#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gir s MET 2 N 0.00 4.31 0.29 -0.41 1.00 -1.26 -1.25 119.30 121.98 2gir s MET 2 Ca 0.00 1.44 0.01 0.00 0.00 0.00 0.00 55.69 57.14 2gir s MET 2 Cb 0.00 -2.62 0.43 0.00 0.00 0.00 0.00 34.83 32.64 2gir s MET 2 CO 0.00 0.01 1.80 0.66 0.00 0.00 0.00 175.02 177.48 2gir h SER 3 N 2.71 0.65 -5.06 3.03 4.64 -1.32 -3.41 113.55 114.78 2gir h SER 3 Ca -0.48 -0.15 -0.11 0.00 -0.47 0.00 0.00 61.79 60.58 2gir h SER 3 Cb 1.21 -0.17 -0.18 0.00 -0.31 0.00 0.00 62.40 62.95 2gir h SER 3 CO 0.63 0.73 -0.36 -0.31 -0.87 0.00 0.00 176.83 176.65 2gir s TYR 4 N -4.94 0.01 0.06 4.77 2.02 -1.26 -0.76 117.35 117.25 2gir s TYR 4 Ca -0.09 -0.19 0.08 0.00 -0.37 0.00 0.00 57.07 56.50 2gir s TYR 4 Cb 0.15 0.00 -0.03 0.00 -0.40 0.00 0.00 41.96 41.68 2gir s TYR 4 CO 0.79 -0.44 -0.21 0.95 -1.57 0.00 0.00 175.55 175.07 2gir s THR 5 N -2.44 1.74 0.11 -0.71 -4.23 -0.26 -4.87 115.64 104.99 2gir s THR 5 Ca -0.06 -1.33 0.09 0.00 -1.18 0.00 0.00 61.69 59.21 2gir s THR 5 Cb -0.02 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.25 2gir s THR 5 CO -0.03 0.15 -0.22 0.26 -0.54 0.00 0.00 174.62 174.24 2gir s TRP 6 N -0.90 1.88 -0.24 3.99 0.52 -1.26 -0.56 118.94 122.37 2gir s TRP 6 Ca 0.08 -0.42 0.22 0.00 0.02 0.00 0.00 56.10 56.01 2gir s TRP 6 Cb -0.09 -1.02 -0.15 0.00 -1.15 0.00 0.00 33.47 31.06 2gir s TRP 6 CO 0.03 0.24 0.78 0.25 0.02 0.00 0.00 176.95 178.27 2gir n THR 7 N 0.98 0.24 0.00 2.01 -2.24 -0.29 -4.91 114.28 110.07 2gir n THR 7 Ca -0.19 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 2gir n THR 7 Cb 0.54 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 2gir n THR 7 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gir n GLY 8 N 1.26 2.94 3.75 3.38 0.00 -1.26 -5.07 105.19 110.20 2gir n GLY 8 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 2gir n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gir s ALA 9 N -2.71 2.78 0.53 4.61 0.00 -1.26 -4.98 121.76 120.73 2gir s ALA 9 Ca 0.00 1.23 -0.16 0.00 0.00 0.00 0.00 51.96 53.02 2gir s ALA 9 Cb 0.00 -3.52 -0.07 0.00 0.00 0.00 0.00 23.12 19.52 2gir s ALA 9 CO 0.00 -1.26 1.00 -0.51 0.00 0.00 0.00 175.76 174.99 2gir s LEU 10 N -3.57 3.59 -0.37 0.00 1.43 -1.26 -4.86 118.68 113.64 2gir s LEU 10 Ca 0.72 1.60 -0.26 0.00 -1.03 0.00 0.00 54.13 55.16 2gir s LEU 10 Cb -0.37 -4.51 0.01 0.00 0.03 0.00 0.00 46.19 41.35 2gir s LEU 10 CO 0.43 -0.68 0.92 -0.63 0.23 0.00 0.00 176.35 176.62 2gir s ILE 11 N -2.62 4.60 0.12 -0.59 1.01 -1.26 -4.78 121.20 117.67 2gir s ILE 11 Ca 0.59 1.18 0.03 0.00 0.00 0.00 0.00 60.65 62.46 2gir s ILE 11 Cb -0.11 -4.32 -0.04 0.00 0.01 0.00 0.00 42.46 38.00 2gir s ILE 11 CO 0.33 -0.52 0.13 0.42 0.00 0.00 0.00 174.94 175.30 2gir s THR 12 N 3.44 4.68 0.68 2.92 -4.23 -1.26 -4.85 115.64 117.02 2gir s THR 12 Ca 0.38 -0.84 -0.09 0.00 -1.18 0.00 0.00 61.69 59.96 2gir s THR 12 Cb -0.12 -3.32 0.03 0.00 1.34 0.00 0.00 72.50 70.43 2gir s THR 12 CO 0.18 0.02 1.03 -2.16 -0.54 0.00 0.00 174.62 173.15 2gir s PRO 13 N -2.75 2.66 -0.10 3.99 0.04 -1.26 -4.33 135.00 133.25 2gir s PRO 13 Ca 0.31 0.14 0.09 0.00 0.04 0.00 0.00 61.00 61.58 2gir s PRO 13 Cb -0.11 -2.12 -0.24 0.00 0.04 0.00 0.00 34.50 32.07 2gir s PRO 13 CO 0.24 -1.03 0.43 0.00 0.04 0.00 0.00 177.00 176.69 2gir s ALA 15 N -2.57 2.33 0.19 0.00 0.00 -1.26 -5.11 121.76 115.36 2gir s ALA 15 Ca -0.11 -1.64 -0.32 0.00 0.00 0.00 0.00 51.96 49.89 2gir s ALA 15 Cb 0.07 0.94 -0.12 0.00 0.00 0.00 0.00 23.12 24.02 2gir s ALA 15 CO 0.80 -0.42 1.73 0.00 0.00 0.00 0.00 175.76 177.87 2gir s ALA 16 N -3.43 3.91 0.03 0.00 0.00 -1.26 -4.99 121.76 116.03 2gir s ALA 16 Ca 0.32 1.56 0.01 0.00 0.00 0.00 0.00 51.96 53.85 2gir s ALA 16 Cb 0.05 -3.70 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 2gir s ALA 16 CO 0.16 -0.96 0.07 -1.21 0.00 0.00 0.00 175.76 173.82 2gir s GLU 17 N 1.40 2.97 -0.04 0.00 2.02 -1.26 -5.12 118.70 118.67 2gir s GLU 17 Ca 0.76 -0.58 0.06 0.00 0.02 0.00 0.00 54.97 55.22 2gir s GLU 17 Cb -0.49 -2.79 -0.02 0.00 0.10 0.00 0.00 34.13 30.93 2gir s GLU 17 CO 0.33 0.61 -0.20 -1.21 0.02 0.00 