 180.44 2gih h TYR 77 N 0.00 0.84 -0.01 3.04 0.05 -1.47 -2.94 116.97 116.49 2gih h TYR 77 Ca -0.00 -0.30 0.00 0.00 0.05 0.00 0.00 58.73 58.48 2gih h TYR 77 Cb 0.14 -0.16 -0.00 0.00 1.01 0.00 0.00 36.73 37.72 2gih h TYR 77 CO 0.00 1.07 0.03 0.87 -1.05 0.00 0.00 178.16 179.08 2gih h LYS 78 N 0.51 0.00 0.00 4.88 1.79 -1.28 -2.47 116.57 120.01 2gih h LYS 78 Ca 0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2gih h LYS 78 Cb 1.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 2gih h LYS 78 CO 0.11 0.00 0.00 -0.07 -1.08 0.00 0.00 179.45 178.41 2gih h LEU 79 N 0.00 0.00 -0.28 2.94 3.38 -1.47 -1.54 115.31 118.34 2gih h LEU 79 Ca 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2gih h LEU 79 Cb 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2gih h LEU 79 CO -0.00 0.00 -0.14 -0.26 0.09 0.00 0.00 178.44 178.13 2gih h PHE 80 N 0.00 0.00 -1.96 1.13 -1.00 -1.64 -3.47 116.94 110.00 2gih h PHE 80 Ca 0.00 0.00 -0.26 0.00 2.81 0.00 0.00 57.97 60.52 2gih h PHE 80 Cb 0.19 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 39.67 2gih h PHE 80 CO 0.00 0.14 -0.26 0.09 -1.61 0.00 0.00 178.31 176.67 2gih n ASN 81 N -3.16 -3.56 -3.44 2.17 3.02 -0.58 -4.87 115.26 104.84 2gih n ASN 81 Ca 0.03 0.29 -0.03 0.00 -0.03 0.00 0.00 54.58 54.83 2gih n ASN 81 Cb 0.54 -3.26 -0.05 0.00 -0.61 0.00 0.00 39.78 36.41 2gih n ASN 81 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2gih s SER 82 N -2.08 -0.73 0.45 6.41 0.15 -1.26 -5.03 113.70 111.61 2gih s SER 82 Ca 0.00 0.95 0.13 0.00 0.70 0.00 0.00 55.95 57.73 2gih s SER 82 Cb 0.00 1.80 1.04 0.00 -1.71 0.00 0.00 66.02 67.15 2gih s SER 82 CO 0.00 -0.25 2.04 -0.65 1.20 0.00 0.00 173.24 175.58 2gih h PRO 83 N 8.08 0.35 -0.03 5.44 0.11 -1.95 0.33 132.00 144.33 2gih h PRO 83 Ca -0.19 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.87 2gih h PRO 83 Cb 1.13 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2gih h PRO 83 CO 0.19 0.23 -0.09 1.15 -0.21 0.00 0.00 178.00 179.27 2gih h THR 84 N 0.36 1.48 -0.71 -1.15 2.02 -1.96 -1.53 112.91 111.42 2gih h THR 84 Ca 0.18 -1.55 -0.05 0.00 0.77 0.00 0.00 66.41 65.76 2gih h THR 84 Cb 0.26 2.44 -0.03 0.00 -1.74 0.00 0.00 68.15 69.08 2gih h THR 84 CO -0.04 0.42 0.25 0.25 0.37 0.00 0.00 175.52 176.76 2gih h LEU 85 N -0.48 0.99 -0.18 2.58 7.12 -1.85 -1.93 115.31 121.57 2gih h LEU 85 Ca -0.00 -0.17 0.03 0.00 0.13 0.00 0.00 57.88 57.87 2gih h LEU 85 Cb 0.73 -0.26 -0.03 0.00 -0.53 0.00 0.00 40.66 40.57 2gih h LEU 85 CO 0.02 0.91 0.01 0.25 -0.13 0.00 0.00 178.44 179.50 2gih h LEU 86 N 1.04 -0.05 -0.60 2.25 5.85 -0.35 -1.32 115.31 122.13 2gih h LEU 86 Ca 0.23 0.04 0.02 0.00 0.84 0.00 0.00 57.88 59.01 2gih h LEU 86 Cb 0.25 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 2gih h LEU 86 CO -0.01 -0.00 0.38 0.15 -0.34 0.00 0.00 178.44 178.62 2gih h PHE 87 N 0.07 0.72 -0.22 1.25 3.57 -0.72 -1.68 116.94 119.93 2gih h PHE 87 Ca 0.08 0.02 -0.20 0.00 3.53 0.00 0.00 57.97 61.40 2gih h PHE 87 Cb 0.10 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.60 2gih h PHE 87 CO -0.16 0.43 -0.65 -0.07 -2.23 0.00 0.00 178.31 175.63 2gih h LEU 88 N 0.77 0.92 0.00 0.59 3.38 -1.05 -3.39 115.31 116.53 2gih h LEU 88 Ca 0.23 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.66 2gih h LEU 88 Cb -0.03 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.45 2gih h LEU 88 CO -0.08 1.34 -1.44 0.18 0.09 0.00 0.00 178.44 178.53 2gih n LEU 89 N -3.97 0.09 -4.74 1.67 4.77 -0.52 -4.33 117.00 109.97 2gih n LEU 89 Ca -0.06 -0.08 -0.31 0.00 -0.03 0.00 0.00 56.01 55.54 2gih n LEU 89 Cb 0.68 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.89 2gih n LEU 89 CO 0.51 0.02 0.69 -0.94 -1.33 0.00 0.00 177.39 176.34 2gih s SER 90 N -3.29 4.02 0.39 -1.43 1.04 -0.64 -5.00 113.70 108.79 2gih s SER 90 Ca -0.03 1.84 0.08 0.00 0.48 0.00 0.00 55.95 58.31 2gih s SER 90 Cb 0.08 -2.48 -0.03 0.00 0.10 0.00 0.00 66.02 63.70 2gih s SER 90 CO 0.53 -2.35 0.28 -0.13 0.98 0.00 0.00 173.24 172.55 2gih s ARG 91 N -4.86 2.45 1.09 4.02 0.52 -1.26 -5.01 118.95 115.91 2gih s ARG 91 Ca 0.63 -1.58 -0.16 0.00 -0.52 0.00 0.00 55.73 54.09 2gih s ARG 91 Cb -0.18 -2.26 0.12 0.00 0.52 0.00 0.00 34.95 33.15 2gih s ARG 91 CO 0.57 -0.08 0.28 0.41 0.02 0.00 0.00 175.30 176.50 2gih n GLY 92 N -1.38 -2.26 0.27 -3.53 0.00 -1.26 -4.64 105.19 92.39 2gih n GLY 92 Ca 0.01 -0.84 -0.14 0.00 0.00 0.00 0.00 46.02 45.05 2gih n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gih h LYS 93 N -2.06 -0.49 -0.79 1.61 1.57 -1.98 -1.26 116.57 113.17 2gih h LYS 93 Ca -0.53 0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.29 2gih h LYS 93 Cb 1.34 0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.72 2gih h LYS 93 CO 0.39 -0.33 0.51 0.00 -0.57 0.00 0.00 179.45 179.46 2gih h ALA 94 N 0.16 1.00 -0.46 3.86 0.00 -1.97 1.31 119.26 123.16 2gih h ALA 94 Ca -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2gih h ALA 94 Cb 0.47 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2gih h ALA 94 CO -0.04 0.42 0.11 0.00 0.00 0.00 0.00 179.25 179.75 2gih h ALA 95 N 1.28 1.34 0.06 0.00 0.00 -1.87 0.41 119.26 120.48 2gih h ALA 95 Ca 0.29 -0.18 -0.25 0.00 0.00 0.00 0.00 54.91 54.77 2gih h ALA 95 Cb -0.11 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2gih h ALA 95 CO -0.06 0.47 -1.19 1.15 0.00 0.00 0.00 179.25 179.62 2gih h THR 96 N 0.68 1.52 -0.21 0.00 2.02 -0.40 -1.93 112.91 114.59 2gih h THR 96 Ca 0.15 -3.18 -0.16 0.00 0.77 0.00 0.00 66.41 64.00 2gih h THR 96 Cb 0.25 2.85 -0.01 0.00 -1.74 0.00 0.00 68.15 69.50 2gih h THR 96 CO -0.00 0.90 -0.51 -0.08 0.37 0.00 0.00 175.52 176.20 2gih h GLU 97 N 0.03 0.59 0.00 6.66 4.57 0.22 -3.22 114.58 123.43 2gih h GLU 97 Ca -0.10 -0.35 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 2gih h GLU 97 Cb 1.89 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 30.51 2gih h GLU 97 CO 0.16 0.96 -0.56 0.09 -1.18 0.00 0.00 179.01 178.47 2gih n ASN 98 N -3.98 0.56 -4.67 1.04 5.03 0.14 -4.71 115.26 108.66 2gih n ASN 98 Ca -0.03 -0.10 -0.41 0.00 0.87 0.00 0.00 54.58 54.91 2gih n ASN 98 Cb 0.58 0.24 0.01 0.00 -1.02 0.00 0.00 39.78 39.59 2gih n ASN 98 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.26 177.30 2gih n TRP 99 N -1.73 1.79 -3.56 3.10 -0.00 -0.73 -4.88 117.44 111.44 2gih n TRP 99 Ca 0.05 0.53 -0.14 0.00 -0.00 0.00 0.00 57.50 57.93 2gih n TRP 99 Cb 0.38 -2.32 -0.05 0.00 -0.00 0.00 0.00 31.31 29.31 2gih n TRP 99 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 177.69 176.15 2gih s SER 100 N -0.60 -0.46 0.10 5.87 1.04 -1.26 -4.95 113.70 113.43 2gih s SER 100 Ca 0.62 0.20 0.06 0.00 0.48 0.00 0.00 55.95 57.30 2gih s SER 100 Cb -0.53 0.50 0.31 0.00 0.10 0.00 0.00 66.02 66.40 2gih s SER 100 CO 0.58 -0.73 1.12 -0.38 0.98 0.00 0.00 173.24 174.81 2gih n ILE 101 N 0.38 1.49 -0.05 -1.02 5.41 -1.26 -0.19 119.36 124.11 2gih n ILE 101 Ca -0.18 0.57 -0.02 0.00 1.00 0.00 0.00 62.75 64.12 2gih n ILE 101 Cb 0.60 -1.57 -0.13 0.00 -0.71 0.00 0.00 39.64 37.83 2gih n ILE 101 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2gih n GLU 102 N -1.67 1.11 -0.05 0.38 -0.58 -1.26 -4.67 120.64 113.90 2gih n GLU 102 Ca -0.00 -0.06 -0.02 0.00 -0.42 0.00 0.00 57.16 56.66 2gih n GLU 102 Cb 0.08 -1.41 -0.01 0.00 -0.57 0.00 0.00 31.44 29.54 2gih n GLU 102 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 2gih h ASN 103 N 0.00 0.00 -4.04 1.62 -1.24 -0.92 -3.51 115.58 107.49 2gih h ASN 103 Ca -0.28 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.73 2gih h ASN 103 Cb 1.56 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.61 2gih h ASN 103 CO 0.02 0.54 -0.96 0.18 -1.29 0.00 0.00 177.43 175.91 2gih n LEU 104 N -4.36 -2.94 -4.78 0.34 4.77 0.73 -4.90 117.00 105.87 2gih n LEU 104 Ca -0.03 3.25 -0.35 0.00 -0.03 0.00 0.00 56.01 58.85 2gih n LEU 104 Cb 0.11 -3.31 -0.01 0.00 -2.33 0.00 0.00 43.42 37.89 2gih n LEU 104 CO 0.04 0.29 0.77 -0.36 -1.33 0.00 0.00 177.39 176.81 2gih s PHE 105 N -3.30 2.79 0.07 -1.77 2.99 -1.26 -4.98 117.98 112.52 2gih s PHE 105 Ca 0.00 1.55 0.00 0.00 0.00 0.00 0.00 56.93 58.48 2gih s PHE 105 Cb 0.00 -3.24 -0.00 0.00 0.00 0.00 0.00 43.02 39.78 2gih s PHE 105 CO 0.00 -1.36 0.00 0.39 -0.00 0.00 0.00 175.22 174.25 2gih n GLU 106 N -1.07 1.79 -2.79 0.44 1.02 -1.26 -4.86 120.64 113.91 2gih n GLU 106 Ca 0.10 -0.53 -0.40 0.00 -0.02 0.00 0.00 57.16 56.31 2gih n GLU 106 Cb 0.51 0.15 -0.06 0.00 -0.02 0.00 0.00 31.44 32.02 2gih n GLU 106 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2gih s GLU 107 N -2.26 4.80 -0.04 3.49 2.12 -1.26 -4.71 118.70 120.84 2gih s GLU 107 Ca 0.00 1.42 0.06 0.00 0.36 0.00 0.00 54.97 56.81 2gih s GLU 107 Cb 0.00 -3.28 -0.01 0.00 0.26 0.00 0.00 34.13 31.10 2gih s GLU 107 CO 0.00 0.52 -0.22 -1.59 -0.54 0.00 0.00 175.26 173.43 2gih s LYS 108 N -1.12 2.05 0.51 4.30 0.00 -1.26 -5.02 119.74 119.20 2gih s LYS 108 Ca 0.40 -0.77 0.23 0.00 0.00 0.00 0.00 55.97 55.83 2gih s LYS 108 Cb -0.25 -1.82 1.32 0.00 0.00 0.00 0.00 37.83 37.07 2gih s LYS 108 CO 0.31 0.37 2.00 0.37 0.00 0.00 0.00 175.35 178.40 2gih h GLN 109 N 5.96 0.08 0.00 1.78 4.15 -2.03 -2.27 115.11 122.78 2gih h GLN 109 Ca -0.35 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.07 2gih h GLN 109 Cb 1.16 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.83 2gih h GLN 109 CO 0.47 0.05 -0.07 0.09 -1.93 0.00 0.00 178.83 177.45 2gih n ASN 110 N -4.41 0.26 -4.66 -0.69 3.02 -1.26 -4.95 115.26 102.57 2gih n ASN 110 Ca 0.09 0.44 -0.45 0.00 -0.03 0.00 0.00 54.58 54.63 2gih n ASN 110 Cb 0.54 -0.48 -0.02 0.00 -0.61 0.00 0.00 39.78 39.20 2gih n ASN 110 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2gih n ASP 111 N -1.70 2.52 -0.08 6.41 8.00 -0.86 -4.91 116.55 125.93 2gih n ASP 111 Ca 0.06 1.16 -0.06 0.00 0.71 0.00 0.00 54.79 56.65 2gih n ASP 111 Cb 0.36 -1.41 -0.00 0.00 -0.02 0.00 0.00 41.12 40.05 2gih n ASP 111 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2gih h THR 112 N 2.86 0.70 -2.70 -3.53 2.02 -1.93 -3.44 112.91 106.90 2gih h THR 112 Ca -0.45 -0.00 -0.63 0.00 0.77 0.00 0.00 66.41 66.10 2gih h THR 112 Cb 1.29 0.69 -0.16 0.00 -1.74 0.00 0.00 68.15 68.23 2gih h THR 112 CO 0.72 0.00 -0.78 0.00 0.37 0.00 0.00 175.52 175.83 2gih s ALA 113 N -6.21 2.69 -0.15 6.16 0.00 -1.26 -4.94 121.76 118.05 2gih s ALA 113 Ca -0.14 -1.74 -0.17 0.00 0.00 0.00 0.00 51.96 49.92 2gih s ALA 113 Cb 0.12 -0.35 -0.14 0.00 0.00 0.00 0.00 23.12 22.76 2gih s ALA 113 CO 0.70 0.36 0.26 -0.44 0.00 0.00 0.00 175.76 176.63 2gih h ASP 114 N 2.70 0.00 -4.26 0.00 3.32 -1.65 -3.40 116.42 113.13 2gih h ASP 114 Ca -0.43 -0.44 -0.68 0.00 0.02 0.00 0.00 57.03 55.49 2gih h ASP 114 Cb 1.23 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.52 2gih h ASP 114 CO 0.54 0.98 -0.88 -0.63 -1.72 0.00 0.00 179.24 177.54 2gih s ILE 115 N -2.12 2.10 -0.13 0.35 1.01 -0.70 -3.27 121.20 118.44 2gih s ILE 115 Ca -0.17 -1.41 -0.00 0.00 0.00 0.00 0.00 60.65 59.07 2gih s ILE 115 Cb 0.01 -1.81 0.03 0.00 0.01 0.00 0.00 42.46 40.70 2gih s ILE 115 CO 0.42 0.32 -0.08 -0.22 0.00 0.00 0.00 174.94 175.38 2gih s LEU 116 N -1.32 1.41 -0.33 2.97 2.96 0.27 -0.60 118.68 124.04 2gih s LEU 116 Ca 0.12 -0.44 -0.09 0.00 -0.22 0.00 0.00 54.13 53.50 2gih s LEU 116 Cb -0.10 -0.94 0.01 0.00 0.50 0.00 0.00 46.19 45.66 2gih s LEU 116 CO 0.02 -0.12 0.15 -0.76 -1.32 0.00 0.00 176.35 174.33 2gih s LEU 117 N 1.64 4.28 -0.05 -0.68 1.02 -0.85 -0.87 118.68 123.17 2gih s LEU 117 Ca 0.04 -0.75 0.03 0.00 0.02 0.00 0.00 54.13 53.46 2gih s LEU 117 Cb -0.13 -1.98 -0.03 0.00 0.02 0.00 0.00 46.19 44.07 2gih s LEU 117 CO -0.09 -0.27 -0.13 -0.69 0.02 0.00 0.00 176.35 175.20 2gih s VAL 118 N 1.56 3.18 -0.30 -1.59 1.01 -0.13 -0.69 120.40 123.45 2gih s VAL 118 Ca 0.03 -0.68 -0.09 0.00 0.00 0.00 0.00 61.98 61.25 2gih s VAL 118 Cb -0.18 -2.26 0.18 0.00 0.00 0.00 0.00 36.38 34.12 2gih s VAL 118 CO 0.05 0.59 0.87 -0.54 0.00 0.00 0.00 175.10 176.07 2gih s LYS 119 N -0.73 0.35 -0.71 2.72 1.02 -0.63 -4.39 119.74 117.37 2gih s LYS 119 Ca 0.11 0.63 -0.03 0.00 0.02 0.00 0.00 55.97 56.70 2gih s LYS 119 Cb -0.11 0.35 -0.04 0.00 -0.52 0.00 0.00 37.83 37.52 2gih s LYS 119 CO 0.01 -0.36 0.62 -0.25 -0.92 0.00 0.00 175.35 174.45 2gih n ASP 120 N 5.43 -4.45 -0.73 2.83 10.43 -1.26 -3.20 116.55 125.59 2gih n ASP 120 Ca -0.05 -0.46 -0.09 0.00 2.57 0.00 0.00 54.79 56.76 2gih n ASP 120 Cb 0.53 -3.60 -0.04 0.00 1.84 0.00 0.00 41.12 39.85 2gih n ASP 120 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2gih n GLN 121 N -2.72 -1.73 -4.88 -1.24 10.64 -1.26 -4.95 117.38 111.23 2gih n GLN 121 Ca -0.08 0.78 -0.32 0.00 -1.83 0.00 0.00 57.00 55.55 2gih n GLN 121 Cb 0.59 -5.12 -0.13 0.00 -0.86 0.00 0.00 30.24 24.71 2gih n GLN 121 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.06 