#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gi4 s LYS 2 N 0.00 3.88 -0.10 0.03 3.01 -1.26 -4.94 119.74 120.36 2gi4 s LYS 2 Ca 0.00 -0.37 0.03 0.00 -1.01 0.00 0.00 55.97 54.62 2gi4 s LYS 2 Cb 0.00 -3.43 0.01 0.00 -1.01 0.00 0.00 37.83 33.39 2gi4 s LYS 2 CO 0.00 -0.05 -0.19 0.15 0.51 0.00 0.00 175.35 175.77 2gi4 s LYS 3 N 1.30 2.54 -0.14 1.68 -0.14 -1.26 -1.79 119.74 121.93 2gi4 s LYS 3 Ca 0.06 -0.69 -0.01 0.00 -1.36 0.00 0.00 55.97 53.96 2gi4 s LYS 3 Cb -0.15 -2.02 -0.02 0.00 -1.68 0.00 0.00 37.83 33.96 2gi4 s LYS 3 CO 0.05 0.05 -0.10 0.42 -0.76 0.00 0.00 175.35 175.01 2gi4 s ILE 4 N 0.65 3.31 -0.32 2.17 1.09 -0.76 -0.33 121.20 127.01 2gi4 s ILE 4 Ca -0.13 -0.57 -0.05 0.00 -1.10 0.00 0.00 60.65 58.80 2gi4 s ILE 4 Cb -0.16 -2.41 0.04 0.00 -1.06 0.00 0.00 42.46 38.87 2gi4 s ILE 4 CO 0.03 0.52 0.07 -0.22 -0.10 0.00 0.00 174.94 175.24 2gi4 s LEU 5 N 0.34 4.12 -0.44 2.97 0.20 -0.50 0.02 118.68 125.38 2gi4 s LEU 5 Ca -0.09 -1.09 -0.20 0.00 0.69 0.00 0.00 54.13 53.44 2gi4 s LEU 5 Cb -0.15 -1.83 0.03 0.00 -0.43 0.00 0.00 46.19 43.80 2gi4 s LEU 5 CO 0.05 -0.29 0.60 -0.36 -0.29 0.00 0.00 176.35 176.06 2gi4 s PHE 6 N 1.38 3.08 -0.24 5.38 0.08 -0.26 -1.56 117.98 125.85 2gi4 s PHE 6 Ca -0.02 -0.17 -0.11 0.00 0.12 0.00 0.00 56.93 56.76 2gi4 s PHE 6 Cb -0.19 -3.27 -0.05 0.00 -0.57 0.00 0.00 43.02 38.94 2gi4 s PHE 6 CO 0.02 -0.85 0.18 0.42 -0.10 0.00 0.00 175.22 174.88 2gi4 s ILE 7 N 2.66 5.34 -0.06 0.64 1.09 -0.63 -1.72 121.20 128.53 2gi4 s ILE 7 Ca 0.20 0.21 0.01 0.00 -1.10 0.00 0.00 60.65 59.97 2gi4 s ILE 7 Cb -0.15 -3.52 0.02 0.00 -1.06 0.00 0.00 42.46 37.75 2gi4 s ILE 7 CO 0.17 0.33 -0.07 0.00 -0.10 0.00 0.00 174.94 175.27 2gi4 h LEU 9 N 7.38 0.00 -6.68 0.00 7.12 -1.95 -3.33 115.31 117.85 2gi4 h LEU 9 Ca -0.33 0.00 -0.51 0.00 0.13 0.00 0.00 57.88 57.17 2gi4 h LEU 9 Cb 1.16 0.00 -0.38 0.00 -0.53 0.00 0.00 40.66 40.90 2gi4 h LEU 9 CO 0.44 0.00 -0.77 -0.83 -0.13 0.00 0.00 178.44 177.15 2gi4 s GLY 10 N -3.94 0.47 0.00 3.75 0.00 -1.26 -4.70 107.32 101.64 2gi4 s GLY 10 Ca -0.04 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.51 2gi4 s GLY 10 CO 0.41 2.18 1.26 0.70 0.00 0.00 0.00 173.10 177.65 2gi4 n ASN 11 N 4.93 3.53 0.00 1.64 4.13 -1.25 -2.80 115.26 125.44 2gi4 n ASN 11 Ca -0.00 -1.97 0.00 0.00 1.68 0.00 0.00 54.58 54.28 2gi4 n ASN 11 Cb 0.42 -0.68 0.00 0.00 -1.54 0.00 0.00 39.78 37.98 2gi4 n ASN 11 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 2gi4 n ILE 12 N 0.98 0.23 0.00 2.41 -5.35 -1.26 -2.69 119.36 113.68 2gi4 n ILE 12 Ca 0.00 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.07 2gi4 n ILE 12 Cb 0.44 1.14 0.00 0.00 -1.74 0.00 0.00 39.64 39.48 2gi4 n ILE 12 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2gi4 h ARG 14 N 0.00 0.25 -0.24 0.00 9.65 -1.94 -3.07 114.38 119.04 2gi4 h ARG 14 Ca 0.00 -0.38 0.04 0.00 -1.10 0.00 0.00 59.98 58.54 2gi4 h ARG 14 Cb 0.00 0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 28.68 2gi4 h ARG 14 CO 0.00 1.15 -0.00 1.03 2.80 0.00 0.00 179.97 184.95 2gi4 h SER 15 N -0.46 -0.09 -0.28 -3.80 0.87 -1.88 -1.99 113.55 105.92 2gi4 h SER 15 Ca -0.10 0.05 -0.07 0.00 -1.23 0.00 0.00 61.79 60.44 2gi4 h SER 15 Cb 1.42 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 63.47 2gi4 h SER 15 CO 0.11 -0.02 -0.12 1.55 -0.53 0.00 0.00 176.83 177.82 2gi4 h PRO 16 N 0.07 0.57 0.02 2.24 0.13 -1.72 0.72 132.00 134.03 2gi4 h PRO 16 Ca 0.11 -0.24 0.02 0.00 -0.87 0.00 0.00 66.00 65.02 2gi4 h PRO 16 Cb 0.14 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.22 2gi4 h PRO 16 CO -0.19 0.81 -0.17 1.98 -0.23 0.00 0.00 178.00 180.19 2gi4 h MET 17 N 0.32 -0.29 0.00 0.86 4.05 -1.46 -1.05 114.93 117.37 2gi4 h MET 17 Ca 0.06 0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.50 2gi4 h MET 17 Cb 0.62 0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.49 2gi4 h MET 17 CO 0.04 -0.19 0.00 0.00 0.23 0.00 0.00 176.91 176.99 2gi4 h ALA 18 N 0.61 1.00 0.06 0.39 0.00 -1.40 -2.56 119.26 117.35 2gi4 h ALA 18 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2gi4 h ALA 18 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2gi4 h ALA 18 CO -0.15 0.00 -0.03 1.49 0.00 0.00 0.00 179.25 180.56 2gi4 h GLU 19 N 0.00 -0.08 -0.07 0.00 4.81 0.44 0.16 114.58 119.84 2gi4 h GLU 19 Ca 0.00 0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 2gi4 h GLU 19 Cb 0.66 0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.06 2gi4 h GLU 19 CO 0.00 0.08 -0.54 0.35 -0.73 0.00 0.00 179.01 178.16 2gi4 h PHE 20 N -0.22 0.69 0.50 0.92 3.57 -1.39 -2.10 116.94 118.91 2gi4 h PHE 20 Ca -0.01 -0.32 -0.02 0.00 3.53 0.00 0.00 57.97 61.15 2gi4 h PHE 20 Cb 0.19 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 2gi4 h PHE 20 CO -0.03 1.11 -0.29 0.82 -2.23 0.00 0.00 178.31 177.69 2gi4 h ILE 21 N 0.07 0.40 -0.72 1.41 2.04 -1.46 -2.15 117.51 117.10 2gi4 h ILE 21 Ca -0.05 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.86 2gi4 h ILE 21 Cb 1.21 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 37.63 2gi4 h ILE 21 CO 0.11 0.00 0.43 0.24 0.00 0.00 0.00 178.15 178.93 2gi4 h MET 22 N -0.74 0.79 -0.99 2.37 2.86 -0.80 -1.19 114.93 117.24 2gi4 h MET 22 Ca -0.06 -0.05 0.21 0.00 -2.06 0.00 0.00 59.70 57.74 2gi4 h MET 22 Cb 0.60 -0.18 -0.10 0.00 0.06 0.00 0.00 