0.00 175.26 174.80 2gir s GLU 18 N -2.00 2.33 -0.11 1.61 2.02 -1.26 -5.04 118.70 116.26 2gir s GLU 18 Ca 0.25 -0.81 0.08 0.00 0.02 0.00 0.00 54.97 54.51 2gir s GLU 18 Cb -0.12 -2.21 -0.12 0.00 0.10 0.00 0.00 34.13 31.77 2gir s GLU 18 CO 0.17 0.58 0.02 -1.13 0.02 0.00 0.00 175.26 174.91 2gir n SER 19 N 2.41 2.47 -4.80 -0.19 3.41 -1.26 -4.57 113.62 111.09 2gir n SER 19 Ca -0.17 -0.01 -0.37 0.00 -0.26 0.00 0.00 58.87 58.06 2gir n SER 19 Cb 0.52 0.63 -0.06 0.00 -0.26 0.00 0.00 64.21 65.04 2gir n SER 19 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2gir s LYS 20 N -2.26 4.37 -0.00 4.33 1.02 -1.26 -0.80 119.74 125.14 2gir s LYS 20 Ca -0.07 0.98 -0.30 0.00 0.02 0.00 0.00 55.97 56.60 2gir s LYS 20 Cb 0.03 -2.99 -0.09 0.00 -0.52 0.00 0.00 37.83 34.26 2gir s LYS 20 CO 0.42 0.44 2.00 -0.11 -0.92 0.00 0.00 175.35 177.18 2gir n LEU 21 N 0.99 4.01 -4.77 3.17 7.94 -1.25 -4.88 117.00 122.21 2gir n LEU 21 Ca -0.03 0.83 -0.38 0.00 -1.11 0.00 0.00 56.01 55.32 2gir n LEU 21 Cb 0.50 -1.52 -0.01 0.00 0.53 0.00 0.00 43.42 42.93 2gir n LEU 21 CO 0.44 0.09 0.89 -2.84 -1.11 0.00 0.00 177.39 174.85 2gir s PRO 22 N 4.65 3.85 -0.10 1.96 0.02 -1.26 -5.02 135.00 139.09 2gir s PRO 22 Ca 0.91 1.95 0.03 0.00 0.02 0.00 0.00 61.00 63.91 2gir s PRO 22 Cb -0.45 -2.58 -0.01 0.00 0.02 0.00 0.00 34.50 31.49 2gir s PRO 22 CO 0.42 -0.53 -0.19 0.42 -0.33 0.00 0.00 177.00 176.80 2gir s ILE 23 N -1.39 2.56 0.00 2.83 -1.09 -1.26 -4.73 121.20 118.12 2gir s ILE 23 Ca 0.60 -0.85 0.00 0.00 -2.23 0.00 0.00 60.65 58.17 2gir s ILE 23 Cb -0.33 -2.02 0.00 0.00 -1.58 0.00 0.00 42.46 38.53 2gir s ILE 23 CO 0.41 0.55 0.00 -0.46 -1.23 0.00 0.00 174.94 174.21 2gir n ASN 24 N 3.34 1.29 0.28 3.58 6.94 -1.26 -5.01 115.26 124.41 2gir n ASN 24 Ca -0.18 -0.78 0.19 0.00 -0.02 0.00 0.00 54.58 53.78 2gir n ASN 24 Cb 0.53 0.00 0.89 0.00 -2.36 0.00 0.00 39.78 38.84 2gir n ASN 24 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2gir h ALA 25 N 1.00 1.00 0.00 -2.53 0.00 -2.00 -2.84 119.26 113.89 2gir h ALA 25 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2gir h ALA 25 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2gir h ALA 25 CO 0.00 0.00 -1.56 1.28 0.00 0.00 0.00 179.25 178.97 2gir n LEU 26 N -2.92 0.37 -0.13 0.00 4.77 -1.26 -4.61 117.00 113.22 2gir n LEU 26 Ca -0.01 -0.06 -0.05 0.00 -0.03 0.00 0.00 56.01 55.86 2gir n LEU 26 Cb 0.17 -0.02 0.03 0.00 -2.33 0.00 0.00 43.42 41.27 2gir n LEU 26 CO 0.22 0.03 0.94 0.28 -1.33 0.00 0.00 177.39 177.53 2gir h SER 27 N 0.00 0.13 0.91 -1.43 0.02 -1.85 -1.99 113.55 109.34 2gir h SER 27 Ca 0.00 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2gir h SER 27 Cb 0.86 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.45 2gir h SER 27 CO 0.00 0.11 -0.00 0.78 -1.14 0.00 0.00 176.83 176.57 2gir h ASN 28 N 0.29 0.00 0.74 3.07 2.35 -1.79 -1.12 115.58 119.13 2gir h ASN 28 Ca 0.19 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.91 2gir h ASN 28 Cb 0.19 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 2gir h ASN 28 CO -0.21 0.00 -0.15 0.77 -1.65 0.00 0.00 177.43 176.19 2gir h SER 29 N 0.00 0.00 0.03 5.81 4.64 -1.65 -3.28 113.55 119.10 2gir h SER 29 Ca -0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 2gir h SER 29 Cb 0.46 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.50 2gir h SER 29 CO 0.00 0.15 -1.92 -0.11 -0.87 0.00 0.00 176.83 174.08 2gir n LEU 30 N -3.40 2.26 -3.68 5.97 7.94 -0.47 -4.66 117.00 120.96 2gir n LEU 30 Ca -0.00 0.26 -0.11 0.00 -1.11 0.00 0.00 56.01 55.05 2gir n LEU 30 Cb 0.34 -0.97 -0.09 0.00 0.53 0.00 0.00 43.42 43.23 2gir n LEU 30 CO 0.31 0.60 0.18 -0.22 -1.11 0.00 0.00 177.39 177.14 2gir s LEU 31 N -7.37 -0.25 -0.19 -1.96 0.20 -0.92 -4.18 118.68 104.02 2gir s LEU 31 Ca -0.30 1.09 0.16 0.00 0.69 0.00 0.00 54.13 55.77 2gir s LEU 31 Cb 0.09 1.75 -0.24 0.00 -0.43 0.00 0.00 46.19 47.35 2gir s LEU 31 CO 0.62 -0.20 0.12 0.54 -0.29 0.00 0.00 176.35 177.14 2gir n ARG 32 N 3.71 0.68 -2.42 1.98 1.74 -0.20 -4.10 116.66 118.04 2gir n ARG 32 Ca -0.19 0.04 -0.43 0.00 -0.77 0.00 0.00 57.85 56.50 2gir n ARG 32 Cb 