175.35 2gih s PHE 122 N -1.72 2.59 0.05 2.61 5.36 -1.19 -4.90 117.98 120.78 2gih s PHE 122 Ca 0.00 -0.24 0.08 0.00 -0.96 0.00 0.00 56.93 55.81 2gih s PHE 122 Cb 0.00 -1.55 -0.03 0.00 -0.34 0.00 0.00 43.02 41.10 2gih s PHE 122 CO 0.00 0.17 -0.23 0.71 -1.46 0.00 0.00 175.22 174.41 2gih s TYR 123 N -0.78 2.00 -0.34 10.12 1.51 -0.22 -1.61 117.35 128.04 2gih s TYR 123 Ca 0.12 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.81 2gih s TYR 123 Cb -0.10 -1.19 0.10 0.00 -0.11 0.00 0.00 41.96 40.66 2gih s TYR 123 CO 0.02 0.12 0.09 -2.00 -1.11 0.00 0.00 175.55 172.66 2gih s GLU 124 N -1.25 1.16 -0.47 -0.62 2.12 0.14 -2.56 118.70 117.22 2gih s GLU 124 Ca 0.09 -1.57 -0.28 0.00 0.36 0.00 0.00 54.97 53.56 2gih s GLU 124 Cb -0.09 -2.66 0.01 0.00 0.26 0.00 0.00 34.13 31.65 2gih s GLU 124 CO 0.02 -0.98 1.39 -0.51 -0.54 0.00 0.00 175.26 174.64 2gih s LEU 125 N 1.14 3.53 -0.18 2.70 1.02 -0.28 -2.01 118.68 124.60 2gih s LEU 125 Ca 0.11 0.62 -0.09 0.00 0.02 0.00 0.00 54.13 54.79 2gih s LEU 125 Cb -0.19 -3.39 -0.05 0.00 0.02 0.00 0.00 46.19 42.58 2gih s LEU 125 CO -0.15 -1.50 0.11 -0.22 0.02 0.00 0.00 176.35 174.61 2gih s LEU 126 N 5.54 4.13 -0.12 1.79 2.96 0.23 -1.34 118.68 131.87 2gih s LEU 126 Ca 0.57 0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.73 2gih s LEU 126 Cb -0.12 -2.05 0.02 0.00 0.50 0.00 0.00 46.19 44.54 2gih s LEU 126 CO 0.30 0.23 -0.15 -0.62 -1.32 0.00 0.00 176.35 174.79 2gih s ASP 127 N 0.07 2.49 -0.10 3.68 -1.08 -0.98 -1.72 116.67 119.03 2gih s ASP 127 Ca 0.08 -0.44 -0.19 0.00 -0.52 0.00 0.00 52.55 51.48 2gih s ASP 127 Cb -0.11 -1.10 -0.04 0.00 -1.46 0.00 0.00 42.92 40.20 2gih s ASP 127 CO -0.00 -0.01 0.53 -0.69 0.52 0.00 0.00 175.17 175.52 2gih s VAL 128 N 1.15 5.14 -0.05 1.11 1.01 -1.26 -2.67 120.40 124.83 2gih s VAL 128 Ca -0.03 1.08 0.03 0.00 0.00 0.00 0.00 61.98 63.06 2gih s VAL 128 Cb -0.14 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 2gih s VAL 128 CO -0.04 0.32 -0.13 -0.54 0.00 0.00 0.00 175.10 174.70 2gih s LYS 129 N 0.57 2.51 -0.10 2.72 -0.14 0.14 -4.96 119.74 120.49 2gih s LYS 129 Ca 0.29 -0.69 0.02 0.00 -1.36 0.00 0.00 55.97 54.23 2gih s LYS 129 Cb -0.16 -2.39 0.01 0.00 -1.68 0.00 0.00 37.83 33.61 2gih s LYS 129 CO 0.12 0.62 -0.17 0.95 -0.76 0.00 0.00 175.35 176.12 2gih s THR 130 N -0.76 1.54 -0.09 2.17 -4.23 -1.26 0.31 115.64 113.33 2gih s THR 130 Ca 0.12 -0.69 0.04 0.00 -1.18 0.00 0.00 61.69 59.97 2gih s THR 130 Cb -0.11 -1.38 0.00 0.00 1.34 0.00 0.00 72.50 72.35 2gih s THR 130 CO 0.01 0.45 -0.21 -0.60 -0.54 0.00 0.00 174.62 173.72 2gih s ARG 131 N 0.75 2.72 -0.88 3.99 3.52 -0.58 -4.89 118.95 123.58 2gih s ARG 131 Ca -0.11 -0.78 -0.22 0.00 -0.13 0.00 0.00 55.73 54.49 2gih s ARG 131 Cb -0.16 -2.09 0.08 0.00 -1.56 0.00 0.00 34.95 31.22 2gih s ARG 131 CO 0.02 0.15 1.21 1.21 -0.81 0.00 0.00 175.30 177.09 2gih s ASN 132 N 0.39 6.45 0.00 -2.12 3.04 -1.26 -0.72 114.94 120.71 2gih s ASN 132 Ca -0.17 -1.49 0.05 0.00 0.04 0.00 0.00 52.86 51.29 2gih s ASN 132 Cb -0.17 -2.47 0.23 0.00 -1.54 0.00 0.00 41.25 37.30 2gih s ASN 132 CO 0.08 -1.36 1.08 2.30 -3.04 0.00 0.00 177.10 176.16 2gih n ILE 133 N 6.10 1.30 0.04 -5.21 -6.64 -1.06 -2.36 119.36 111.52 2gih n ILE 133 Ca 0.19 0.32 -0.10 0.00 -1.77 0.00 0.00 62.75 61.39 2gih n ILE 133 Cb 0.49 -1.24 0.03 0.00 -1.44 0.00 0.00 39.64 37.48 2gih n ILE 133 CO 0.00 0.00 0.00 -1.28 -1.77 0.00 0.00 176.55 173.50 2gih h SER 134 N 0.00 0.53 -3.64 7.28 0.87 -1.89 -3.45 113.55 113.24 2gih h SER 134 Ca 0.00 -0.33 -0.46 0.00 -1.23 0.00 0.00 61.79 59.77 2gih h SER 134 Cb 0.07 -0.16 0.10 0.00 -0.44 0.00 0.00 62.40 61.97 2gih h SER 134 CO 0.00 1.07 0.28 -0.54 -0.53 0.00 0.00 176.83 177.11 2gih s LYS 135 N -3.71 1.65 0.25 2.24 1.02 -1.00 -5.05 119.74 115.15 2gih s LYS 135 Ca -0.06 -0.41 -0.30 0.00 0.02 0.00 0.00 55.97 55.22 2gih s LYS 135 Cb 0.11 -2.09 -0.09 0.00 -0.52 0.00 0.00 37.83 35.24 2gih s LYS 135 CO 0.84 -1.64 1.07 0.45 -0.92 0.00 0.00 175.35 175.15 2gih s SER 136 N -4.67 7.34 -0.07 2.83 0.15 -1.26 -4.96 113.70 113.07 2gih s SER 136 Ca 0.65 2.17 -0.38 0.00 0.70 0.00 0.00 55.95 59.09 2gih s SER 136 Cb -0.08 -2.62 -0.16 0.00 -1.71 0.00 0.00 66.02 61.45 2gih s SER 136 CO 0.47 -0.10 1.51 0.00 1.20 0.00 0.00 173.24 176.33 2gih n ALA 137 N 1.51 -0.66 -3.44 5.45 0.00 -1.26 -4.97 120.51 117.15 2gih n ALA 137 Ca -0.00 0.46 -0.17 0.00 0.00 0.00 0.00 53.44 53.72 2gih n ALA 137 Cb 0.46 -2.14 -0.11 0.00 0.00 0.00 0.00 19.45 17.66 2gih n ALA 137 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2gih s PHE 138 N 1.80 -0.39 0.14 0.00 2.19 -1.26 -5.12 117.98 115.34 2gih s PHE 138 Ca 0.91 0.06 -0.33 0.00 0.33 0.00 0.00 56.93 57.89 2gih s PHE 138 Cb -1.01 -0.39 -0.13 0.00 -1.31 0.00 0.00 43.02 40.18 2gih s PHE 138 CO 0.55 -0.77 1.66 0.00 1.83 0.00 0.00 175.22 178.49 2gih n ALA 139 N 5.32 1.70 -2.17 11.12 0.00 -1.26 -4.96 120.51 130.26 2gih n ALA 139 Ca -0.04 0.41 -0.30 0.00 0.00 0.00 0.00 53.44 53.51 2gih n ALA 139 Cb 0.48 -2.42 -0.03 0.00 0.00 0.00 0.00 19.45 17.48 2gih n ALA 139 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2gih s PRO 140 N 1.45 3.75 0.36 0.00 0.04 -1.26 -4.69 135.00 134.64 2gih s PRO 140 Ca 0.80 0.47 -0.27 0.00 0.04 0.00 0.00 61.00 62.03 2gih s PRO 140 Cb -0.63 -2.37 -0.12 0.00 0.04 0.00 0.00 34.50 31.43 2gih s PRO 140 CO 0.38 -0.09 1.26 0.09 0.04 0.00 0.00 177.00 178.68 2gih n ASN 141 N -1.49 2.58 -0.04 6.66 3.02 -1.26 -3.45 115.26 121.28 2gih n ASN 141 Ca 0.02 1.18 -0.10 0.00 -0.03 0.00 0.00 54.58 55.65 2gih n ASN 141 Cb 0.54 -1.47 -0.03 0.00 -0.61 0.00 0.00 39.78 38.21 2gih n ASN 141 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2gih n ILE 142 N 0.19 0.85 -3.51 2.41 2.08 0.48 -4.93 119.36 116.93 2gih n ILE 142 Ca 0.05 -0.03 -0.11 0.00 0.56 0.00 0.00 62.75 63.23 2gih n ILE 142 Cb 0.37 -1.73 -0.03 0.00 -0.75 0.00 0.00 39.64 37.49 2gih n ILE 142 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 2gih s ILE 143 N -2.26 0.00 0.12 1.39 2.07 -1.25 -4.97 121.20 116.30 2gih s ILE 143 Ca -0.15 0.00 -0.31 0.00 -1.41 0.00 0.00 60.65 58.78 2gih s ILE 143 Cb 0.05 -1.00 -0.08 0.00 0.13 0.00 0.00 42.46 41.55 2gih s ILE 143 CO 0.20 0.00 1.47 -0.55 -1.91 0.00 0.00 174.94 174.15 2gih s SER 144 N -2.10 6.73 0.41 4.50 0.15 -1.26 -0.96 113.70 121.17 2gih s SER 144 Ca 0.01 2.42 0.17 0.00 0.70 0.00 0.00 55.95 59.25 2gih s SER 