31.60 31.99 2gi4 h MET 22 CO 0.07 0.53 0.62 0.87 1.06 0.00 0.00 176.91 180.05 2gi4 h LYS 23 N 0.82 0.58 -0.04 1.72 1.79 -1.10 0.43 116.57 120.78 2gi4 h LYS 23 Ca 0.30 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.72 2gi4 h LYS 23 Cb 0.10 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 30.62 2gi4 h LYS 23 CO -0.14 0.39 -0.05 -0.44 -1.08 0.00 0.00 179.45 178.13 2gi4 h ASP 24 N 0.60 0.10 0.59 0.86 3.32 -0.58 -3.11 116.42 118.21 2gi4 h ASP 24 Ca 0.56 -0.51 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 2gi4 h ASP 24 Cb 1.09 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.61 2gi4 h ASP 24 CO -0.32 0.60 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.67 2gi4 h LEU 25 N -0.38 0.00 0.25 1.55 3.38 -0.68 -3.18 115.31 116.25 2gi4 h LEU 25 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2gi4 h LEU 25 Cb 0.57 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 2gi4 h LEU 25 CO 0.01 0.06 -0.30 0.58 0.09 0.00 0.00 178.44 178.88 2gi4 h VAL 26 N 0.00 0.37 -0.58 1.22 2.07 -0.13 -1.89 116.25 117.32 2gi4 h VAL 26 Ca -0.00 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.69 2gi4 h VAL 26 Cb 0.37 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 2gi4 h VAL 26 CO 0.01 0.00 0.49 0.11 0.02 0.00 0.00 177.57 178.20 2gi4 h LYS 27 N -0.60 0.00 0.27 1.57 1.57 -1.66 1.08 116.57 118.81 2gi4 h LYS 27 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2gi4 h LYS 27 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2gi4 h LYS 27 CO -0.09 0.00 -0.13 -0.22 -0.57 0.00 0.00 179.45 178.44 2gi4 h LYS 28 N 0.00 -0.35 0.00 3.15 3.64 -1.49 -3.38 116.57 118.14 2gi4 h LYS 28 Ca 0.28 0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.59 2gi4 h LYS 28 Cb 1.25 0.08 -0.19 0.00 -0.41 0.00 0.00 32.23 32.96 2gi4 h LYS 28 CO -0.00 -0.02 -0.72 0.00 -2.27 0.00 0.00 179.45 176.44 2gi4 n ALA 29 N -2.46 2.69 0.08 5.00 0.00 -0.97 -4.81 120.51 120.04 2gi4 n ALA 29 Ca -0.09 -2.48 0.00 0.00 0.00 0.00 0.00 53.44 50.87 2gi4 n ALA 29 Cb 0.26 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.14 2gi4 n ALA 29 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2gi4 n ASN 30 N -0.21 0.07 0.34 0.00 3.02 0.36 -4.77 115.26 114.07 2gi4 n ASN 30 Ca 0.10 0.27 0.22 0.00 -0.03 0.00 0.00 54.58 55.14 2gi4 n ASN 30 Cb 0.91 0.16 1.20 0.00 -0.61 0.00 0.00 39.78 41.44 2gi4 n ASN 30 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2gi4 h LEU 31 N 0.00 0.00 -0.17 3.41 7.12 -1.36 0.14 115.31 124.46 2gi4 h LEU 31 Ca 0.00 0.00 -0.15 0.00 0.13 0.00 0.00 57.88 57.86 2gi4 h LEU 31 Cb 0.08 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.22 2gi4 h LEU 31 CO 0.00 0.00 -0.50 -0.33 -0.13 0.00 0.00 178.44 177.48 2gi4 h GLU 32 N 0.00 0.63 -0.66 1.25 4.39 -1.81 -3.13 114.58 115.25 2gi4 h GLU 32 Ca 0.00 -0.45 0.00 0.00 0.34 0.00 0.00 59.36 59.25 2gi4 h GLU 32 Cb 0.03 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 2gi4 h GLU 32 CO -0.00 1.07 0.00 1.63 -1.16 0.00 0.00 179.01 180.55 2gi4 n LYS 33 N -4.18 3.31 -3.09 2.33 4.76 -0.47 -4.96 118.16 115.85 2gi4 n LYS 33 Ca -0.07 -2.62 -0.07 0.00 -2.87 0.00 0.00 58.31 52.68 2gi4 n LYS 33 Cb 0.59 -1.77 0.03 0.00 -1.84 0.00 0.00 35.03 32.04 2gi4 n LYS 33 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2gi4 n GLU 34 N 1.17 -1.71 -3.91 1.97 1.02 0.05 -5.01 120.64 114.22 2gi4 n GLU 34 Ca 0.24 1.15 -0.35 0.00 -0.02 0.00 0.00 57.16 58.18 2gi4 n GLU 34 Cb 0.77 -5.64 -0.08 0.00 -0.02 0.00 0.00 31.44 26.47 2gi4 n GLU 34 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2gi4 s PHE 35 N -3.19 3.37 -0.13 -0.32 0.40 0.29 -4.58 117.98 113.82 2gi4 s PHE 35 Ca 0.22 0.26 -0.04 0.00 -0.60 0.00 0.00 56.93 56.77 2gi4 s PHE 35 Cb -0.03 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.41 2gi4 s PHE 35 CO 0.72 0.33 0.00 -0.06 0.70 0.00 0.00 175.22 176.91 2gi4 s PHE 36 N 0.02 3.13 0.07 0.36 0.40 -0.74 -4.59 117.98 116.63 2gi4 s PHE 36 Ca 0.08 0.01 0.06 0.00 -0.60 0.00 0.00 56.93 56.48 2gi4 s PHE 36 Cb -0.12 -1.90 -0.03 0.00 0.51 0.00 0.00 43.02 41.48 2gi4 s PHE 36 CO 0.00 0.24 -0.16 0.96 0.70 0.00 0.00 175.22 176.97 2gi4 s ILE 37 N -0.23 1.25 0.15 0.64 -4.36 -1.26 -1.83 121.20 115.55 2gi4 s ILE 37 Ca 0.06 -1.26 0.00 0.00 -0.26 0.00 0.00 60.65 59.19 2gi4 s ILE 37 Cb -0.12 -1.16 -0.04 0.00 1.25 0.00 0.00 42.46 42.38 2gi4 s ILE 37 CO 0.02 -0.11 0.03 0.20 0.24 0.00 0.00 174.94 175.32 2gi4 s ASN 38 N -1.58 0.77 -0.26 4.36 0.01 0.10 -4.91 114.94 113.43 2gi4 s ASN 38 Ca 0.01 -1.19 -0.11 0.00 -0.71 0.00 0.00 52.86 50.86 2gi4 s ASN 38 Cb -0.09 0.20 0.10 0.00 0.41 0.00 0.00 41.25 41.87 2gi4 s ASN 38 CO 0.02 -0.65 0.60 -0.44 -1.51 0.00 0.00 177.10 175.12 2gi4 s SER 39 N -3.11 -0.87 0.33 -1.22 0.01 -1.26 -1.10 113.70 106.49 2gi4 s SER 39 Ca 0.24 1.38 -0.04 0.00 1.31 0.00 0.00 55.95 58.84 2gi4 s SER 39 Cb 0.07 1.70 0.02 0.00 0.21 0.00 0.00 66.02 68.01 2gi4 s SER 39 CO 0.03 -0.23 0.51 0.00 0.41 0.00 0.00 173.24 173.96 2gi4 n ALA 40 N 4.96 -0.60 -3.28 1.44 0.00 -0.70 -4.86 120.51 117.48 2gi4 n ALA 40 Ca -0.15 -1.43 -0.21 0.00 0.00 0.00 0.00 53.44 51.65 2gi4 n ALA 40 Cb 0.53 1.15 0.04 0.00 0.00 0.00 0.00 19.45 21.16 2gi4 n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gi4 n GLY 41 N -0.53 2.22 0.11 0.00 0.00 -1.02 -1.79 105.19 104.18 2gi4 n GLY 41 Ca -0.01 -2.23 -0.14 0.00 0.00 0.00 0.00 46.02 43.64 2gi4 n GLY 41 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2gi4 h THR 42 N 0.26 1.43 0.00 2.61 1.35 -1.86 0.78 112.91 117.47 2gi4 h THR 42 Ca -0.24 -1.55 0.00 0.00 -0.55 0.00 0.00 66.41 64.06 2gi4 h THR 42 Cb 1.03 2.29 0.00 0.00 -1.73 0.00 0.00 68.15 69.74 2gi4 h THR 42 CO 0.36 0.44 0.00 -1.20 -0.25 0.00 0.00 175.52 174.86 2gi4 n SER 43 N -4.57 0.58 -1.29 5.36 7.64 -1.26 -4.52 113.62 115.56 2gi4 n SER 43 Ca -0.08 -0.89 -0.16 0.00 1.01 0.00 0.00 58.87 58.75 2gi4 n SER 43 Cb 0.41 0.12 -0.06 0.00 -1.01 0.00 0.00 64.21 63.67 2gi4 n SER 43 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gi4 n GLY 44 N 0.12 1.35 0.42 0.23 0.00 -1.25 -4.81 105.19 101.25 2gi4 n GLY 44 Ca 0.00 -0.26 -0.16 0.00 0.00 0.00 0.00 46.02 45.59 2gi4 n GLY 44 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2gi4 h GLU 45 N 0.00 -0.79 0.00 1.61 5.08 -1.95 -3.40 114.58 115.14 2gi4 h GLU 45 Ca -0.33 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2gi4 h GLU 45 Cb 1.06 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2gi4 h GLU 45 CO 0.47 -0.53 -0.65 -2.39 -1.00 0.00 0.00 179.01 174.91 2gi4 n HIS 46 N -5.50 0.00 -1.39 4.33 -0.00 -1.26 -5.03 115.22 106.37 2gi4 n HIS 46 Ca -0.10 0.00 -0.50 0.00 -0.00 0.00 0.00 57.72 57.12 2gi4 n HIS 46 Cb 0.40 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 30.27 2gi4 n HIS 46 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 2gi4 n ASP 47 N -1.28 0.94 0.00 4.39 8.00 -1.26 -1.32 116.55 126.01 2gi4 n ASP 47 Ca 0.00 0.38 0.00 0.00 0.71 0.00 0.00 54.79 55.88 2gi4 n ASP 47 Cb 0.20 -1.02 0.00 0.00 -0.02 0.00 0.00 41.12 40.28 2gi4 n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gi4 n GLY 48 N 6.88 1.88 0.00 0.44 0.00 -1.09 -2.13 105.19 111.17 2gi4 n GLY 48 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.57 2gi4 n GLY 48 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gi4 n GLU 49 N -0.54 0.00 0.00 1.61 -0.58 -0.43 -0.54 120.64 120.15 2gi4 n GLU 49 Ca 0.00 0.27 0.00 0.00 -0.42 0.00 0.00 57.16 57.01 2gi4 n GLU 49 Cb 0.00 -0.91 0.00 0.00 -0.57 0.00 0.00 31.44 29.96 2gi4 n GLU 49 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gi4 n GLY 50 N 1.34 0.01 3.61 0.62 0.00 -1.26 -4.76 105.19 104.75 2gi4 n GLY 50 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2gi4 n GLY 50 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2gi4 s MET 51 N 0.00 0.47 -0.15 1.61 0.23 -1.26 -4.79 119.30 115.42 2gi4 s MET 51 Ca 0.00 -0.23 -0.30 0.00 -1.03 0.00 0.00 55.69 54.13 2gi4 s MET 51 Cb 0.00 0.18 0.11 0.00 -1.53 0.00 0.00 34.83 33.59 2gi4 s MET 51 CO 0.00 -0.21 0.91 -1.58 -2.03 0.00 0.00 175.02 172.11 2gi4 s HIS 52 N -2.56 -0.47 0.47 3.16 2.46 -1.15 -4.90 115.29 112.31 2gi4 s HIS 52 Ca 0.11 0.84 -0.21 0.00 0.47 0.00 0.00 55.06 56.27 2gi4 s HIS 52 Cb 0.02 0.43 -0.11 0.00 -0.13 0.00 0.00 32.58 32.79 2gi4 s HIS 52 CO -0.04 -0.40 0.67 0.98 -2.47 0.00 0.00 174.74 173.48 2gi4 n TYR 53 N 0.97 -0.10 0.00 3.88 9.36 -1.26 -2.02 117.16 127.98 2gi4 n TYR 53 Ca -0.13 0.54 0.00 0.00 3.32 0.00 0.00 57.90 61.63 2gi4 n TYR 53 Cb 0.57 -2.04 0.00 0.00 -0.63 0.00 0.00 39.34 37.24 2gi4 n TYR 53 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2gi4 n GLY 54 N 1.62 2.20 0.07 2.98 0.00 -1.26 -4.54 105.19 106.27 2gi4 n GLY 54 Ca 0.11 -0.31 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 2gi4 n GLY 54 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2gi4 h THR 55 N 0.00 0.91 -0.70 2.61 2.02 -1.83 -2.16 112.91 113.76 2gi4 h THR 55 Ca 0.00 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.26 2gi4 h THR 55 Cb 0.00 0.91 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 2gi4 h THR 55 CO 0.00 0.00 0.46 0.07 0.37 0.00 0.00 175.52 176.42 2gi4 h LYS 56 N -0.02 0.64 -0.02 6.66 2.10 -1.64 -0.16 116.57 124.13 2gi4 h LYS 56 Ca 0.03 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2gi4 h LYS 56 Cb 0.07 -0.14 -0.00 0.00 -0.90 0.00 0.00 32.23 31.25 2gi4 h LYS 56 CO -0.07 0.42 0.01 -0.97 -2.00 0.00 0.00 179.45 176.85 2gi4 h ASN 57 N 0.66 0.02 -0.09 7.07 -1.24 -1.63 0.61 115.58 120.98 2gi4 h ASN 57 Ca 0.31 -0.08 -0.00 0.00 0.71 0.00 0.00 56.30 57.23 2gi4 h ASN 57 Cb 0.36 -0.01 -0.00 0.00 0.73 0.00 0.00 38.32 39.40 2gi4 h ASN 57 CO -0.10 0.10 0.04 0.50 -1.29 0.00 0.00 177.43 176.68 2gi4 h LYS 58 N -0.06 0.13 -0.58 6.67 1.63 -0.88 -2.03 116.57 121.44 2gi4 h LYS 58 Ca 0.01 -0.02 0.10 0.00 -0.85 0.00 0.00 60.65 59.88 2gi4 h LYS 58 Cb 0.08 -0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 31.61 2gi4 h LYS 58 CO -0.00 0.20 0.18 -0.07 -3.45 0.00 0.00 179.45 176.31 2gi4 h LEU 59 N 0.02 0.14 -1.70 5.20 3.38 -0.92 0.75 115.31 122.17 2gi4 h LEU 59 Ca 0.03 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2gi4 h LEU 59 Cb 0.11 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2gi4 h LEU 59 CO -0.00 0.09 0.16 0.00 0.09 0.00 0.00 178.44 178.78 2gi4 h ALA 60 N 1.42 1.78 0.42 1.53 0.00 -0.61 0.17 119.26 123.98 2gi4 h ALA 60 Ca 0.30 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2gi4 h ALA 60 Cb 0.39 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2gi4 h ALA 60 CO -0.33 0.20 -0.34 1.96 0.00 0.00 0.00 179.25 180.74 2gi4 h GLN 61 N 0.37 -0.73 0.00 0.00 4.20 -0.11 -3.43 115.11 115.41 2gi4 h GLN 61 