0.56 -1.55 0.00 0.00 -1.02 0.00 0.00 32.46 30.45 2gir n ARG 32 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2gir n HIS 33 N -2.83 3.64 0.07 -1.55 8.25 -0.70 -4.78 115.22 117.32 2gir n HIS 33 Ca -0.32 -2.96 0.03 0.00 -0.26 0.00 0.00 57.72 54.21 2gir n HIS 33 Cb 1.13 -2.14 0.39 0.00 1.12 0.00 0.00 29.99 30.50 2gir n HIS 33 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2gir h HIS 34 N 6.25 0.37 0.00 4.41 3.86 -1.85 -2.26 115.15 125.93 2gir h HIS 34 Ca 0.40 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.59 2gir h HIS 34 Cb 0.71 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 29.06 2gir h HIS 34 CO 1.26 0.37 0.00 0.09 0.86 0.00 0.00 177.93 180.51 2gir n ASN 35 N -4.35 0.46 0.24 2.45 3.02 -1.26 -1.72 115.26 114.10 2gir n ASN 35 Ca 0.01 0.64 0.15 0.00 -0.03 0.00 0.00 54.58 55.35 2gir n ASN 35 Cb 0.19 -0.73 0.47 0.00 -0.61 0.00 0.00 39.78 39.10 2gir n ASN 35 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 2gir h MET 36 N 0.00 0.00 -5.66 3.52 2.86 -1.81 -3.46 114.93 110.38 2gir h MET 36 Ca 0.00 0.00 -0.66 0.00 -2.06 0.00 0.00 59.70 56.98 2gir h MET 36 Cb 0.22 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 31.76 2gir h MET 36 CO 0.00 0.00 -0.56 0.08 1.06 0.00 0.00 176.91 177.49 2gir s VAL 37 N -3.45 4.86 0.08 -2.22 1.01 -0.70 0.01 120.40 119.98 2gir s VAL 37 Ca 0.04 -0.03 -0.10 0.00 0.00 0.00 0.00 61.98 61.89 2gir s VAL 37 Cb 0.08 -3.11 0.01 0.00 0.00 0.00 0.00 36.38 33.35 2gir s VAL 37 CO 0.59 0.57 0.22 -0.72 0.00 0.00 0.00 175.10 175.76 2gir s TYR 38 N -0.58 0.07 -0.07 5.22 1.13 -0.65 -3.88 117.35 118.59 2gir s TYR 38 Ca 0.11 -0.42 0.00 0.00 -1.41 0.00 0.00 57.07 55.35 2gir s TYR 38 Cb -0.12 -0.01 -0.03 0.00 -1.10 0.00 0.00 41.96 40.70 2gir s TYR 38 CO 0.02 -0.53 -0.05 0.00 -2.51 0.00 0.00 175.55 172.48 2gir s ALA 39 N -3.45 3.06 0.48 9.51 0.00 0.02 -0.93 121.76 130.45 2gir s ALA 39 Ca 0.02 -0.87 -0.22 0.00 0.00 0.00 0.00 51.96 50.89 2gir s ALA 39 Cb 0.03 -1.30 -0.07 0.00 0.00 0.00 0.00 23.12 21.78 2gir s ALA 39 CO -0.09 0.57 1.14 0.95 0.00 0.00 0.00 175.76 178.32 2gir s THR 40 N -0.79 3.22 0.24 0.00 -4.23 0.42 -4.46 115.64 110.03 2gir s THR 40 Ca 0.12 0.85 0.01 0.00 -1.18 0.00 0.00 61.69 61.49 2gir s THR 40 Cb -0.11 -3.40 -0.04 0.00 1.34 0.00 0.00 72.50 70.28 2gir s THR 40 CO 0.02 -0.07 0.13 0.42 -0.54 0.00 0.00 174.62 174.57 2gir s THR 41 N -1.65 0.24 0.48 3.99 -4.23 -1.26 -3.96 115.64 109.25 2gir s THR 41 Ca 0.66 -2.00 0.38 0.00 -1.18 0.00 0.00 61.69 59.55 2gir s THR 41 Cb -0.26 -2.55 0.38 0.00 1.34 0.00 0.00 72.50 71.41 2gir s THR 41 CO 0.31 0.00 2.16 0.77 -0.54 0.00 0.00 174.62 177.31 2gir h SER 42 N 2.47 0.00 -0.66 3.99 4.64 -1.86 -2.53 113.55 119.59 2gir h SER 42 Ca -0.36 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.06 2gir h SER 42 Cb 1.25 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.30 2gir h SER 42 CO 0.55 0.00 0.44 -0.09 -0.87 0.00 0.00 176.83 176.86 2gir h ARG 43 N 0.00 0.47 -0.19 4.77 2.43 -1.96 -1.69 114.38 118.21 2gir h ARG 43 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2gir h ARG 43 Cb 0.10 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 2gir h ARG 43 CO 0.00 0.31 0.00 -1.13 -1.51 0.00 0.00 179.97 177.64 2gir n SER 44 N -4.48 2.59 0.18 -3.80 3.41 -0.95 -4.41 113.62 106.16 2gir n SER 44 Ca 0.11 -1.85 0.12 0.00 -0.26 0.00 0.00 58.87 56.99 2gir n SER 44 Cb 0.38 -0.12 0.66 0.00 -0.26 0.00 0.00 64.21 64.88 2gir n SER 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gir h ALA 45 N 4.41 2.14 -0.62 7.33 0.00 -1.42 -1.29 119.26 129.81 2gir h ALA 45 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2gir h ALA 45 Cb 0.78 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2gir h ALA 45 CO 0.00 -0.20 0.29 0.78 0.00 0.00 0.00 179.25 180.12 2gir h GLY 46 N 0.00 0.94 0.82 0.00 0.00 -1.77 -0.53 103.07 102.53 2gir h GLY 46 Ca 0.08 -0.44 -0.06 0.00 0.00 0.00 0.00 47.33 46.90 2gir h GLY 46 CO -0.00 0.42 -0.11 -2.00 0.00 0.00 0.00 176.54 174.85 2gir h LEU 47 N 0.87 0.47 -0.64 3.11 6.46 -1.56 -2.84 115.31 121.18 2gir h LEU 47 Ca 0.22 -0.41 0.07 0.00 -0.12 0.00 