144 Cb -0.01 -2.59 0.87 0.00 -1.71 0.00 0.00 66.02 62.59 2gih s SER 144 CO -0.05 -0.73 1.86 0.00 1.20 0.00 0.00 173.24 175.52 2gih h ALA 145 N 6.98 1.29 0.01 5.45 0.00 -0.02 -1.03 119.26 131.94 2gih h ALA 145 Ca -0.42 -0.29 -0.22 0.00 0.00 0.00 0.00 54.91 53.98 2gih h ALA 145 Cb 1.21 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 2gih h ALA 145 CO 0.89 0.40 -0.94 -0.92 0.00 0.00 0.00 179.25 178.68 2gih h TYR 146 N 0.00 0.47 -0.36 0.00 3.20 -1.90 -1.00 116.97 117.38 2gih h TYR 146 Ca -0.00 -0.27 -0.06 0.00 3.14 0.00 0.00 58.73 61.54 2gih h TYR 146 Cb 0.63 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 2gih h TYR 146 CO 0.00 1.09 -0.03 -0.22 -1.64 0.00 0.00 178.16 177.36 2gih h LYS 147 N 0.17 0.65 -0.82 1.82 3.64 -1.76 -1.90 116.57 118.37 2gih h LYS 147 Ca -0.07 -0.22 -0.02 0.00 -1.27 0.00 0.00 60.65 59.06 2gih h LYS 147 Cb 1.58 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 33.31 2gih h LYS 147 CO 0.15 0.78 0.42 1.25 -2.27 0.00 0.00 179.45 179.79 2gih h LEU 148 N 0.46 1.05 0.46 5.20 6.46 -1.15 -0.98 115.31 126.81 2gih h LEU 148 Ca 0.10 -0.11 -0.01 0.00 -0.12 0.00 0.00 57.88 57.74 2gih h LEU 148 Cb 0.51 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.16 2gih h LEU 148 CO 0.02 0.86 -0.31 0.00 -0.62 0.00 0.00 178.44 178.40 2gih h ALA 149 N 1.30 -0.76 -0.79 1.25 0.00 -0.91 -0.62 119.26 118.73 2gih h ALA 149 Ca 0.29 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.11 2gih h ALA 149 Cb 0.07 0.40 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 2gih h ALA 149 CO -0.04 -0.94 0.52 1.96 0.00 0.00 0.00 179.25 180.74 2gih h GLN 150 N -0.75 0.87 -0.74 0.00 4.20 -1.14 -1.59 115.11 115.95 2gih h GLN 150 Ca -0.05 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.55 2gih h GLN 150 Cb 0.63 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 2gih h GLN 150 CO 0.03 0.57 0.25 1.15 -0.67 0.00 0.00 178.83 180.17 2gih h THR 151 N 0.89 1.26 -0.25 -0.54 2.02 -0.64 -0.26 112.91 115.38 2gih h THR 151 Ca 0.33 -0.87 -0.14 0.00 0.77 0.00 0.00 66.41 66.50 2gih h THR 151 Cb 0.17 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 2gih h THR 151 CO -0.11 0.35 -0.42 0.00 0.37 0.00 0.00 175.52 175.70 2gih h ALA 153 N 1.04 -0.14 0.00 0.00 0.00 -0.87 -0.11 119.26 119.18 2gih h ALA 153 Ca 0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2gih h ALA 153 Cb 0.94 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 2gih h ALA 153 CO 0.08 -0.53 -0.08 0.87 0.00 0.00 0.00 179.25 179.60 2gih h LYS 154 N -0.24 0.00 -0.02 0.00 1.57 -0.88 -0.27 116.57 116.74 2gih h LYS 154 Ca -0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2gih h LYS 154 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 2gih h LYS 154 CO 0.02 0.08 -0.03 0.52 -0.57 0.00 0.00 179.45 179.47 2gih h MET 155 N 0.00 0.05 0.60 3.15 2.86 -0.20 -2.26 114.93 119.14 2gih h MET 155 Ca -0.00 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 2gih h MET 155 Cb 0.16 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.82 2gih h MET 155 CO 0.01 0.60 -0.35 0.82 1.06 0.00 0.00 176.91 179.05 2gih h ILE 156 N -0.50 0.28 -0.81 -1.22 1.08 -0.67 0.17 117.51 115.84 2gih h ILE 156 Ca 0.00 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.62 2gih h ILE 156 Cb 0.60 0.28 -0.09 0.00 -3.07 0.00 0.00 36.82 34.53 2gih h ILE 156 CO 0.01 0.00 0.38 0.44 -0.69 0.00 0.00 178.15 178.28 2gih h ASP 157 N -0.90 0.42 -0.05 1.72 3.32 -1.14 -2.56 116.42 117.23 2gih h ASP 157 Ca -0.07 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2gih h ASP 157 Cb 0.72 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.31 2gih h ASP 157 CO 0.09 0.17 0.00 0.59 -1.72 0.00 0.00 179.24 178.36 2gih n ASN 158 N -4.93 2.72 -2.41 6.45 4.13 -0.85 -4.97 115.26 115.40 2gih n ASN 158 Ca 0.16 -1.90 -0.19 0.00 1.68 0.00 0.00 54.58 54.33 2gih n ASN 158 Cb 0.43 -0.02 0.02 0.00 -1.54 0.00 0.00 39.78 38.66 2gih n ASN 158 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2gih n LYS 159 N 1.11 -3.25 -3.26 3.52 4.76 0.54 -4.94 118.16 116.64 2gih n LYS 159 Ca 0.15 0.81 -0.46 0.00 -2.87 0.00 0.00 58.31 55.95 2gih n LYS 159 Cb 0.55 -5.37 -0.01 0.00 -1.84 0.00 0.00 35.03 28.36 2gih n LYS 159 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2gih s GLU 160 N -5.31 3.92 -0.04 1.97 2.02 -0.86 -4.80 118.70 115.60 2gih s GLU 160 Ca 0.17 -2.75 0.11 0.00 0.02 0.00 0.00 54.97 52.52 2gih s GLU 160 Cb -0.07 -4.59 0.33 0.00 0.10 0.00 0.00 34.13 29.90 2gih s GLU 160 CO 0.21 -1.36 1.27 1.19 0.02 0.00 0.00 175.26 176.59 2gih n PHE 161 N 3.80 0.53 -2.34 1.61 3.72 -1.26 -4.57 117.46 118.94 2gih n PHE 161 Ca 0.21 -0.58 -0.01 0.00 -0.05 0.00 0.00 57.45 57.02 2gih n PHE 161 Cb 0.43 -0.09 -0.01 0.00 -0.94 0.00 0.00 39.48 38.88 2gih n PHE 161 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2gih n ASP 162 N 0.21 0.13 -0.12 4.37 5.68 -1.26 -4.76 116.55 120.80 2gih n ASP 162 Ca 0.13 -2.01 -0.19 0.00 -0.50 0.00 0.00 54.79 52.22 2gih n ASP 162 Cb 0.51 -0.03 -0.11 0.00 -1.14 0.00 0.00 41.12 40.36 2gih n ASP 162 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 2gih n LEU 163 N 0.11 2.81 -3.95 -2.12 7.94 -1.26 -4.94 117.00 115.59 2gih n LEU 163 Ca -0.08 -0.06 -0.10 0.00 -1.11 0.00 0.00 56.01 54.66 2gih n LEU 163 Cb 0.94 -0.85 -0.06 0.00 0.53 0.00 0.00 43.42 43.97 2gih n LEU 163 CO -0.08 0.86 0.08 0.72 -1.11 0.00 0.00 177.39 177.86 2gih s PHE 164 N -2.49 0.35 0.13 1.96 -0.12 -1.26 -1.05 117.98 115.49 2gih s PHE 164 Ca -0.34 -0.70 0.01 0.00 -0.05 0.00 0.00 56.93 55.86 2gih s PHE 164 Cb 0.09 0.07 -0.04 0.00 -0.63 0.00 0.00 43.02 42.51 2gih s PHE 164 CO 0.55 -0.83 -0.03 -0.51 -0.05 0.00 0.00 175.22 174.35 2gih s ASP 165 N -2.98 1.09 -0.27 1.98 1.01 -1.06 -5.00 116.67 111.44 2gih s ASP 165 Ca 0.19 -1.08 0.01 0.00 0.71 0.00 0.00 52.55 52.38 2gih s ASP 165 Cb 0.02 0.12 0.08 0.00 1.01 0.00 0.00 42.92 44.14 2gih s ASP 165 CO 0.03 -0.52 -0.00 -0.63 0.21 0.00 0.00 175.17 174.25 2gih s ILE 166 N -3.67 1.61 0.41 0.77 1.01 -1.26 -1.13 121.20 118.93 2gih s ILE 166 Ca 0.17 -1.54 0.08 0.00 0.00 0.00 0.00 60.65 59.36 2gih s ILE 166 Cb 0.06 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 2gih s ILE 166 CO -0.01 -0.32 0.27 0.20 0.00 0.00 0.00 174.94 175.07 2gih s ASN 167 N 1.31 4.74 0.04 3.58 0.01 -0.45 -1.57 114.94 122.60 2gih s ASN 167 Ca 0.01 -0.89 0.01 0.00 -0.71 0.00 0.00 52.86 51.27 2gih s ASN 167 