Ca 0.10 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.86 2gi4 h GLN 61 Cb -0.02 0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2gi4 h GLN 61 CO -0.02 -0.49 0.00 1.47 -0.67 0.00 0.00 178.83 179.13 2gi4 n LEU 62 N -5.46 0.00 0.00 1.46 -0.00 -1.11 -5.12 117.00 106.78 2gi4 n LEU 62 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.90 2gi4 n LEU 62 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.78 2gi4 n LEU 62 CO 0.31 0.00 0.00 0.59 -0.00 0.00 0.00 177.39 178.29 2gi4 n ASN 63 N -0.70 0.00 -4.72 1.45 3.02 0.60 -5.02 115.26 109.88 2gi4 n ASN 63 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 2gi4 n ASN 63 Cb 0.00 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.09 2gi4 n ASN 63 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2gi4 s ILE 64 N 0.00 5.34 -0.10 2.41 -1.09 -1.22 -4.46 121.20 122.08 2gi4 s ILE 64 Ca 0.00 0.16 0.12 0.00 -2.23 0.00 0.00 60.65 58.71 2gi4 s ILE 64 Cb 0.00 -3.43 0.12 0.00 -1.58 0.00 0.00 42.46 37.57 2gi4 s ILE 64 CO 0.00 0.45 1.28 1.21 -1.23 0.00 0.00 174.94 176.65 2gi4 n GLU 65 N 3.50 0.08 0.00 2.79 2.13 -1.26 -4.65 120.64 123.23 2gi4 n GLU 65 Ca -0.16 0.55 0.00 0.00 0.66 0.00 0.00 57.16 58.20 2gi4 n GLU 65 Cb 0.52 -2.02 0.00 0.00 0.27 0.00 0.00 31.44 30.21 2gi4 n GLU 65 CO 0.00 0.00 0.00 -2.39 -0.41 0.00 0.00 177.13 174.33 2gi4 n HIS 66 N -1.98 0.00 -3.65 4.31 1.44 -1.26 -4.87 115.22 109.21 2gi4 n HIS 66 Ca -0.01 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.69 2gi4 n HIS 66 Cb 0.26 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.31 2gi4 n HIS 66 CO 0.00 0.00 0.00 0.21 -2.81 0.00 0.00 176.34 173.74 2gi4 s LYS 67 N -2.00 0.08 -1.53 -1.40 2.47 -1.26 -4.97 119.74 111.13 2gi4 s LYS 67 Ca 0.00 0.11 -0.01 0.00 -1.56 0.00 0.00 55.97 54.51 2gi4 s LYS 67 Cb 0.00 0.03 0.00 0.00 -1.46 0.00 0.00 37.83 36.40 2gi4 s LYS 67 CO 0.00 -0.01 0.17 0.09 0.16 0.00 0.00 175.35 175.76 2gi4 n ASN 68 N 2.30 -5.49 -4.64 1.43 5.03 -1.26 -4.57 115.26 108.06 2gi4 n ASN 68 Ca -0.13 -0.09 -0.42 0.00 0.87 0.00 0.00 54.58 54.80 2gi4 n ASN 68 Cb 0.57 -4.47 -0.04 0.00 -1.02 0.00 0.00 39.78 34.81 2gi4 n ASN 68 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2gi4 s PHE 69 N -2.99 3.32 -0.23 3.10 0.08 -1.26 -5.00 117.98 115.00 2gi4 s PHE 69 Ca 0.09 1.13 -0.14 0.00 0.12 0.00 0.00 56.93 58.13 2gi4 s PHE 69 Cb -0.04 -3.04 0.07 0.00 -0.57 0.00 0.00 43.02 39.44 2gi4 s PHE 69 CO 0.11 -0.39 0.57 0.95 -0.10 0.00 0.00 175.22 176.35 2gi4 s THR 70 N 2.79 -0.01 -0.49 0.64 -4.23 -1.24 -4.97 115.64 108.12 2gi4 s THR 70 Ca 0.35 0.04 -0.26 0.00 -1.18 0.00 0.00 61.69 60.63 2gi4 s THR 70 Cb -0.15 -0.82 -0.06 0.00 1.34 0.00 0.00 72.50 72.81 2gi4 s THR 70 CO 0.08 0.01 2.27 -0.44 -0.54 0.00 0.00 174.62 176.00 2gi4 s SER 71 N 1.33 4.71 0.11 3.99 0.01 0.29 -4.29 113.70 119.85 2gi4 s SER 71 Ca -0.08 0.99 0.08 0.00 1.31 0.00 0.00 55.95 58.25 2gi4 s SER 71 Cb -0.06 -2.51 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 2gi4 s SER 71 CO -0.14 -2.69 -0.15 -0.54 0.41 0.00 0.00 173.24 170.13 2gi4 s LYS 72 N 7.82 1.91 -0.32 12.44 1.02 -0.91 -4.97 119.74 136.73 2gi4 s LYS 72 Ca 0.91 -1.12 -0.01 0.00 0.02 0.00 0.00 55.97 55.77 2gi4 s LYS 72 Cb -0.17 -2.18 0.11 0.00 -0.52 0.00 0.00 37.83 35.06 2gi4 s LYS 72 CO 0.26 0.49 0.13 -1.59 -0.92 0.00 0.00 175.35 173.72 2gi4 s LYS 73 N -2.13 0.61 -0.06 1.68 -2.85 -1.26 -2.43 119.74 113.31 2gi4 s LYS 73 Ca 0.19 -1.04 -0.35 0.00 -1.00 0.00 0.00 55.97 53.78 2gi4 s LYS 73 Cb -0.11 -1.74 -0.12 0.00 -2.06 0.00 0.00 37.83 33.80 2gi4 s LYS 73 CO 0.11 -1.03 1.82 -0.11 0.10 0.00 0.00 175.35 176.23 2gi4 n LEU 74 N 4.77 3.30 0.00 2.77 0.00 0.27 -4.85 117.00 123.25 2gi4 n LEU 74 Ca -0.01 1.00 -0.19 0.00 0.00 0.00 0.00 56.01 56.81 2gi4 n LEU 74 Cb 0.41 -1.36 -0.02 0.00 0.00 0.00 0.00 43.42 42.44 2gi4 n LEU 74 CO 0.11 -0.13 -0.06 0.41 0.00 0.00 0.00 177.39 177.71 2gi4 n THR 75 N 4.80 0.00 -0.03 1.96 -1.04 -1.26 -4.73 114.28 113.98 2gi4 n THR 75 Ca 0.22 -1.48 -0.12 0.00 -2.04 0.00 0.00 64.05 60.63 2gi4 n THR 75 Cb 0.28 0.08 -0.07 0.00 -1.82 0.00 0.00 70.33 68.80 2gi4 n THR 75 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 2gi4 h GLN 76 N 0.00 0.20 -0.89 -2.82 4.15 -1.93 -0.92 115.11 112.89 2gi4 h GLN 76 Ca -0.25 -0.06 0.02 0.00 0.77 0.00 0.00 58.65 59.13 2gi4 h GLN 76 Cb 0.82 -0.02 -0.05 0.00 0.21 0.00 0.00 27.48 28.44 2gi4 h GLN 76 CO 0.40 0.42 0.59 -0.22 -1.93 0.00 0.00 178.83 178.09 2gi4 h LYS 77 N -0.06 1.13 -0.59 1.69 3.64 -1.99 0.12 116.57 120.51 2gi4 h LYS 77 Ca 0.03 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 2gi4 h LYS 77 Cb 0.33 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 2gi4 h LYS 77 CO 0.00 0.75 0.01 1.25 -2.27 0.00 0.00 179.45 179.20 2gi4 h LEU 78 N 1.16 0.99 -0.61 5.20 5.85 -1.93 -2.85 115.31 123.12 2gi4 h LEU 78 Ca 0.34 -0.27 -0.11 0.00 0.84 0.00 0.00 57.88 58.69 2gi4 h LEU 78 Cb -0.06 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.68 2gi4 h LEU 78 CO -0.10 1.04 -0.07 0.00 -0.34 0.00 0.00 178.44 178.97 2gi4 h ASP 80 N 0.92 0.00 0.00 0.00 1.82 -0.78 -3.04 116.42 115.34 2gi4 h ASP 80 Ca 0.15 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.79 2gi4 h ASP 80 Cb 0.63 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.64 2gi4 h ASP 80 CO 0.04 0.00 -0.01 -0.33 -1.61 