0.00 57.88 57.63 2gir h LEU 47 Cb 0.10 -0.13 -0.06 0.00 -0.73 0.00 0.00 40.66 39.84 2gir h LEU 47 CO -0.03 0.78 0.32 -0.09 -0.62 0.00 0.00 178.44 178.80 2gir h ARG 48 N 0.15 0.57 -0.68 1.25 9.65 -1.31 -1.74 114.38 122.27 2gir h ARG 48 Ca 0.05 -0.03 0.12 0.00 -1.10 0.00 0.00 59.98 59.01 2gir h ARG 48 Cb 0.60 -0.13 -0.09 0.00 -1.39 0.00 0.00 29.97 28.97 2gir h ARG 48 CO 0.03 0.38 0.24 1.96 2.80 0.00 0.00 179.97 185.38 2gir h GLN 49 N 0.59 0.38 -0.66 0.20 4.20 -0.99 -0.11 115.11 118.72 2gir h GLN 49 Ca 0.30 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.97 2gir h GLN 49 Cb 0.25 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.91 2gir h GLN 49 CO -0.22 0.25 0.36 0.87 -0.67 0.00 0.00 178.83 179.43 2gir h LYS 50 N 0.39 0.91 -0.44 1.46 1.57 -1.14 -3.05 116.57 116.28 2gir h LYS 50 Ca 0.36 -0.11 -0.08 0.00 -1.87 0.00 0.00 60.65 58.96 2gir h LYS 50 Cb 0.52 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 2gir h LYS 50 CO -0.38 0.69 -0.05 -0.22 -0.57 0.00 0.00 179.45 178.92 2gir h LYS 51 N 0.90 0.75 -0.01 3.15 1.63 -0.23 -3.07 116.57 119.68 2gir h LYS 51 Ca 0.23 -0.22 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 2gir h LYS 51 Cb 0.04 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.59 2gir h LYS 51 CO -0.04 0.79 -0.01 1.33 -3.45 0.00 0.00 179.45 178.07 2gir n VAL 52 N -4.20 0.00 -3.71 2.00 0.24 -0.48 -4.79 118.33 107.39 2gir n VAL 52 Ca 0.02 -0.22 -0.38 0.00 -2.04 0.00 0.00 64.34 61.72 2gir n VAL 52 Cb 0.32 0.37 -0.12 0.00 -1.47 0.00 0.00 33.84 32.95 2gir n VAL 52 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2gir s THR 53 N -2.02 3.95 0.20 3.34 2.01 -1.16 -4.68 115.64 117.27 2gir s THR 53 Ca 0.39 -1.18 -0.23 0.00 0.31 0.00 0.00 61.69 60.98 2gir s THR 53 Cb 0.21 -3.28 0.05 0.00 0.01 0.00 0.00 72.50 69.49 2gir s THR 53 CO 0.35 -0.26 0.70 0.72 -0.69 0.00 0.00 174.62 175.43 2gir s PHE 54 N 1.42 -0.35 0.07 4.92 -0.12 -1.26 -4.96 117.98 117.70 2gir s PHE 54 Ca -0.00 0.03 -0.26 0.00 -0.05 0.00 0.00 56.93 56.66 2gir s PHE 54 Cb -0.20 0.63 -0.06 0.00 -0.63 0.00 0.00 43.02 42.76 2gir s PHE 54 CO 0.03 -0.99 0.79 0.34 -0.05 0.00 0.00 175.22 175.35 2gir s ASP 55 N -2.82 7.28 -0.18 1.98 2.15 -1.26 -0.93 116.67 122.89 2gir s ASP 55 Ca 0.06 1.52 -0.05 0.00 0.43 0.00 0.00 52.55 54.52 2gir s ASP 55 Cb -0.03 -2.49 -0.03 0.00 -0.30 0.00 0.00 42.92 40.07 2gir s ASP 55 CO -0.03 0.03 -0.01 -0.13 -0.17 0.00 0.00 175.17 174.86 2gir s ARG 56 N -0.21 3.66 0.04 4.34 3.00 -0.38 -4.97 118.95 124.43 2gir s ARG 56 Ca 0.39 -0.51 0.07 0.00 0.00 0.00 0.00 55.73 55.68 2gir s ARG 56 Cb -0.21 -3.02 -0.03 0.00 0.00 0.00 0.00 34.95 31.68 2gir s ARG 56 CO 0.24 0.11 -0.18 -0.51 0.00 0.00 0.00 175.30 174.97 2gir s LEU 57 N 0.72 2.61 -0.02 2.53 1.02 -1.26 -4.73 118.68 119.55 2gir s LEU 57 Ca -0.00 -0.43 0.00 0.00 0.02 0.00 0.00 54.13 53.72 2gir s LEU 57 Cb -0.14 -1.52 0.03 0.00 0.02 0.00 0.00 46.19 44.58 2gir s LEU 57 CO 0.02 0.25 0.02 -1.58 0.02 0.00 0.00 176.35 175.08 2gir s GLN 58 N -1.46 0.07 -0.20 1.70 0.74 -1.26 -4.02 119.66 115.23 2gir s GLN 58 Ca 0.15 0.14 0.00 0.00 0.05 0.00 0.00 55.36 55.71 2gir s GLN 58 Cb -0.10 -0.32 0.05 0.00 1.10 0.00 0.00 33.01 33.74 2gir s GLN 58 CO 0.05 -0.15 -0.08 0.08 -0.55 0.00 0.00 175.29 174.65 2gir s VAL 59 N 1.01 1.46 -0.21 1.34 1.01 -0.12 -5.03 120.40 119.86 2gir s VAL 59 Ca -0.09 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 60.89 2gir s VAL 59 Cb -0.13 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.62 2gir s VAL 59 CO -0.02 0.09 -0.02 -0.76 0.00 0.00 0.00 175.10 174.38 2gir s LEU 60 N 1.47 3.09 0.00 3.92 1.43 -1.26 -4.41 118.68 122.91 2gir s LEU 60 Ca -0.02 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 52.80 2gir s LEU 60 Cb -0.17 -1.79 0.01 0.00 0.03 0.00 0.00 46.19 44.28 2gir s LEU 60 CO -0.08 0.02 0.11 -0.90 0.23 0.00 0.00 176.35 175.73 2gir n ASP 61 N 4.56 1.49 0.05 2.29 5.75 -1.26 -4.97 116.55 124.45 2gir n ASP 61 Ca -0.18 -1.52 -0.04 0.00 -0.01 0.00 0.00 54.79 53.04 2gir n ASP 61 Cb 0.51 -0.01 0.18 0.00 -1.03 0.00 0.00 41.12 40.77 2gir n ASP 61 