Cb -0.19 -0.55 -0.03 0.00 0.41 0.00 0.00 41.25 40.90 2gih s ASN 167 CO -0.10 -0.57 -0.05 -0.31 -1.51 0.00 0.00 177.10 174.56 2gih s TYR 168 N -2.52 0.45 -0.07 2.20 2.02 0.06 -2.32 117.35 117.17 2gih s TYR 168 Ca 0.44 -0.62 -0.01 0.00 -0.37 0.00 0.00 57.07 56.51 2gih s TYR 168 Cb 0.00 -0.30 0.03 0.00 -0.40 0.00 0.00 41.96 41.29 2gih s TYR 168 CO 0.25 -0.18 -0.01 -1.17 -1.57 0.00 0.00 175.55 172.86 2gih s LEU 169 N -1.79 0.78 -0.35 -1.29 2.96 -1.09 -1.84 118.68 116.06 2gih s LEU 169 Ca -0.09 -0.12 -0.10 0.00 -0.22 0.00 0.00 54.13 53.60 2gih s LEU 169 Cb -0.07 -0.49 0.02 0.00 0.50 0.00 0.00 46.19 46.16 2gih s LEU 169 CO -0.02 -0.16 0.17 -0.70 -1.32 0.00 0.00 176.35 174.32 2gih s GLU 170 N 1.77 2.87 -0.44 1.98 2.12 0.73 0.26 118.70 127.99 2gih s GLU 170 Ca 0.02 -1.04 -0.18 0.00 0.36 0.00 0.00 54.97 54.14 2gih s GLU 170 Cb -0.13 -3.63 0.03 0.00 0.26 0.00 0.00 34.13 30.66 2gih s GLU 170 CO -0.05 -0.64 0.48 0.08 -0.54 0.00 0.00 175.26 174.59 2gih s VAL 171 N 1.53 5.04 0.09 3.70 1.01 0.15 -0.85 120.40 131.07 2gih s VAL 171 Ca 0.02 -0.37 -0.19 0.00 0.00 0.00 0.00 61.98 61.44 2gih s VAL 171 Cb -0.19 -4.10 -0.07 0.00 0.00 0.00 0.00 36.38 32.03 2gih s VAL 171 CO 0.06 -0.50 0.57 -1.81 0.00 0.00 0.00 175.10 173.42 2gih s ASP 172 N 1.99 7.03 0.04 3.32 1.11 0.36 -1.53 116.67 128.99 2gih s ASP 172 Ca 0.13 1.24 -0.02 0.00 0.18 0.00 0.00 52.55 54.09 2gih s ASP 172 Cb -0.17 -2.35 -0.03 0.00 1.07 0.00 0.00 42.92 41.44 2gih s ASP 172 CO 0.14 0.24 -0.00 -1.66 1.18 0.00 0.00 175.17 175.06 2gih s TRP 173 N -1.18 0.36 0.16 4.23 1.48 0.10 -1.34 118.94 122.74 2gih s TRP 173 Ca 0.31 -0.76 0.09 0.00 -1.06 0.00 0.00 56.10 54.68 2gih s TRP 173 Cb -0.19 -0.27 -0.04 0.00 -1.16 0.00 0.00 33.47 31.81 2gih s TRP 173 CO 0.19 -0.31 -0.20 -2.00 -4.06 0.00 0.00 176.95 170.57 2gih s GLU 174 N -2.80 1.30 -0.13 3.25 2.12 -0.03 -2.57 118.70 119.84 2gih s GLU 174 Ca -0.03 -1.39 -0.01 0.00 0.36 0.00 0.00 54.97 53.89 2gih s GLU 174 Cb -0.00 -1.46 -0.02 0.00 0.26 0.00 0.00 34.13 32.91 2gih s GLU 174 CO -0.06 0.31 -0.09 -1.17 -0.54 0.00 0.00 175.26 173.71 2gih s LEU 175 N -2.52 2.98 -0.01 2.70 1.98 -1.26 -0.47 118.68 122.07 2gih s LEU 175 Ca 0.15 -0.21 -0.01 0.00 -2.89 0.00 0.00 54.13 51.17 2gih s LEU 175 Cb -0.07 -1.69 -0.00 0.00 0.66 0.00 0.00 46.19 45.09 2gih s LEU 175 CO 0.07 0.19 -0.01 0.78 -1.89 0.00 0.00 176.35 175.49 2gih h ASN 176 N 6.51 0.00 0.00 3.68 2.35 -1.90 -3.49 115.58 122.74 2gih h ASN 176 Ca -0.31 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 2gih h ASN 176 Cb 1.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.57 2gih h ASN 176 CO 0.58 0.07 0.00 0.61 -1.65 0.00 0.00 177.43 177.04 2gih n GLY 177 N 1.80 0.10 2.68 2.83 0.00 -1.26 -4.96 105.19 106.38 2gih n GLY 177 Ca -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 46.02 45.92 2gih n GLY 177 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2gih n GLU 178 N -1.33 1.31 -3.64 1.61 0.00 -1.26 -5.11 120.64 112.21 2gih n GLU 178 Ca 0.00 -1.42 -0.04 0.00 0.00 0.00 0.00 57.16 55.69 2gih n GLU 178 Cb 0.00 0.26 -0.07 0.00 0.00 0.00 0.00 31.44 31.64 2gih n GLU 178 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.13 177.29 2gih s ASP 179 N -1.15 -0.52 -0.30 -1.84 3.84 -1.26 -4.51 116.67 110.92 2gih s ASP 179 Ca 0.14 0.87 -0.18 0.00 -0.00 0.00 0.00 52.55 53.37 2gih s ASP 179 Cb 0.43 1.12 -0.02 0.00 -1.38 0.00 0.00 42.92 43.07 2gih s ASP 179 CO -0.12 -0.14 0.52 -0.76 -0.00 0.00 0.00 175.17 174.67 2gih s LEU 180 N 1.05 4.18 -0.17 2.11 1.43 0.48 -2.49 118.68 125.27 2gih s LEU 180 Ca -0.06 0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 53.26 2gih s LEU 180 Cb -0.04 -2.63 -0.03 0.00 0.03 0.00 0.00 46.19 43.52 2gih s LEU 180 CO -0.13 -0.38 -0.03 0.68 0.23 0.00 0.00 176.35 176.71 2gih s VAL 181 N 2.37 3.83 0.04 -1.59 -7.23 0.38 -1.25 120.40 116.96 2gih s VAL 181 Ca 0.20 -0.37 -0.31 0.00 -1.81 0.00 0.00 61.98 59.69 2gih s VAL 181 Cb -0.15 -2.69 -0.07 0.00 0.56 0.00 0.00 36.38 34.03 2gih s VAL 181 CO 0.11 0.48 1.46 0.00 -0.31 0.00 0.00 175.10 176.85 2gih n VAL 183 N 4.51 1.11 -3.87 0.00 0.24 -0.45 -2.13 118.33 117.74 2gih n VAL 183 Ca 0.13 -0.69 -0.07 0.00 -2.04 0.00 0.00 64.34 61.67 2gih n VAL 183 Cb 0.42 -0.54 -0.02 0.00 -1.47 0.00 0.00 33.84 32.23 2gih n VAL 183 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2gih s SER 184 N -5.01 -0.24 0.06 -1.34 1.04 -1.20 -4.96 113.70 102.05 2gih s SER 184 Ca -0.08 -0.64 -0.01 0.00 0.48 0.00 0.00 55.95 55.70 2gih s SER 184 Cb 0.05 0.71 -0.04 0.00 0.10 0.00 0.00 66.02 66.84 2gih s SER 184 CO 0.68 -1.32 -0.01 -0.89 0.98 0.00 0.00 173.24 172.68 2gih s THR 185 N -3.93 0.21 -0.00 2.02 2.01 -1.26 -0.49 115.64 114.20 2gih s THR 185 Ca 0.12 -1.78 -0.14 0.00 0.31 0.00 0.00 61.69 60.20 2gih s THR 185 Cb -0.05 -1.55 0.02 0.00 0.01 0.00 0.00 72.50 70.92 2gih s THR 185 CO 0.07 -0.94 0.29 -0.55 -0.69 0.00 0.00 174.62 172.81 2gih s SER 186 N -2.93 -0.16 0.00 3.53 0.15 -0.03 -4.94 113.70 109.32 2gih s SER 186 Ca 0.08 0.00 0.01 0.00 0.70 0.00 0.00 55.95 56.75 2gih s SER 186 Cb 0.08 0.31 -0.01 0.00 -1.71 0.00 0.00 66.02 64.69 2gih s SER 186 CO -0.09 -0.48 -0.05 0.12 1.20 0.00 0.00 173.24 173.95 2gih s PHE 187 N -1.59 0.42 0.06 3.44 5.36 -1.26 -0.19 117.98 124.23 2gih s PHE 187 Ca -0.12 -0.12 -0.19 0.00 -0.96 0.00 0.00 56.93 55.54 2gih s PHE 187 Cb -0.04 -0.27 0.04 0.00 -0.34 0.00 0.00 43.02 42.41 2gih s PHE 187 CO 0.03 -0.02 0.44 0.00 -1.46 0.00 0.00 175.22 174.20 2gih s ALA 188 N -0.25 -1.07 -0.11 11.12 0.00 -0.76 -4.95 121.76 125.74 2gih s ALA 188 Ca 0.00 0.30 0.01 0.00 0.00 0.00 0.00 51.96 52.28 2gih s ALA 188 Cb -0.03 0.43 -0.02 0.00 0.00 0.00 0.00 23.12 23.51 2gih s ALA 188 CO -0.00 -0.51 -0.15 -1.21 0.00 0.00 0.00 175.76 173.89 2gih s GLU 189 N -2.75 3.14 0.05 0.00 2.02 -1.26 -0.76 118.70 119.13 2gih s GLU 189 Ca -0.04 -0.72 -0.25 0.00 0.02 0.00 0.00 54.97 53.99 2gih s GLU 189 Cb -0.00 -2.53 -0.17 0.00 0.10 0.00 0.00 34.13 31.53 2gih s GLU 189 CO -0.04 0.30 1.55 1.25 0.02 0.00 0.00 175.26 178.33 2gih h LEU 190 N 6.40 -0.12 0.00 1.80 5.85 -1.66 -2.98 115.31 124.60 2gih h LEU 190 Ca -0.29 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.29 2gih h LEU 190 Cb 1.20 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2gih h LEU 190 CO 0.53 0.06 0.00 0.49 -0.34 0.00 0.00 178.44 179.19 2gih n PHE 191 N -5.08 0.00 0.18 1.25 