0.00 0.00 179.24 177.33 2gi4 h GLU 81 N 0.00 0.00 -6.74 0.28 4.39 -1.21 -3.45 114.58 107.84 2gi4 h GLU 81 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 2gi4 h GLU 81 Cb 0.13 0.00 0.07 0.00 -0.10 0.00 0.00 28.75 28.85 2gi4 h GLU 81 CO 0.00 0.17 0.90 -1.54 -1.16 0.00 0.00 179.01 177.38 2gi4 s SER 82 N -5.67 6.43 0.23 1.42 1.04 -1.13 -4.76 113.70 111.26 2gi4 s SER 82 Ca -0.03 2.86 0.24 0.00 0.48 0.00 0.00 55.95 59.50 2gi4 s SER 82 Cb -0.00 -2.62 0.33 0.00 0.10 0.00 0.00 66.02 63.83 2gi4 s SER 82 CO 0.12 -0.89 1.39 -0.78 0.98 0.00 0.00 173.24 174.06 2gi4 h ASP 83 N 5.52 0.00 -3.20 7.02 3.58 -0.96 -3.44 116.42 124.95 2gi4 h ASP 83 Ca -0.45 -0.07 -0.61 0.00 0.42 0.00 0.00 57.03 56.31 2gi4 h ASP 83 Cb 1.21 0.00 -0.36 0.00 1.72 0.00 0.00 39.33 41.90 2gi4 h ASP 83 CO 0.84 0.04 -0.83 -0.36 -2.88 0.00 0.00 179.24 176.05 2gi4 s PHE 84 N -3.22 2.23 -0.09 0.28 0.40 -0.92 -5.01 117.98 111.66 2gi4 s PHE 84 Ca 0.05 -1.32 -0.15 0.00 -0.60 0.00 0.00 56.93 54.92 2gi4 s PHE 84 Cb 0.10 -1.60 -0.05 0.00 0.51 0.00 0.00 43.02 41.98 2gi4 s PHE 84 CO 0.71 -0.69 0.38 -0.51 0.70 0.00 0.00 175.22 175.81 2gi4 s LEU 85 N 1.47 4.35 -0.15 -0.37 2.01 0.09 -1.41 118.68 124.67 2gi4 s LEU 85 Ca 0.03 0.77 -0.00 0.00 0.01 0.00 0.00 54.13 54.94 2gi4 s LEU 85 Cb -0.14 -2.54 0.03 0.00 0.01 0.00 0.00 46.19 43.56 2gi4 s LEU 85 CO -0.10 0.17 -0.10 -0.63 1.01 0.00 0.00 176.35 176.70 2gi4 s ILE 86 N -0.12 1.31 -0.32 -0.59 1.09 -0.60 -0.70 121.20 121.26 2gi4 s ILE 86 Ca 0.22 -0.57 0.01 0.00 -1.10 0.00 0.00 60.65 59.21 2gi4 s ILE 86 Cb -0.15 -1.33 0.08 0.00 -1.06 0.00 0.00 42.46 40.00 2gi4 s ILE 86 CO 0.09 0.33 0.03 0.42 -0.10 0.00 0.00 174.94 175.71 2gi4 s THR 87 N 1.58 2.66 -0.01 2.92 -4.23 0.89 -1.60 115.64 117.86 2gi4 s THR 87 Ca 0.03 -1.83 0.04 0.00 -1.18 0.00 0.00 61.69 58.75 2gi4 s THR 87 Cb -0.14 -2.71 -0.25 0.00 1.34 0.00 0.00 72.50 70.75 2gi4 s THR 87 CO -0.09 -0.33 0.80 -0.03 -0.54 0.00 0.00 174.62 174.43 2gi4 h MET 88 N 7.85 0.12 -6.89 3.99 4.05 -1.72 -3.33 114.93 119.01 2gi4 h MET 88 Ca -0.15 -0.21 -0.47 0.00 -0.28 0.00 0.00 59.70 58.60 2gi4 h MET 88 Cb 1.04 0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.90 2gi4 h MET 88 CO 0.54 0.89 0.29 -0.51 0.23 0.00 0.00 176.91 178.35 2gi4 s ASP 89 N -6.63 7.11 0.08 1.39 1.11 -1.26 -4.48 116.67 113.99 2gi4 s ASP 89 Ca -0.07 1.68 -0.20 0.00 0.18 0.00 0.00 52.55 54.13 2gi4 s ASP 89 Cb 0.08 -2.53 -0.10 0.00 1.07 0.00 0.00 42.92 41.44 2gi4 s ASP 89 CO 0.83 -0.17 1.58 -1.13 1.18 0.00 0.00 175.17 177.45 2gi4 h ASN 90 N 2.66 0.26 1.17 0.27 -0.73 -1.82 -2.72 115.58 114.67 2gi4 h ASN 90 Ca -0.48 -0.22 -0.01 0.00 1.87 0.00 0.00 56.30 57.47 2gi4 h ASN 90 Cb 1.19 -0.07 -0.00 0.00 0.27 0.00 0.00 38.32 39.71 2gi4 h ASN 90 CO 0.64 0.41 -0.04 -1.28 -0.37 0.00 0.00 177.43 176.79 2gi4 h SER 91 N 0.10 0.00 -0.55 1.15 0.87 -1.94 -3.04 113.55 110.13 2gi4 h SER 91 Ca 0.06 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2gi4 h SER 91 Cb 0.25 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 2gi4 h SER 91 CO -0.00 0.04 0.36 0.78 -0.53 0.00 0.00 176.83 177.48 2gi4 h ASN 92 N 0.00 0.64 -0.46 6.23 2.35 -1.87 -1.76 115.58 120.71 2gi4 h ASN 92 Ca -0.00 -0.02 -0.06 0.00 -0.55 0.00 0.00 56.30 55.67 2gi4 h ASN 92 Cb 0.63 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.83 2gi4 h ASN 92 CO 0.00 0.47 0.06 0.15 -1.65 0.00 0.00 177.43 176.46 2gi4 h PHE 93 N 0.75 0.81 -0.58 1.19 3.57 -1.55 -1.98 116.94 119.15 2gi4 h PHE 93 Ca 0.20 -0.12 -0.10 0.00 3.53 0.00 0.00 57.97 61.49 2gi4 h PHE 93 Cb -0.08 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.42 2gi4 h PHE 93 CO 0.00 0.77 -0.02 -0.22 -2.23 0.00 0.00 178.31 176.61 2gi4 h LYS 94 N 0.62 1.04 0.52 1.11 3.64 -1.57 -1.52 116.57 120.42 2gi4 h LYS 94 Ca 0.14 -0.34 -0.03 0.00 -1.27 0.00 0.00 60.65 59.15 2gi4 h LYS 94 Cb 0.40 -0.09 0.01 0.00 -0.41 0.00 0.00 32.23 32.14 2gi4 h LYS 94 CO 0.01 1.03 -0.25 -0.97 -2.27 0.00 0.00 179.45 177.00 2gi4 h ASN 95 N 0.93 -0.60 0.17 4.20 -0.73 -1.24 -2.76 115.58 115.55 2gi4 h ASN 95 Ca 0.16 -0.04 -0.01 0.00 1.87 0.00 0.00 56.30 58.29 2gi4 h ASN 95 Cb 0.58 0.15 -0.00 0.00 0.27 0.00 0.00 38.32 39.32 2gi4 h ASN 95 CO 0.03 -0.33 -0.04 -0.37 -0.37 0.00 0.00 177.43 176.36 2gi4 h VAL 96 N -0.85 0.42 -0.56 2.57 -1.51 -1.39 0.45 116.25 115.37 2gi4 h VAL 96 Ca -0.07 -0.20 -0.05 0.00 -1.23 0.00 0.00 66.70 65.15 2gi4 h VAL 96 Cb 0.60 1.14 -0.02 0.00 -2.13 0.00 0.00 31.29 30.87 2gi4 h VAL 96 CO 0.12 0.04 0.17 0.25 -1.23 0.00 0.00 177.57 176.92 2gi4 h LEU 97 N 0.00 0.82 -0.95 4.19 7.12 -0.98 -1.12 115.31 124.39 2gi4 h LEU 97 Ca -0.00 -0.21 0.00 0.00 0.13 0.00 0.00 57.88 57.80 2gi4 h LEU 97 Cb 0.14 -0.22 0.00 0.00 -0.53 0.00 0.00 40.66 40.05 2gi4 h LEU 97 CO 0.01 0.81 -0.49 0.29 -0.13 0.00 0.00 178.44 178.93 2gi4 n LYS 98 N -4.43 1.19 0.01 1.25 4.76 -0.93 -4.23 118.16 115.78 2gi4 n LYS 98 Ca 0.03 -0.94 0.11 0.00 -2.87 0.00 0.00 58.31 54.63 2gi4 n LYS 98 Cb 0.21 -1.47 -0.11 0.00 -1.84 0.00 0.00 35.03 31.82 2gi4 n LYS 98 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2gi4 n ASN 99 N -0.10 0.38 -4.74 4.39 5.15 0.10 -4.98 115.26 115.46 2gi4 n ASN 99 Ca 0.09 -0.16 -0.31 0.00 -0.60 0.00 0.00 54.58 53.59 2gi4 n ASN 99 Cb 0.45 1.43 -0.08 0.00 -0.53 0.00 0.00 39.78 41.06 2gi4 n ASN 99 