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2gir h ASP 62 N 0.18 0.39 -0.72 -1.12 3.32 -1.99 -2.15 116.42 114.34 2gir h ASP 62 Ca -0.10 -0.17 0.04 0.00 0.02 0.00 0.00 57.03 56.83 2gir h ASP 62 Cb 0.35 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.75 2gir h ASP 62 CO 0.15 0.75 0.44 0.45 -1.72 0.00 0.00 179.24 179.32 2gir h HIS 63 N 0.31 0.82 0.09 4.55 3.86 -1.96 0.16 115.15 122.98 2gir h HIS 63 Ca 0.03 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.26 2gir h HIS 63 Cb 0.85 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 29.05 2gir h HIS 63 CO 0.02 0.45 -0.04 -0.92 0.86 0.00 0.00 177.93 178.30 2gir h TYR 64 N 0.85 -0.11 -0.18 2.45 3.20 -1.75 -1.87 116.97 119.56 2gir h TYR 64 Ca 0.30 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 62.07 2gir h TYR 64 Cb 0.07 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 2gir h TYR 64 CO -0.05 -0.06 -0.31 0.00 -1.64 0.00 0.00 178.16 176.10 2gir h ARG 65 N -0.13 0.36 -0.26 1.82 3.08 -1.00 -1.55 114.38 116.71 2gir h ARG 65 Ca -0.01 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 2gir h ARG 65 Cb 0.10 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2gir h ARG 65 CO 0.02 0.64 0.11 -0.44 -1.07 0.00 0.00 179.97 179.23 2gir h ASP 66 N 0.32 0.36 -0.56 7.04 3.32 -0.57 -1.23 116.42 125.09 2gir h ASP 66 Ca 0.04 -0.16 -0.04 0.00 0.02 0.00 0.00 57.03 56.89 2gir h ASP 66 Cb 0.71 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 2gir h ASP 66 CO 0.05 0.42 0.18 0.58 -1.72 0.00 0.00 179.24 178.75 2gir h VAL 67 N 0.28 1.24 -0.74 -1.35 2.07 -1.23 -2.55 116.25 113.96 2gir h VAL 67 Ca 0.09 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 66.83 2gir h VAL 67 Cb 0.17 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 2gir h VAL 67 CO -0.01 0.30 0.49 0.25 0.02 0.00 0.00 177.57 178.61 2gir h LEU 68 N 0.78 0.83 -0.79 2.57 5.85 -1.09 -1.01 115.31 122.45 2gir h LEU 68 Ca 0.18 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.93 2gir h LEU 68 Cb 0.27 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 2gir h LEU 68 CO -0.01 0.60 0.49 0.50 -0.34 0.00 0.00 178.44 179.68 2gir h LYS 69 N 0.98 0.90 -0.52 1.25 3.64 -0.96 -0.30 116.57 121.57 2gir h LYS 69 Ca 0.28 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.54 2gir h LYS 69 Cb -0.09 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.51 2gir h LYS 69 CO -0.07 0.59 0.08 0.93 -2.27 0.00 0.00 179.45 178.71 2gir h GLU 70 N 0.92 0.86 -0.65 1.90 5.08 -1.05 -1.46 114.58 120.18 2gir h GLU 70 Ca 0.33 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2gir h GLU 70 Cb 0.10 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2gir h GLU 70 CO -0.14 0.85 0.39 0.52 -1.00 0.00 0.00 179.01 179.63 2gir h MET 71 N 0.74 0.89 -0.43 2.33 2.86 -0.63 -2.54 114.93 118.16 2gir h MET 71 Ca 0.16 -0.08 -0.08 0.00 -2.06 0.00 0.00 59.70 57.63 2gir h MET 71 Cb 0.41 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2gir h MET 71 CO 0.01 0.64 -0.07 0.87 1.06 0.00 0.00 176.91 179.42 2gir h LYS 72 N 0.89 0.74 -0.63 1.72 1.57 -0.85 -0.50 116.57 119.52 2gir h LYS 72 Ca 0.23 -0.22 0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2gir h LYS 72 Cb -0.02 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.18 2gir h LYS 72 CO -0.04 0.80 0.40 0.00 -0.57 0.00 0.00 179.45 180.04 2gir h ALA 73 N 1.24 0.80 -0.25 3.86 0.00 -0.98 -0.33 119.26 123.60 2gir h ALA 73 Ca 0.12 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 2gir h ALA 73 Cb 0.53 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2gir h ALA 73 CO 0.03 0.18 -0.17 0.87 0.00 0.00 0.00 179.25 180.16 2gir h LYS 74 N 0.80 0.56 -0.77 0.00 1.57 -1.18 -3.01 116.57 114.55 2gir h LYS 74 Ca 0.24 -0.26 0.13 0.00 -1.87 0.00 0.00 60.65 58.89 2gir h LYS 74 Cb -0.04 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.21 2gir h LYS 74 CO -0.08 0.84 0.51 0.00 -0.57 0.00 0.00 179.45 180.15 2gir h ALA 75 N 0.71 1.98 0.00 3.86 0.00 -0.76 -1.38 119.26 123.67 2gir h ALA 75 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2gir h ALA 75 Cb 0.69 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2gir h ALA 75 CO 