0.99 -1.26 -1.75 117.46 111.79 2gih n PHE 191 Ca -0.08 0.00 0.09 0.00 -0.00 0.00 0.00 57.45 57.46 2gih n PHE 191 Cb 0.15 0.00 0.18 0.00 -1.00 0.00 0.00 39.48 38.80 2gih n PHE 191 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2gih n LYS 192 N -0.76 2.25 -2.94 -1.08 5.02 -1.13 -4.86 118.16 114.66 2gih n LYS 192 Ca 0.07 -2.06 -0.18 0.00 -2.02 0.00 0.00 58.31 54.12 2gih n LYS 192 Cb 0.03 -1.41 0.02 0.00 -0.02 0.00 0.00 35.03 33.65 2gih n LYS 192 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2gih s SER 193 N -1.24 5.54 -0.34 4.39 1.04 -0.72 -0.58 113.70 121.79 2gih s SER 193 Ca 0.31 -0.38 -0.20 0.00 0.48 0.00 0.00 55.95 56.16 2gih s SER 193 Cb 0.18 -0.62 -0.00 0.00 0.10 0.00 0.00 66.02 65.68 2gih s SER 193 CO 0.25 -0.88 0.61 -0.70 0.98 0.00 0.00 173.24 173.50 2gih s GLU 194 N -4.45 3.74 0.14 4.02 2.56 -1.26 -4.45 118.70 118.99 2gih s GLU 194 Ca 0.56 0.09 -0.27 0.00 0.00 0.00 0.00 54.97 55.35 2gih s GLU 194 Cb -0.10 -3.78 -0.02 0.00 2.00 0.00 0.00 34.13 32.23 2gih s GLU 194 CO 0.34 -0.67 1.60 -1.35 -0.56 0.00 0.00 175.26 174.62 2gih h PRO 195 N 8.38 -0.39 0.00 4.30 0.11 -1.93 -1.96 132.00 140.51 2gih h PRO 195 Ca -0.27 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2gih h PRO 195 Cb 1.12 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2gih h PRO 195 CO 0.81 -0.26 0.08 -1.13 -0.21 0.00 0.00 178.00 177.30 2gih n SER 196 N -5.42 0.00 -0.64 -2.05 3.41 -1.26 -1.59 113.62 106.06 2gih n SER 196 Ca -0.03 0.39 0.05 0.00 -0.26 0.00 0.00 58.87 59.03 2gih n SER 196 Cb 0.34 -0.39 0.21 0.00 -0.26 0.00 0.00 64.21 64.10 2gih n SER 196 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gih n GLU 197 N -1.39 1.61 -3.48 4.33 1.02 -0.74 -4.98 120.64 117.01 2gih n GLU 197 Ca 0.00 -3.27 -0.38 0.00 -0.02 0.00 0.00 57.16 53.50 2gih n GLU 197 Cb 0.08 -1.64 -0.08 0.00 -0.02 0.00 0.00 31.44 29.79 2gih n GLU 197 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2gih s LEU 198 N -3.23 4.15 -0.24 -4.62 1.02 -0.62 -4.96 118.68 110.18 2gih s LEU 198 Ca 0.39 0.39 -0.27 0.00 0.02 0.00 0.00 54.13 54.66 2gih s LEU 198 Cb 0.37 -2.38 0.00 0.00 0.02 0.00 0.00 46.19 44.20 2gih s LEU 198 CO -0.06 -0.02 0.95 -0.47 0.02 0.00 0.00 176.35 176.77 2gih s TYR 199 N 1.18 3.32 -0.32 0.29 5.04 -1.26 -5.00 117.35 120.59 2gih s TYR 199 Ca 0.15 1.31 -0.11 0.00 -2.44 0.00 0.00 57.07 55.99 2gih s TYR 199 Cb -0.14 -3.21 -0.01 0.00 0.35 0.00 0.00 41.96 38.95 2gih s TYR 199 CO 0.07 -0.47 0.18 0.42 -1.34 0.00 0.00 175.55 174.41 2gih s ILE 200 N 3.08 4.81 -0.78 3.14 1.01 -1.26 -1.10 121.20 130.09 2gih s ILE 200 Ca 0.40 -0.37 -0.15 0.00 0.00 0.00 0.00 60.65 60.53 2gih s ILE 200 Cb -0.15 -3.47 0.20 0.00 0.01 0.00 0.00 42.46 39.05 2gih s ILE 200 CO 0.07 0.03 0.74 0.21 0.00 0.00 0.00 174.94 176.00 2gih s ASN 201 N 1.64 6.66 0.25 3.58 3.84 0.15 -4.95 114.94 126.12 2gih s ASN 201 Ca 0.05 -2.50 -0.03 0.00 0.21 0.00 0.00 52.86 50.59 2gih s ASN 201 Cb -0.17 -2.22 0.49 0.00 -0.55 0.00 0.00 41.25 38.80 2gih s ASN 201 CO 0.08 -0.65 1.74 -0.50 -2.79 0.00 0.00 177.10 174.98 2gih h TRP 202 N 8.02 0.61 -0.49 0.43 4.06 -1.88 -1.76 115.95 124.94 2gih h TRP 202 Ca 0.04 0.04 -0.08 0.00 2.06 0.00 0.00 58.89 60.95 2gih h TRP 202 Cb 1.05 -0.15 -0.02 0.00 -1.00 0.00 0.00 29.16 29.04 2gih h TRP 202 CO 0.99 0.11 -0.00 0.00 -3.56 0.00 0.00 178.44 175.98 2gih h ALA 203 N 1.55 1.07 -0.11 1.49 0.00 -1.96 -2.27 119.26 119.04 2gih h ALA 203 Ca 0.43 -0.27 -0.71 0.00 0.00 0.00 0.00 54.91 54.37 2gih h ALA 203 Cb 0.64 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 2gih h ALA 203 CO -0.39 0.58 3.15 0.00 0.00 0.00 0.00 179.25 182.60 2gih n ALA 204 N -2.48 5.98 -3.00 0.00 0.00 -0.67 -4.53 120.51 115.81 2gih n ALA 204 Ca 0.03 -3.86 -0.20 0.00 0.00 0.00 0.00 53.44 49.41 2gih n ALA 204 Cb 0.31 -3.43 0.00 0.00 0.00 0.00 0.00 19.45 16.33 2gih n ALA 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gih n ALA 205 N 5.23 -0.95 -2.40 0.00 0.00 -1.24 -0.83 120.51 120.32 2gih n ALA 205 Ca 0.56 0.13 -0.11 0.00 0.00 0.00 0.00 53.44 54.03 2gih n ALA 205 Cb 0.35 -2.59 -0.01 0.00 0.00 0.00 0.00 19.45 17.20 2gih n ALA 205 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2gih n MET 206 N -3.49 -2.27 -2.91 0.00 0.00 -0.85 -4.67 117.12 102.93 2gih n MET 206 Ca -0.08 0.53 -0.37 0.00 0.00 0.00 0.00 57.70 57.78 2gih n MET 206 Cb 0.58 -5.10 -0.06 0.00 0.00 0.00 0.00 33.22 28.64 2gih n MET 206 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 2gih s GLN 207 N -4.93 4.48 0.36 0.03 -1.52 -0.01 0.68 119.66 118.75 2gih s GLN 207 Ca 0.00 1.16 -0.24 0.00 -1.95 0.00 0.00 55.36 54.33 2gih s GLN 207 Cb 0.00 -2.90 -0.10 0.00 -0.22 0.00 0.00 33.01 29.79 2gih s GLN 207 CO 0.00 0.36 0.95 0.42 -0.25 0.00 0.00 175.29 176.77 2gih s ILE 208 N -1.52 4.23 -0.02 1.08 1.01 -0.13 -0.68 121.20 125.17 2gih s ILE 208 Ca 0.46 1.68 0.02 0.00 0.00 0.00 0.00 60.65 62.81 2gih s ILE 208 Cb -0.19 -3.86 0.01 0.00 0.01 0.00 0.00 42.46 38.43 2gih s ILE 208 CO 0.23 -0.01 -0.06 -1.10 0.00 0.00 0.00 174.94 174.01 2gih s GLN 209 N -2.44 0.65 -0.22 2.79 -0.21 -0.26 -0.38 119.66 119.59 2gih s GLN 209 Ca 0.54 -0.18 -0.31 0.00 0.02 0.00 0.00 55.36 55.44 2gih s GLN 209 Cb -0.16 -0.65 0.16 0.00 1.00 0.00 0.00 33.01 33.36 2gih s GLN 209 CO 0.21 0.05 1.19 -0.59 -2.12 0.00 0.00 175.29 174.02 2gih s PHE 210 N 0.30 -0.18 -0.03 0.91 -0.12 -1.22 -4.41 117.98 113.21 2gih s PHE 210 Ca -0.04 0.28 -0.20 0.00 -0.05 0.00 0.00 56.93 56.92 2gih s PHE 210 Cb -0.08 0.48 -0.05 0.00 -0.63 0.00 0.00 43.02 42.75 2gih s PHE 210 CO -0.00 -0.19 0.58 -1.01 -0.05 0.00 0.00 175.22 174.55 2gih s HIS 211 N -1.33 3.64 0.44 3.49 3.76 -1.26 -4.30 115.29 119.72 2gih s HIS 211 Ca 0.05 1.14 0.17 0.00 -0.15 0.00 0.00 55.06 56.27 2gih s HIS 211 Cb -0.01 -2.61 1.10 0.00 1.11 0.00 0.00 32.58 32.17 2gih s HIS 211 CO -0.04 0.29 1.94 0.28 -0.85 0.00 0.00 174.74 176.36 2gih h VAL 212 N 4.32 0.80 0.00 -0.90 2.07 -1.98 -0.19 116.25 120.36 2gih h VAL 212 Ca -0.44 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2gih h VAL 212 Cb 1.20 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 2gih h VAL 212 CO 0.71 0.07 0.00 -2.11 0.02 0.00 0.00 177.57 176.26 2gih n ARG 213 N -4.46 0.19 0.00 1.57 1.85 -1.26 -3.21 116.66 111.33 2gih n ARG 213 Ca 0.13 0.42 0.05 0.00 -1.00 0.00 0.00 57.85 57.46 2gih n ARG 213 Cb 0.52 -1.86 -0.01 0.00 -1.05 0.00 0.00 32.46 30.07 