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2gi4 s PHE 100 N -3.36 2.02 0.00 1.20 0.08 -0.43 -4.84 117.98 112.65 2gi4 s PHE 100 Ca -0.02 -0.87 0.00 0.00 0.12 0.00 0.00 56.93 56.16 2gi4 s PHE 100 Cb 0.14 -1.69 0.00 0.00 -0.57 0.00 0.00 43.02 40.90 2gi4 s PHE 100 CO 0.87 0.21 0.00 0.25 -0.10 0.00 0.00 175.22 176.45 2gi4 n THR 101 N -1.24 0.00 0.36 0.64 -2.24 -1.26 -4.85 114.28 105.68 2gi4 n THR 101 Ca -0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2gi4 n THR 101 Cb 0.67 -1.94 0.00 0.00 -2.10 0.00 0.00 70.33 66.96 2gi4 n THR 101 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2gi4 n ASN 102 N -2.38 0.01 -0.56 3.42 5.15 -1.26 -2.25 115.26 117.39 2gi4 n ASN 102 Ca 0.00 -0.38 0.11 0.00 -0.60 0.00 0.00 54.58 53.71 2gi4 n ASN 102 Cb 0.00 -0.01 0.39 0.00 -0.53 0.00 0.00 39.78 39.63 2gi4 n ASN 102 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2gi4 n THR 103 N -0.43 0.19 0.10 -0.44 -2.24 -1.26 -4.07 114.28 106.12 2gi4 n THR 103 Ca 0.00 -0.34 0.01 0.00 -2.27 0.00 0.00 64.05 61.45 2gi4 n THR 103 Cb 0.00 0.41 0.06 0.00 -2.10 0.00 0.00 70.33 68.70 2gi4 n THR 103 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gi4 n GLN 104 N 0.34 0.01 0.00 -0.78 -0.00 -0.95 -1.58 117.38 114.41 2gi4 n GLN 104 Ca 0.17 0.40 0.08 0.00 -0.00 0.00 0.00 57.00 57.65 2gi4 n GLN 104 Cb 0.34 -1.50 0.49 0.00 -0.00 0.00 0.00 30.24 29.57 2gi4 n GLN 104 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 2gi4 n ASN 105 N -1.44 0.00 -1.08 2.61 5.15 -1.26 -2.83 115.26 116.41 2gi4 n ASN 105 Ca 0.01 -1.16 0.05 0.00 -0.60 0.00 0.00 54.58 52.88 2gi4 n ASN 105 Cb 0.03 0.00 0.26 0.00 -0.53 0.00 0.00 39.78 39.54 2gi4 n ASN 105 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2gi4 n LYS 106 N -0.81 2.89 -3.38 1.20 4.76 -0.62 -5.00 118.16 117.20 2gi4 n LYS 106 Ca 0.12 -2.94 -0.37 0.00 -2.87 0.00 0.00 58.31 52.25 2gi4 n LYS 106 Cb 0.06 -1.89 -0.06 0.00 -1.84 0.00 0.00 35.03 31.29 2gi4 n LYS 106 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2gi4 s VAL 107 N -2.92 4.88 -0.14 -0.18 -7.23 -1.13 -0.73 120.40 112.95 2gi4 s VAL 107 Ca 0.44 0.95 -0.03 0.00 -1.81 0.00 0.00 61.98 61.54 2gi4 s VAL 107 Cb 0.37 -3.78 -0.03 0.00 0.56 0.00 0.00 36.38 33.49 2gi4 s VAL 107 CO 0.08 0.46 -0.03 -0.76 -0.31 0.00 0.00 175.10 174.54 2gi4 s LEU 108 N -1.39 3.35 0.04 1.32 1.02 0.12 -4.88 118.68 118.26 2gi4 s LEU 108 Ca 0.30 -0.05 0.07 0.00 0.02 0.00 0.00 54.13 54.47 2gi4 s LEU 108 Cb -0.17 -1.79 -0.03 0.00 0.02 0.00 0.00 46.19 44.21 2gi4 s LEU 108 CO 0.17 0.23 -0.17 -0.54 0.02 0.00 0.00 176.35 176.06 2gi4 s LYS 109 N 0.01 2.10 0.34 1.70 1.02 -1.25 -0.07 119.74 123.59 2gi4 s LYS 109 Ca 0.01 -0.97 0.11 0.00 0.02 0.00 0.00 55.97 55.14 2gi4 s LYS 109 Cb -0.13 -2.21 0.61 0.00 -0.52 0.00 0.00 37.83 35.57 2gi4 s LYS 109 CO 0.02 0.54 1.77 0.97 -0.92 0.00 0.00 175.35 177.74 2gi4 h ILE 110 N 3.90 1.30 -0.03 2.17 6.09 -1.79 -2.76 117.51 126.38 2gi4 h ILE 110 Ca -0.48 -1.42 0.01 0.00 -1.37 0.00 0.00 64.86 61.60 2gi4 h ILE 110 Cb 1.16 1.72 -0.00 0.00 0.47 0.00 0.00 36.82 40.17 2gi4 h ILE 110 CO 0.48 0.41 0.08 0.00 -3.07 0.00 0.00 178.15 176.05 2gi4 h THR 111 N 0.06 0.22 0.00 2.19 1.03 -1.91 0.71 112.91 115.21 2gi4 h THR 111 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 66.41 66.26 2gi4 h THR 111 Cb 0.74 0.93 -0.02 0.00 -1.07 0.00 0.00 68.15 68.73 2gi4 h THR 111 CO 0.05 0.00 -0.76 0.44 -0.01 0.00 0.00 175.52 175.24 2gi4 h ASP 112 N 0.00 0.00 -2.09 0.00 5.19 -1.92 -3.38 116.42 114.22 2gi4 h ASP 112 Ca 0.02 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.89 2gi4 h ASP 112 Cb 0.17 0.00 -0.41 0.00 0.18 0.00 0.00 39.33 39.28 2gi4 h ASP 112 CO -0.00 0.65 -0.98 0.49 -3.12 0.00 0.00 179.24 176.28 2gi4 n PHE 113 N -3.21 1.44 -3.28 4.55 3.72 0.18 -5.03 117.46 115.83 2gi4 n PHE 113 Ca -0.00 -3.85 0.03 0.00 -0.05 0.00 0.00 57.45 53.57 2gi4 n PHE 113 Cb 0.81 -0.44 -0.02 0.00 -0.94 0.00 0.00 39.48 38.88 2gi4 n PHE 113 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2gi4 s SER 114 N -2.50 -0.90 0.00 4.37 1.04 -0.83 -4.88 113.70 110.00 2gi4 s SER 114 Ca 0.41 0.79 0.00 0.00 0.48 0.00 0.00 55.95 57.64 2gi4 s SER 114 Cb 0.28 1.85 0.00 0.00 0.10 0.00 0.00 66.02 68.25 2gi4 s SER 114 CO -0.09 -0.17 0.00 -2.65 0.98 0.00 0.00 173.24 171.31 2gi4 n PRO 115 N 5.34 0.00 -0.49 4.02 -0.02 -1.26 -4.43 135.00 138.15 2gi4 n PRO 115 Ca -0.06 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.46 2gi4 n PRO 115 Cb 0.52 -0.14 0.22 0.00 -0.02 0.00 0.00 33.50 34.09 2gi4 n PRO 115 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2gi4 n SER 116 N 0.00 3.60 -2.01 2.55 3.41 -1.26 -4.28 113.62 115.63 2gi4 n SER 116 Ca 0.00 -2.51 -0.22 0.00 -0.26 0.00 0.00 58.87 55.88 2gi4 n SER 116 Cb 0.00 -0.60 0.08 0.00 -0.26 0.00 0.00 64.21 63.43 2gi4 n SER 116 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2gi4 n LEU 117 N 0.35 6.53 -4.70 1.04 7.94 -1.26 -4.96 117.00 121.93 2gi4 n LEU 117 Ca 0.15 -3.47 -0.42 0.00 -1.11 0.00 0.00 56.01 51.16 2gi4 n LEU 117 Cb 0.77 -0.92 -0.03 0.00 0.53 0.00 0.00 43.42 43.77 2gi4 n LEU 117 CO 0.18 1.17 0.91 0.21 -1.11 0.00 0.00 177.39 178.75 2gi4 s ASN 118 N -0.70 7.06 0.27 1.96 3.04 -1.26 -5.00 114.94 120.32 2gi4 s ASN 118 Ca 0.44 1.97 0.01 0.00 0.04 0.00 0.00 52.86 55.32 2gi4 s ASN 118 Cb 0.36 -2.57 -0.00 