0.05 -0.18 0.00 0.43 0.00 0.00 0.00 179.25 179.55 2gir n SER 76 N -4.50 0.36 0.04 0.00 7.64 -0.16 -1.45 113.62 115.55 2gir n SER 76 Ca 0.14 0.64 0.12 0.00 1.01 0.00 0.00 58.87 60.78 2gir n SER 76 Cb 0.46 -0.70 0.30 0.00 -1.01 0.00 0.00 64.21 63.27 2gir n SER 76 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2gir n THR 77 N -1.95 0.23 -2.94 0.44 -2.24 -0.52 -4.69 114.28 102.60 2gir n THR 77 Ca 0.00 -0.15 -0.40 0.00 -2.27 0.00 0.00 64.05 61.23 2gir n THR 77 Cb 0.08 -0.15 -0.05 0.00 -2.10 0.00 0.00 70.33 68.12 2gir n THR 77 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2gir s VAL 78 N -3.08 4.63 -0.13 2.28 1.01 -0.53 -4.96 120.40 119.61 2gir s VAL 78 Ca 0.10 1.71 0.02 0.00 0.00 0.00 0.00 61.98 63.81 2gir s VAL 78 Cb 0.15 -4.15 -0.00 0.00 0.00 0.00 0.00 36.38 32.38 2gir s VAL 78 CO 0.67 0.39 -0.19 -0.75 0.00 0.00 0.00 175.10 175.21 2gir s LYS 79 N -0.25 3.15 0.04 2.72 2.20 -1.26 -0.49 119.74 125.85 2gir s LYS 79 Ca 0.39 -0.80 0.07 0.00 -0.36 0.00 0.00 55.97 55.28 2gir s LYS 79 Cb -0.21 -2.50 -0.02 0.00 -1.51 0.00 0.00 37.83 33.59 2gir s LYS 79 CO 0.25 0.08 -0.21 0.00 -0.36 0.00 0.00 175.35 175.11 2gir s ALA 80 N 0.62 1.77 0.09 3.13 0.00 -0.68 -4.94 121.76 121.75 2gir s ALA 80 Ca -0.10 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.81 2gir s ALA 80 Cb -0.16 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.57 2gir s ALA 80 CO 0.03 0.40 0.24 -1.59 0.00 0.00 0.00 175.76 174.84 2gir s LYS 81 N -1.13 3.45 0.00 0.00 -2.85 -1.26 -4.49 119.74 113.46 2gir s LYS 81 Ca 0.08 -0.47 -0.30 0.00 -1.00 0.00 0.00 55.97 54.28 2gir s LYS 81 Cb -0.09 -3.01 -0.03 0.00 -2.06 0.00 0.00 37.83 32.64 2gir s LYS 81 CO 0.02 0.57 1.03 -1.17 0.10 0.00 0.00 175.35 175.90 2gir s LEU 82 N -2.75 4.36 0.38 2.77 2.96 -1.26 -4.47 118.68 120.67 2gir s LEU 82 Ca 0.35 1.72 -0.24 0.00 -0.22 0.00 0.00 54.13 55.74 2gir s LEU 82 Cb -0.12 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 42.89 2gir s LEU 82 CO 0.28 -0.32 0.96 -0.76 -1.32 0.00 0.00 176.35 175.19 2gir s LEU 83 N 1.12 4.15 0.86 -0.68 1.02 -0.59 -5.06 118.68 119.50 2gir s LEU 83 Ca 0.53 1.80 -0.11 0.00 0.02 0.00 0.00 54.13 56.37 2gir s LEU 83 Cb -0.22 -4.26 0.11 0.00 0.02 0.00 0.00 46.19 41.83 2gir s LEU 83 CO 0.27 -0.24 1.10 -0.94 0.02 0.00 0.00 176.35 176.56 2gir s SER 84 N -1.85 3.74 0.25 2.29 1.04 -1.26 -4.70 113.70 113.22 2gir s SER 84 Ca 0.56 1.71 -0.03 0.00 0.48 0.00 0.00 55.95 58.67 2gir s SER 84 Cb -0.15 -2.37 0.39 0.00 0.10 0.00 0.00 66.02 63.99 2gir s SER 84 CO 0.20 -2.50 1.85 0.58 0.98 0.00 0.00 173.24 174.34 2gir h VAL 85 N -1.45 1.01 -0.01 5.02 2.07 -1.97 -1.97 116.25 118.95 2gir h VAL 85 Ca -0.47 -0.34 -0.19 0.00 0.82 0.00 0.00 66.70 66.52 2gir h VAL 85 Cb 1.26 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2gir h VAL 85 CO 0.51 0.18 -0.83 1.05 0.02 0.00 0.00 177.57 178.50 2gir h GLU 86 N 1.00 0.18 -0.60 1.57 9.09 -1.98 0.64 114.58 124.47 2gir h GLU 86 Ca 0.41 -0.18 -0.01 0.00 0.05 0.00 0.00 59.36 59.63 2gir h GLU 86 Cb 0.25 0.05 -0.03 0.00 -1.65 0.00 0.00 28.75 27.37 2gir h GLU 86 CO -0.20 0.91 0.35 0.93 0.05 0.00 0.00 179.01 181.05 2gir h GLU 87 N 0.10 0.83 -0.45 1.06 5.08 -1.87 -2.18 114.58 117.16 2gir h GLU 87 Ca -0.04 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 58.13 2gir h GLU 87 Cb 1.44 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.51 2gir h GLU 87 CO 0.13 0.62 -0.16 0.00 -1.00 0.00 0.00 179.01 178.59 2gir h ALA 88 N 1.17 0.86 -0.72 3.43 0.00 -0.98 -2.92 119.26 120.10 2gir h ALA 88 Ca 0.21 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.79 2gir h ALA 88 Cb 0.01 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 2gir h ALA 88 CO -0.04 0.64 0.47 0.00 0.00 0.00 0.00 179.25 180.32 2gir h LYS 90 N 0.94 0.00 -0.00 0.00 1.79 -1.20 -2.30 116.57 115.80 2gir h LYS 90 Ca 0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.74 2gir h LYS 90 Cb -0.06 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.59 2gir h LYS 90 CO -0.08 0.00 -0.03 1.28 -1.08 0.00 0.00 179.45 179.54 2gir n LEU 91 N -2.38 0.10 -4.72 2.94 4.77 -1.04 -4.88 117.00 111.80 