2gih n ARG 213 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2gih n ASP 214 N -2.21 1.19 -4.72 2.89 8.00 -0.10 -5.01 116.55 116.59 2gih n ASP 214 Ca 0.02 -1.10 -0.42 0.00 0.71 0.00 0.00 54.79 54.01 2gih n ASP 214 Cb 0.22 0.53 -0.03 0.00 -0.02 0.00 0.00 41.12 41.83 2gih n ASP 214 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2gih s LEU 215 N -1.79 4.38 0.41 0.64 2.96 -1.13 -4.98 118.68 119.17 2gih s LEU 215 Ca 0.09 2.36 -0.25 0.00 -0.22 0.00 0.00 54.13 56.10 2gih s LEU 215 Cb 0.09 -3.59 -0.08 0.00 0.50 0.00 0.00 46.19 43.10 2gih s LEU 215 CO 0.30 -0.62 1.22 1.51 -1.32 0.00 0.00 176.35 177.43 2gih s ASP 216 N 0.87 6.40 -0.16 3.68 3.84 -1.26 -4.95 116.67 125.09 2gih s ASP 216 Ca 0.62 2.46 0.15 0.00 -0.00 0.00 0.00 52.55 55.78 2gih s ASP 216 Cb -0.37 -2.62 0.43 0.00 -1.38 0.00 0.00 42.92 38.98 2gih s ASP 216 CO 0.33 -0.77 1.20 0.00 -0.00 0.00 0.00 175.17 175.93 2gih n GLN 217 N 0.03 1.31 -0.67 2.11 1.13 -1.24 -3.59 117.38 116.46 2gih n GLN 217 Ca 0.04 -3.04 0.09 0.00 -1.94 0.00 0.00 57.00 52.16 2gih n GLN 217 Cb 0.46 -1.25 0.37 0.00 0.11 0.00 0.00 30.24 29.92 2gih n GLN 217 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2gih n GLY 218 N -0.68 2.85 3.75 1.08 0.00 -0.79 -4.81 105.19 106.60 2gih n GLY 218 Ca 0.17 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.90 2gih n GLY 218 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2gih s PHE 219 N -2.08 2.90 -0.01 1.61 5.36 0.25 -4.91 117.98 121.10 2gih s PHE 219 Ca 0.52 1.02 0.00 0.00 -0.96 0.00 0.00 56.93 57.51 2gih s PHE 219 Cb 0.35 -3.90 -0.00 0.00 -0.34 0.00 0.00 43.02 39.13 2gih s PHE 219 CO 0.22 -2.87 0.01 0.27 -1.46 0.00 0.00 175.22 171.40 2gih n ASN 220 N 1.90 1.94 -3.54 6.13 2.04 -1.26 -4.90 115.26 117.57 2gih n ASN 220 Ca 0.06 -0.31 0.00 0.00 -0.44 0.00 0.00 54.58 53.89 2gih n ASN 220 Cb 0.39 1.01 0.00 0.00 -2.53 0.00 0.00 39.78 38.65 2gih n ASN 220 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2gih n GLY 221 N 1.59 -2.05 4.02 4.83 0.00 -1.26 -5.06 105.19 107.26 2gih n GLY 221 Ca 0.00 -1.36 -0.19 0.00 0.00 0.00 0.00 46.02 44.47 2gih n GLY 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gih s THR 222 N 0.00 2.43 0.28 2.61 -4.23 -1.26 -4.97 115.64 110.50 2gih s THR 222 Ca 0.00 -0.95 0.18 0.00 -1.18 0.00 0.00 61.69 59.74 2gih s THR 222 Cb 0.00 -2.48 0.14 0.00 1.34 0.00 0.00 72.50 71.50 2gih s THR 222 CO 0.00 0.00 1.82 -0.09 -0.54 0.00 0.00 174.62 175.81 2gih h ARG 223 N 0.25 0.00 -0.01 3.99 9.65 -1.94 -1.77 114.38 124.55 2gih h ARG 223 Ca -0.34 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.49 2gih h ARG 223 Cb 1.28 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 2gih h ARG 223 CO 0.42 0.34 -0.20 1.49 2.80 0.00 0.00 179.97 184.82 2gih h GLU 224 N 0.00 0.15 -0.56 0.20 4.81 -1.94 -2.82 114.58 114.41 2gih h GLU 224 Ca -0.00 -0.15 0.03 0.00 -0.13 0.00 0.00 59.36 59.11 2gih h GLU 224 Cb 0.73 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.12 2gih h GLU 224 CO 0.04 0.87 0.37 0.93 -0.73 0.00 0.00 179.01 180.50 2gih h GLU 225 N -0.51 0.64 0.04 1.92 5.08 -1.92 -2.07 114.58 117.77 2gih h GLU 225 Ca -0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2gih h GLU 225 Cb 0.93 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2gih h GLU 225 CO 0.04 0.43 -0.05 2.35 -1.00 0.00 0.00 179.01 180.78 2gih h TRP 226 N 0.66 -0.13 -0.03 4.33 7.01 -1.30 -1.17 115.95 125.33 2gih h TRP 226 Ca 0.22 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.19 2gih h TRP 226 Cb 0.07 0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.18 2gih h TRP 226 CO -0.00 -0.08 -0.14 0.00 -2.79 0.00 0.00 178.44 175.43 2gih h ALA 227 N 0.84 1.73 0.17 2.65 0.00 -1.13 -0.22 119.26 123.30 2gih h ALA 227 Ca 0.01 -0.14 -0.30 0.00 0.00 0.00 0.00 54.91 54.47 2gih h ALA 227 Cb 0.11 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.89 2gih h ALA 227 CO -0.02 0.21 -1.32 0.87 0.00 0.00 0.00 179.25 178.99 2gih h LYS 228 N 0.04 0.44 -0.02 0.00 1.57 -1.21 -2.60 116.57 114.79 2gih h LYS 228 Ca 0.01 -0.70 -0.00 0.00 -1.87 0.00 0.00 60.65 58.08 2gih h LYS 228 Cb 0.27 0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 2gih h LYS 228 CO 0.02 1.33 0.00 1.03 -0.57 0.00 0.00 179.45 181.26 2gih h SER 229 N 0.15 0.03 -0.12 0.86 0.87 -0.91 -2.18 113.55 112.25 2gih h SER 229 Ca -0.19 -0.27 0.04 0.00 -1.23 0.00 0.00 61.79 60.14 2gih h SER 229 Cb 2.02 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 63.93 2gih h SER 229 CO 0.24 0.29 -0.11 0.22 -0.53 0.00 0.00 176.83 176.94 2gih h TYR 230 N -0.23 -0.26 -0.99 2.24 3.20 -1.14 -0.96 116.97 118.83 2gih h TYR 230 Ca 0.01 0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.04 2gih h TYR 230 Cb 0.28 0.13 -0.09 0.00 1.54 0.00 0.00 36.73 38.59 2gih h TYR 230 CO 0.02 -0.16 0.61 -0.07 -1.64 0.00 0.00 178.16 176.91 2gih h LEU 231 N -0.12 0.84 -0.62 2.82 4.07 -1.40 0.61 115.31 121.51 2gih h LEU 231 Ca 0.08 0.07 -0.10 0.00 0.08 0.00 0.00 57.88 58.01 2gih h LEU 231 Cb 0.24 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.87 2gih h LEU 231 CO -0.20 0.39 -0.02 0.50 -1.08 0.00 0.00 178.44 178.03 2gih h LYS 232 N 0.88 1.07 -0.21 1.13 3.64 -0.78 -1.06 116.57 121.24 2gih h LYS 232 Ca 0.52 -0.35 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 2gih h LYS 232 Cb 0.65 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 2gih h LYS 232 CO -0.32 1.05 0.09 1.25 -2.27 0.00 0.00 179.45 179.26 2gih h HIS 233 N 0.97 0.31 -0.36 1.91 2.76 0.52 -2.12 115.15 119.14 2gih h HIS 233 Ca 0.17 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 2gih h HIS 233 Cb 0.59 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.43 2gih h HIS 233 CO 0.04 0.34 0.23 0.35 -1.30 0.00 0.00 177.93 177.59 2gih h PHE 234 N 0.20 0.46 -0.70 5.26 3.04 0.32 -0.32 116.94 125.20 2gih h PHE 234 Ca 0.07 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 61.98 2gih h PHE 234 Cb 0.16 -0.15 -0.03 0.00 2.56 0.00 0.00 35.95 38.48 2gih h PHE 234 CO -0.02 0.31 0.26 0.28 -2.02 0.00 0.00 178.31 177.13 2gih h VAL 235 N 0.48 1.25 -0.39 1.41 2.07 -1.18 -0.10 116.25 119.80 2gih h VAL 235 Ca 0.13 -0.80 -0.10 0.00 0.82 0.00 0.00 66.70 66.75 2gih h VAL 235 Cb -0.03 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 2gih h VAL 235 CO -0.03 0.32 -0.14 0.74 0.02 0.00 0.00 177.57 178.49 2gih h THR 236 N 1.00 1.28 -0.10 2.57 2.02 -1.17 -1.55 112.91 