0.00 -1.54 0.00 0.00 41.25 37.49 2gi4 s ASN 118 CO 0.02 -0.51 0.33 0.00 -3.04 0.00 0.00 177.10 173.91 2gi4 n TYR 119 N 4.34 -1.04 0.00 0.43 4.11 -1.26 -5.12 117.16 118.62 2gi4 n TYR 119 Ca 0.10 -2.00 0.00 0.00 -0.00 0.00 0.00 57.90 56.00 2gi4 n TYR 119 Cb 0.46 0.37 0.00 0.00 -0.00 0.00 0.00 39.34 40.17 2gi4 n TYR 119 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.86 176.61 2gi4 n ASP 120 N -1.81 0.00 -3.41 9.48 8.00 -1.26 -4.91 116.55 122.65 2gi4 n ASP 120 Ca 0.02 0.10 -0.18 0.00 0.71 0.00 0.00 54.79 55.44 2gi4 n ASP 120 Cb 0.47 -0.24 -0.10 0.00 -0.02 0.00 0.00 41.12 41.23 2gi4 n ASP 120 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2gi4 s GLU 121 N -0.48 0.31 0.30 -1.24 8.01 -1.26 -2.49 118.70 121.85 2gi4 s GLU 121 Ca 0.00 -0.15 0.00 0.00 0.01 0.00 0.00 54.97 54.83 2gi4 s GLU 121 Cb 0.00 -0.70 0.00 0.00 -4.31 0.00 0.00 34.13 29.12 2gi4 s GLU 121 CO 0.00 -1.02 0.00 0.28 0.01 0.00 0.00 175.26 174.53 2gi4 n VAL 122 N 5.31 -3.37 0.00 2.63 0.31 -1.26 -4.89 118.33 117.06 2gi4 n VAL 122 Ca -0.02 1.34 0.00 0.00 -0.01 0.00 0.00 64.34 65.65 2gi4 n VAL 122 Cb 0.46 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 2gi4 n VAL 122 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2gi4 n PRO 123 N -1.01 0.37 -1.06 5.55 -0.04 -1.26 -4.52 135.00 133.03 2gi4 n PRO 123 Ca 0.00 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.51 2gi4 n PRO 123 Cb 0.02 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.45 2gi4 n PRO 123 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2gi4 n ASP 124 N 0.00 -5.71 0.21 3.54 -0.08 -1.25 -3.81 116.55 109.45 2gi4 n ASP 124 Ca 0.00 1.19 0.06 0.00 -1.51 0.00 0.00 54.79 54.53 2gi4 n ASP 124 Cb 0.00 -3.35 0.47 0.00 2.34 0.00 0.00 41.12 40.59 2gi4 n ASP 124 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2gi4 h PRO 125 N -0.38 0.00 0.00 -0.67 0.13 -0.89 0.13 132.00 130.32 2gi4 h PRO 125 Ca -0.06 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2gi4 h PRO 125 Cb 0.81 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.93 2gi4 h PRO 125 CO 0.02 0.28 -0.02 2.35 -0.23 0.00 0.00 178.00 180.40 2gi4 h TRP 126 N 0.00 0.00 0.00 1.56 -0.00 -1.86 -1.87 115.95 113.78 2gi4 h TRP 126 Ca -0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 58.89 58.73 2gi4 h TRP 126 Cb 0.59 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.72 2gi4 h TRP 126 CO 0.00 0.02 -1.54 0.66 -0.00 0.00 0.00 178.44 177.58 2gi4 n TYR 127 N -3.19 0.00 -0.09 2.65 4.01 -1.00 -4.89 117.16 114.65 2gi4 n TYR 127 Ca -0.01 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.62 2gi4 n TYR 127 Cb 0.18 -0.35 -0.04 0.00 -0.31 0.00 0.00 39.34 38.82 2gi4 n TYR 127 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2gi4 n SER 128 N -3.32 1.86 0.00 7.72 7.64 0.42 -4.86 113.62 123.08 2gi4 n SER 128 Ca -0.19 0.51 0.00 0.00 1.01 0.00 0.00 58.87 60.21 2gi4 n SER 128 Cb 0.64 -0.86 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 2gi4 n SER 128 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gi4 n GLY 129 N 1.52 0.41 3.15 0.23 0.00 -0.70 -4.95 105.19 104.86 2gi4 n GLY 129 Ca -0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 2gi4 n GLY 129 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2gi4 s ASN 130 N 0.00 1.25 0.02 1.61 2.47 -1.26 -4.65 114.94 114.38 2gi4 s ASN 130 Ca 0.00 -0.83 -0.09 0.00 0.42 0.00 0.00 52.86 52.36 2gi4 s ASN 130 Cb 0.00 0.04 -0.31 0.00 -1.45 0.00 0.00 41.25 39.53 2gi4 s ASN 130 CO 0.00 -0.32 0.94 -0.26 -3.72 0.00 0.00 177.10 173.74 2gi4 h PHE 131 N 3.53 0.69 -0.08 0.43 0.04 -1.90 0.19 116.94 119.83 2gi4 h PHE 131 Ca -0.36 -0.50 0.02 0.00 2.80 0.00 0.00 57.97 59.93 2gi4 h PHE 131 Cb 1.18 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 39.30 2gi4 h PHE 131 CO 0.62 1.47 0.24 0.22 -0.60 0.00 0.00 178.31 180.26 2gi4 h ASP 132 N 0.10 0.00 -0.68 2.17 3.58 -1.97 -1.67 116.42 117.95 2gi4 h ASP 132 Ca -0.24 0.00 0.07 0.00 0.42 0.00 0.00 57.03 57.28 2gi4 h ASP 132 Cb 2.07 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 43.06 2gi4 h ASP 132 CO 0.21 0.00 0.35 -0.33 -2.88 0.00 0.00 179.24 176.60 2gi4 h GLU 133 N 0.00 0.61 -1.09 0.28 4.39 -1.93 -0.31 114.58 116.54 2gi4 h GLU 133 Ca 0.04 -0.04 0.30 0.00 0.34 0.00 0.00 59.36 60.00 2gi4 h GLU 133 Cb 0.51 -0.14 -0.09 0.00 -0.10 0.00 0.00 28.75 28.93 2gi4 h GLU 133 CO -0.00 0.41 0.72 1.79 -1.16 0.00 0.00 179.01 180.76 2gi4 h THR 134 N 0.63 0.47 0.23 1.13 1.35 -1.53 0.23 112.91 115.42 2gi4 h THR 134 Ca 0.32 -0.10 -0.01 0.00 -0.55 0.00 0.00 66.41 66.07 2gi4 h THR 134 Cb 0.26 0.15 0.00 0.00 -1.73 0.00 0.00 68.15 66.84 2gi4 h THR 134 CO -0.22 0.05 -0.11 0.22 -0.25 0.00 0.00 175.52 175.21 2gi4 h TYR 135 N 0.29 -0.29 -0.13 4.73 3.20 -1.24 -1.94 116.97 121.59 2gi4 h TYR 135 Ca 0.61 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.51 2gi4 h TYR 135 Cb 1.74 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 40.06 2gi4 h TYR 135 CO -0.00 -0.07 -0.15 -0.22 -1.64 0.00 0.00 178.16 176.07 2gi4 h LYS 136 N -1.05 -0.18 0.17 1.82 1.63 -0.89 0.34 116.57 118.40 2gi4 h LYS 136 Ca -0.03 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 2gi4 h LYS 136 Cb 0.34 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.01 2gi4 h LYS 136 CO 0.05 -0.12 -0.08 0.82 -3.45 0.00 0.00 179.45 176.67 2gi4 