2gir n LEU 91 Ca 0.02 0.23 -0.41 0.00 -0.03 0.00 0.00 56.01 55.82 2gir n LEU 91 Cb 0.25 -0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 2gir n LEU 91 CO 0.21 0.02 0.57 -0.89 -1.33 0.00 0.00 177.39 175.97 2gir s THR 92 N -2.55 4.82 0.39 -5.08 2.01 -0.86 -0.45 115.64 113.92 2gir s THR 92 Ca 0.29 1.83 -0.28 0.00 0.31 0.00 0.00 61.69 63.84 2gir s THR 92 Cb 0.20 -4.21 -0.10 0.00 0.01 0.00 0.00 72.50 68.39 2gir s THR 92 CO 0.47 0.25 1.48 -2.84 -0.69 0.00 0.00 174.62 173.29 2gir s PRO 93 N 0.57 4.03 0.55 4.92 0.02 -1.26 -4.73 135.00 139.09 2gir s PRO 93 Ca 0.45 2.55 0.29 0.00 0.02 0.00 0.00 61.00 64.31 2gir s PRO 93 Cb -0.21 -2.91 1.60 0.00 0.02 0.00 0.00 34.50 33.01 2gir s PRO 93 CO 0.25 -0.59 2.14 -1.00 -0.33 0.00 0.00 177.00 177.47 2gir h PRO 94 N 2.87 0.00 -0.60 5.54 0.13 -1.95 -2.24 132.00 135.75 2gir h PRO 94 Ca -0.51 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.30 2gir h PRO 94 Cb 1.24 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.18 2gir h PRO 94 CO 0.64 0.08 0.18 0.72 -0.23 0.00 0.00 178.00 179.38 2gir n HIS 95 N -3.67 1.87 -2.30 1.56 8.25 -1.26 -4.05 115.22 115.62 2gir n HIS 95 Ca -0.02 -1.75 -0.37 0.00 -0.26 0.00 0.00 57.72 55.32 2gir n HIS 95 Cb 0.19 -0.68 -0.01 0.00 1.12 0.00 0.00 29.99 30.61 2gir n HIS 95 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2gir s SER 96 N -2.12 6.19 0.06 0.41 0.15 -0.84 -4.93 113.70 112.61 2gir s SER 96 Ca 0.50 2.25 -0.36 0.00 0.70 0.00 0.00 55.95 59.04 2gir s SER 96 Cb 0.44 -2.60 -0.16 0.00 -1.71 0.00 0.00 66.02 61.99 2gir s SER 96 CO 0.03 -0.90 1.48 0.00 1.20 0.00 0.00 173.24 175.05 2gir n ALA 97 N -0.55 -0.16 -1.38 5.45 0.00 -1.26 -4.14 120.51 118.47 2gir n ALA 97 Ca 0.08 0.47 -0.35 0.00 0.00 0.00 0.00 53.44 53.64 2gir n ALA 97 Cb 0.49 -2.19 0.10 0.00 0.00 0.00 0.00 19.45 17.85 2gir n ALA 97 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2gir n LYS 98 N 3.28 0.58 -1.84 0.00 2.85 -1.26 -4.57 118.16 117.20 2gir n LYS 98 Ca 0.19 0.27 -0.33 0.00 -1.05 0.00 0.00 58.31 57.38 2gir n LYS 98 Cb 0.22 -2.45 0.04 0.00 -0.65 0.00 0.00 35.03 32.19 2gir n LYS 98 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2gir s SER 99 N -1.77 5.24 0.00 -5.58 0.15 -0.12 -4.63 113.70 107.00 2gir s SER 99 Ca 0.77 2.00 0.19 0.00 0.70 0.00 0.00 55.95 59.62 2gir s SER 99 Cb -0.33 -2.55 0.88 0.00 -1.71 0.00 0.00 66.02 62.30 2gir s SER 99 CO 0.47 -1.54 1.61 0.29 1.20 0.00 0.00 173.24 175.26 2gir n LYS 100 N -2.25 0.11 -1.11 5.44 5.02 -1.26 -3.74 118.16 120.37 2gir n LYS 100 Ca 0.10 0.15 -0.16 0.00 -2.02 0.00 0.00 58.31 56.38 2gir n LYS 100 Cb 0.52 -1.50 0.17 0.00 -0.02 0.00 0.00 35.03 34.20 2gir n LYS 100 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2gir n PHE 101 N -1.42 2.14 -2.47 2.13 3.72 -1.26 -4.95 117.46 115.35 2gir n PHE 101 Ca 0.06 -1.91 -0.01 0.00 -0.05 0.00 0.00 57.45 55.54 2gir n PHE 101 Cb 0.20 -0.75 0.00 0.00 -0.94 0.00 0.00 39.48 37.99 2gir n PHE 101 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gir n GLY 102 N -1.08 0.76 3.43 1.37 0.00 -1.25 -5.05 105.19 103.38 2gir n GLY 102 Ca 0.47 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 2gir n GLY 102 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2gir s TYR 103 N -2.84 -0.16 0.13 1.61 -0.85 -1.26 -4.98 117.35 109.00 2gir s TYR 103 Ca 0.03 -0.17 0.00 0.00 -0.52 0.00 0.00 57.07 56.41 2gir s TYR 103 Cb -0.01 0.34 -0.00 0.00 0.38 0.00 0.00 41.96 42.66 2gir s TYR 103 CO 0.04 -0.83 0.01 0.41 -1.52 0.00 0.00 175.55 173.66 2gir n GLY 104 N -0.30 3.98 0.35 5.49 0.00 -1.26 -0.94 105.19 112.51 2gir n GLY 104 Ca -0.13 -2.16 -0.05 0.00 0.00 0.00 0.00 46.02 43.69 2gir n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gir h ALA 105 N 1.11 1.11 -0.01 4.61 0.00 -1.82 -1.23 119.26 123.03 2gir h ALA 105 Ca -0.11 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 2gir h ALA 105 Cb 0.34 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2gir h ALA 105 CO 0.17 0.65 -0.61 0.87 0.00 0.00 0.00 179.25 180.33 2gir h LYS 106 N 1.22 0.02 -0.32 0.00 1.57 -1.87 0.45 116.57 117.64 2gir h LYS 106 Ca 0.30 