116.97 2gih h THR 236 Ca 0.23 -1.25 -0.13 0.00 0.77 0.00 0.00 66.41 66.04 2gih h THR 236 Cb 0.24 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 2gih h THR 236 CO -0.02 0.42 -0.51 1.56 0.37 0.00 0.00 175.52 177.34 2gih h GLN 237 N 0.58 0.26 -0.55 6.66 1.08 -0.88 -1.77 115.11 120.49 2gih h GLN 237 Ca 0.09 -0.15 -0.03 0.00 -1.45 0.00 0.00 58.65 57.11 2gih h GLN 237 Cb 0.67 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.09 2gih h GLN 237 CO 0.05 0.72 0.23 0.00 -0.95 0.00 0.00 178.83 178.87 2gih h ALA 238 N 1.26 0.72 -0.42 3.87 0.00 -0.82 0.56 119.26 124.42 2gih h ALA 238 Ca 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2gih h ALA 238 Cb 0.98 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2gih h ALA 238 CO 0.08 0.33 0.17 0.93 0.00 0.00 0.00 179.25 180.76 2gih h GLU 239 N 0.76 0.63 -0.50 0.00 5.08 -1.01 -2.67 114.58 116.86 2gih h GLU 239 Ca 0.19 -0.11 -0.09 0.00 -1.00 0.00 0.00 59.36 58.34 2gih h GLU 239 Cb 0.19 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2gih h GLU 239 CO -0.02 0.58 -0.05 1.96 -1.00 0.00 0.00 179.01 180.49 2gih h GLN 240 N 0.54 0.89 -0.93 2.33 4.20 -1.05 -2.77 115.11 118.31 2gih h GLN 240 Ca 0.14 -0.28 0.06 0.00 0.06 0.00 0.00 58.65 58.63 2gih h GLN 240 Cb 0.19 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 27.82 2gih h GLN 240 CO -0.01 0.92 0.59 -0.09 -0.67 0.00 0.00 178.83 179.57 2gih h ARG 241 N 0.81 1.06 -0.26 1.46 9.65 -0.68 -0.27 114.38 126.16 2gih h ARG 241 Ca 0.14 -0.06 0.01 0.00 -1.10 0.00 0.00 59.98 58.97 2gih h ARG 241 Cb 0.56 -0.24 -0.01 0.00 -1.39 0.00 0.00 29.97 28.88 2gih h ARG 241 CO 0.03 0.70 0.16 0.00 2.80 0.00 0.00 179.97 183.66 2gih h ALA 242 N 1.42 0.32 -0.28 2.80 0.00 -1.20 0.72 119.26 123.05 2gih h ALA 242 Ca 0.40 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 2gih h ALA 242 Cb 0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2gih h ALA 242 CO -0.16 -0.22 0.10 0.82 0.00 0.00 0.00 179.25 179.79 2gih h ILE 243 N 0.33 1.19 0.00 0.00 2.04 -1.26 -2.80 117.51 117.01 2gih h ILE 243 Ca 0.10 -0.59 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 2gih h ILE 243 Cb -0.02 1.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.11 2gih h ILE 243 CO -0.03 0.20 -0.14 0.77 0.00 0.00 0.00 178.15 178.94 2gih h SER 244 N 0.29 0.00 0.75 1.72 4.64 -0.87 -1.68 113.55 118.40 2gih h SER 244 Ca 0.09 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.35 2gih h SER 244 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2gih h SER 244 CO -0.01 0.14 -0.28 0.24 -0.87 0.00 0.00 176.83 176.05 2gih h MET 245 N 0.00 0.00 0.16 4.77 2.86 -0.59 -2.10 114.93 120.03 2gih h MET 245 Ca -0.00 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.42 2gih h MET 245 Cb 0.54 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.22 2gih h MET 245 CO 0.02 0.28 -0.96 0.82 1.06 0.00 0.00 176.91 178.13 2gih h ILE 246 N 0.00 1.44 0.00 -1.22 1.08 -1.16 -1.68 117.51 115.98 2gih h ILE 246 Ca -0.00 -2.55 -0.01 0.00 -0.39 0.00 0.00 64.86 61.90 2gih h ILE 246 Cb 0.73 3.15 -0.00 0.00 -3.07 0.00 0.00 36.82 37.63 2gih h ILE 246 CO 0.04 0.73 -0.05 0.44 -0.69 0.00 0.00 178.15 178.61 2gih h ASP 247 N -0.29 0.00 0.00 1.72 3.32 -1.43 -1.68 116.42 118.06 2gih h ASP 247 Ca -0.17 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.59 2gih h ASP 247 Cb 1.73 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 41.23 2gih h ASP 247 CO 0.16 0.05 -2.08 1.17 -1.72 0.00 0.00 179.24 176.82 2gih n LYS 248 N -3.19 1.02 -0.01 3.56 4.81 -0.80 -4.42 118.16 119.14 2gih n LYS 248 Ca 0.00 0.05 0.06 0.00 -0.87 0.00 0.00 58.31 57.55 2gih n LYS 248 Cb 0.31 -1.39 0.06 0.00 0.02 0.00 0.00 35.03 34.03 2gih n LYS 248 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2gih n PHE 249 N -2.81 0.02 0.01 5.64 3.72 -0.63 -4.63 117.46 118.78 2gih n PHE 249 Ca -0.30 -0.02 -0.00 0.00 -0.05 0.00 0.00 57.45 57.09 2gih n PHE 249 Cb 0.94 -0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.48 2gih n PHE 249 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2gih n VAL 250 N 0.72 0.34 -0.22 -4.37 0.31 -0.70 -4.75 118.33 109.67 2gih n VAL 250 Ca 0.08 0.12 -0.01 0.00 -0.01 0.00 0.00 64.34 64.51 2gih n VAL 250 Cb 0.33 -1.18 0.05 0.00 -0.91 0.00 0.00 33.84 32.13 2gih n VAL 250 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2gih h LYS 251 N -0.01 -0.05 -0.19 5.55 1.57 -1.61 -1.50 116.57 120.34 2gih h LYS 251 Ca 0.00 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.84 2gih h LYS 251 Cb 0.01 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 2gih h LYS 251 CO 0.00 -0.03 0.20 -1.35 -0.57 0.00 0.00 179.45 177.70 2gih h PRO 252 N -0.05 0.00 -0.45 3.15 0.11 -1.82 -2.33 132.00 130.61 2gih h PRO 252 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.41 2gih h PRO 252 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 2gih h PRO 252 CO -0.68 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.30 2gih n PHE 253 N -3.88 1.16 -0.07 0.65 3.72 -0.58 -4.59 117.46 113.87 2gih n PHE 253 Ca 0.02 -0.68 -0.13 0.00 -0.05 0.00 0.00 57.45 56.61 2gih n PHE 253 Cb 0.32 -0.25 -0.06 0.00 -0.94 0.00 0.00 39.48 38.56 2gih n PHE 253 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2gih h LYS 254 N 2.91 0.42 -0.38 -1.08 1.57 -1.24 -3.19 116.57 115.59 2gih h LYS 254 Ca 0.00 -0.20 0.11 0.00 -1.87 0.00 0.00 60.65 58.69 2gih h LYS 254 Cb 1.35 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.64 2gih h LYS 254 CO 0.21 0.74 0.28 1.57 -0.57 0.00 0.00 179.45 181.68 2gih h LYS 255 N 0.10 0.00 0.00 3.15 2.10 -1.81 0.15 116.57 120.27 2gih h LYS 255 Ca 0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.69 2gih h LYS 255 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 2gih h LYS 255 CO 0.04 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.15 2gih n TYR 256 N -4.35 0.19 -3.50 0.07 4.01 -1.21 -4.75 117.16 107.63 2gih n TYR 256 Ca 0.06 0.06 -0.37 0.00 -0.16 0.00 0.00 57.90 57.49 2gih n TYR 256 Cb 0.47 -0.59 -0.07 0.00 -0.31 0.00 0.00 39.34 38.84 2gih n TYR 256 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2gih s ILE 257 N -3.02 5.25 0.00 -0.72 -1.09 0.53 -5.18 121.20 116.97 2gih s ILE 257 Ca 0.13 0.66 0.00 0.00 -2.23 0.00 0.00 60.65 59.21 2gih s ILE 257 Cb 0.17 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.38 2gih s ILE 257 CO 0.54 0.41 0.17 0.18 -1.23 0.00 0.00 174.94 175.01