h ILE 137 N -0.19 0.94 0.08 2.00 1.08 -0.73 -2.31 117.51 118.37 2gi4 h ILE 137 Ca 0.09 -0.53 -0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2gi4 h ILE 137 Cb 0.33 1.26 0.00 0.00 -3.07 0.00 0.00 36.82 35.34 2gi4 h ILE 137 CO -0.24 0.12 -0.04 0.25 -0.69 0.00 0.00 178.15 177.56 2gi4 h LEU 138 N -0.48 -0.09 0.03 1.44 5.85 -1.27 -0.25 115.31 120.54 2gi4 h LEU 138 Ca -0.02 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.49 2gi4 h LEU 138 Cb 0.37 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 2gi4 h LEU 138 CO 0.04 0.19 -0.31 -1.28 -0.34 0.00 0.00 178.44 176.73 2gi4 h SER 139 N -0.37 -0.92 0.53 1.25 0.87 -0.41 0.40 113.55 114.90 2gi4 h SER 139 Ca -0.01 0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.64 2gi4 h SER 139 Cb 0.32 0.36 0.01 0.00 -0.44 0.00 0.00 62.40 62.64 2gi4 h SER 139 CO 0.02 -0.38 -0.26 0.25 -0.53 0.00 0.00 176.83 175.93 2gi4 h LEU 140 N -0.48 -0.60 -0.63 2.23 5.85 -1.46 -2.21 115.31 118.00 2gi4 h LEU 140 Ca 0.05 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.85 2gi4 h LEU 140 Cb 0.55 0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.68 2gi4 h LEU 140 CO -0.24 -0.40 0.30 0.00 -0.34 0.00 0.00 178.44 177.76 2gi4 h ALA 141 N -0.31 0.84 -0.59 1.25 0.00 -0.91 -1.28 119.26 118.26 2gi4 h ALA 141 Ca -0.07 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.90 2gi4 h ALA 141 Cb 0.57 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2gi4 h ALA 141 CO 0.12 -0.08 0.39 0.00 0.00 0.00 0.00 179.25 179.68 2gi4 h LYS 143 N 0.74 -0.55 -1.00 0.00 3.64 -0.60 0.89 116.57 119.68 2gi4 h LYS 143 Ca 0.23 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.74 2gi4 h LYS 143 Cb -0.00 0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 31.86 2gi4 h LYS 143 CO -0.06 -0.36 0.64 -2.95 -2.27 0.00 0.00 179.45 174.45 2gi4 h ASN 144 N -0.77 0.96 -0.06 4.20 7.08 -1.37 -1.81 115.58 123.82 2gi4 h ASN 144 Ca -0.06 0.03 -0.00 0.00 -3.08 0.00 0.00 56.30 53.19 2gi4 h ASN 144 Cb 0.44 -0.17 -0.00 0.00 -2.08 0.00 0.00 38.32 36.51 2gi4 h ASN 144 CO 0.10 0.55 0.03 -0.07 -2.08 0.00 0.00 177.43 175.95 2gi4 h LEU 145 N 1.06 0.07 -1.00 6.14 -0.00 -0.78 -2.37 115.31 118.43 2gi4 h LEU 145 Ca 0.47 -0.13 0.20 0.00 -0.00 0.00 0.00 57.88 58.42 2gi4 h LEU 145 Cb 0.37 -0.02 -0.11 0.00 -0.00 0.00 0.00 40.66 40.90 2gi4 h LEU 145 CO -0.23 0.19 0.60 0.25 -0.00 0.00 0.00 178.44 179.25 2gi4 h LEU 146 N -0.05 0.74 0.13 1.67 5.85 0.03 0.30 115.31 123.98 2gi4 h LEU 146 Ca 0.02 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2gi4 h LEU 146 Cb 0.14 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2gi4 h LEU 146 CO -0.00 0.22 -0.06 0.58 -0.34 0.00 0.00 178.44 178.84 2gi4 h VAL 147 N 0.71 1.00 0.33 1.05 2.07 -1.12 -1.84 116.25 118.45 2gi4 h VAL 147 Ca 0.60 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 2gi4 h VAL 147 Cb 0.99 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2gi4 h VAL 147 CO -0.41 0.13 -0.16 0.15 0.02 0.00 0.00 177.57 177.30 2gi4 h PHE 148 N -0.43 -0.41 -0.76 1.57 3.57 -0.75 -0.03 116.94 119.69 2gi4 h PHE 148 Ca -0.02 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.58 2gi4 h PHE 148 Cb 0.35 0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.17 2gi4 h PHE 148 CO 0.01 -0.12 0.50 -0.07 -2.23 0.00 0.00 178.31 176.40 2gi4 h LEU 149 N -0.68 0.58 -0.20 0.59 3.38 -0.55 0.15 115.31 118.57 2gi4 h LEU 149 Ca -0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2gi4 h LEU 149 Cb 0.48 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2gi4 h LEU 149 CO 0.07 0.34 -0.26 -0.24 0.09 0.00 0.00 178.44 178.44 2gi4 n SER 150 N -4.50 0.58 -2.90 -0.43 2.88 -0.69 -5.00 113.62 103.56 2gi4 n SER 150 Ca 0.13 -0.43 -0.09 0.00 -1.33 0.00 0.00 58.87 57.16 2gi4 n SER 150 Cb 0.36 0.04 0.01 0.00 -0.75 0.00 0.00 64.21 63.87 2gi4 n SER 150 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2gi4 n LYS 151 N -1.11 -2.56 0.22 -1.46 4.81 0.53 -4.96 118.16 113.63 2gi4 n LYS 151 Ca 0.10 2.18 -0.09 0.00 -0.87 0.00 0.00 58.31 59.63 2gi4 n LYS 151 Cb 0.32 -5.00 -0.04 0.00 0.02 0.00 0.00 35.03 30.34 2gi4 n LYS 151 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 2gi4 h HIS 152 N 2.39 -0.54 0.00 5.64 -0.00 -1.63 -3.45 115.15 117.56 2gi4 h HIS 152 Ca -0.06 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.30 2gi4 h HIS 152 Cb 0.76 0.18 0.00 0.00 -0.00 0.00 0.00 27.41 28.35 2gi4 h HIS 152 CO 0.06 -0.33 0.00 1.58 -0.00 0.00 0.00 177.93 179.24 2gi4 n HIS 153 N -3.83 0.00 -1.39 5.26 -0.00 -1.26 -4.91 115.22 109.09 2gi4 n HIS 153 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.65 2gi4 n HIS 153 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.22 2gi4 n HIS 153 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2gi4 n HIS 154 N 0.00 -3.77 -1.50 1.57 -0.00 -1.26 -5.02 115.22 105.24 2gi4 n HIS 154 Ca 0.00 2.00 0.00 0.00 0.46 0.00 0.00 57.72 60.18 2gi4 n HIS 154 Cb 0.00 -3.17 0.00 0.00 -0.12 0.00 0.00 29.99 26.70 2gi4 n HIS 154 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2gi4 n HIS 155 N -0.59 -3.90 -0.04 1.57 8.25 -1.26 -5.32 115.22 113.93 2gi4 n HIS 155 Ca 0.00 2.03 0.00 0.00 -0.26 0.00 0.00 57.72 59.49 2gi4 n HIS 155 Cb 0.00 -3.27 0.00 0.00 1.12 0.00 0.00 29.99 27.84 2gi4 n HIS 155 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59