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 59.09 2gir h LYS 106 Cb 0.08 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 2gir h LYS 106 CO -0.04 0.63 0.15 -0.44 -0.57 0.00 0.00 179.45 179.17 2gir h ASP 107 N 0.02 0.20 0.12 0.86 3.32 -1.83 -0.66 116.42 118.45 2gir h ASP 107 Ca -0.01 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2gir h ASP 107 Cb 1.09 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 2gir h ASP 107 CO 0.08 0.16 -0.09 0.58 -1.72 0.00 0.00 179.24 178.25 2gir h VAL 108 N 0.31 0.80 -0.26 -1.35 2.07 -0.71 -0.57 116.25 116.54 2gir h VAL 108 Ca 0.14 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.63 2gir h VAL 108 Cb 0.07 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2gir h VAL 108 CO -0.11 0.00 0.02 0.03 0.02 0.00 0.00 177.57 177.53 2gir h ARG 109 N -0.22 0.39 -0.03 1.57 3.08 -0.83 -0.68 114.38 117.66 2gir h ARG 109 Ca -0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2gir h ARG 109 Cb 0.19 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.18 2gir h ARG 109 CO -0.01 0.40 0.00 0.09 -1.07 0.00 0.00 179.97 179.38 2gir n ASN 110 N -4.35 0.60 -3.61 7.04 3.02 -0.26 -4.78 115.26 112.92 2gir n ASN 110 Ca 0.01 -1.34 -0.24 0.00 -0.03 0.00 0.00 54.58 52.98 2gir n ASN 110 Cb 0.19 -0.02 0.08 0.00 -0.61 0.00 0.00 39.78 39.42 2gir n ASN 110 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2gir n LEU 111 N -0.47 -3.39 -4.74 3.41 4.77 -0.26 -4.91 117.00 111.40 2gir n LEU 111 Ca 0.19 -0.56 -0.42 0.00 -0.03 0.00 0.00 56.01 55.20 2gir n LEU 111 Cb 0.19 -3.02 -0.01 0.00 -2.33 0.00 0.00 43.42 38.25 2gir n LEU 111 CO 0.15 0.64 1.14 -1.54 -1.33 0.00 0.00 177.39 176.45 2gir n SER 112 N -3.02 3.59 -0.30 -1.43 3.41 -0.26 -4.79 113.62 110.82 2gir n SER 112 Ca -0.00 1.18 0.11 0.00 -0.26 0.00 0.00 58.87 59.90 2gir n SER 112 Cb 0.56 -1.57 0.34 0.00 -0.26 0.00 0.00 64.21 63.28 2gir n SER 112 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2gir h SER 113 N 3.79 0.73 -0.01 4.04 4.64 -1.90 -0.52 113.55 124.32 2gir h SER 113 Ca -0.48 0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2gir h SER 113 Cb 1.24 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2gir h SER 113 CO 0.71 0.37 0.01 0.50 -0.87 0.00 0.00 176.83 177.55 2gir h LYS 114 N 0.77 0.02 -0.22 4.77 3.64 -1.96 0.11 116.57 123.70 2gir h LYS 114 Ca 0.47 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.84 2gir h LYS 114 Cb 0.68 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 2gir h LYS 114 CO -0.24 0.11 0.10 0.00 -2.27 0.00 0.00 179.45 177.16 2gir h ALA 115 N 0.91 0.28 -0.37 5.00 0.00 -1.72 -2.10 119.26 121.27 2gir h ALA 115 Ca 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2gir h ALA 115 Cb 0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2gir h ALA 115 CO -0.00 -0.15 0.16 0.28 0.00 0.00 0.00 179.25 179.54 2gir h VAL 116 N 0.22 1.18 -0.78 0.00 2.07 -1.02 -0.05 116.25 117.88 2gir h VAL 116 Ca 0.08 -0.53 0.11 0.00 0.82 0.00 0.00 66.70 67.18 2gir h VAL 116 Cb 0.12 0.84 -0.08 0.00 -1.52 0.00 0.00 31.29 30.66 2gir h VAL 116 CO -0.01 0.19 0.40 0.78 0.02 0.00 0.00 177.57 178.95 2gir h ASN 117 N 0.46 0.50 -0.22 0.57 4.21 -0.74 -1.14 115.58 119.22 2gir h ASN 117 Ca 0.13 0.07 -0.08 0.00 1.21 0.00 0.00 56.30 57.63 2gir h ASN 117 Cb 0.15 -0.01 -0.00 0.00 -1.12 0.00 0.00 38.32 37.34 2gir h ASN 117 CO -0.01 0.26 -0.16 -0.74 -1.29 0.00 0.00 177.43 175.49 2gir h HIS 118 N 0.63 0.58 -0.53 1.19 2.76 -0.77 -2.49 115.15 116.51 2gir h HIS 118 Ca 0.40 -0.16 0.05 0.00 -2.20 0.00 0.00 60.37 58.46 2gir h HIS 118 Cb 0.48 -0.13 -0.05 0.00 1.55 0.00 0.00 27.41 29.27 2gir h HIS 118 CO -0.10 0.81 0.27 0.82 -1.30 0.00 0.00 177.93 178.43 2gir h ILE 119 N 0.18 0.96 -0.97 6.26 2.04 -0.75 0.31 117.51 125.54 2gir h ILE 119 Ca 0.04 -0.18 0.06 0.00 1.00 0.00 0.00 64.86 65.78 2gir h ILE 119 Cb 0.68 0.38 -0.06 0.00 -0.74 0.00 0.00 36.82 37.08 2gir h ILE 119 CO 0.04 0.10 0.62 0.45 0.00 0.00 0.00 178.15 179.36 2gir h HIS 120 N 0.53 1.16 -0.44 1.37 3.86 -1.16 -0.74 115.15 119.74 2gir h HIS 120 Ca 0.24 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.39 2gir h HIS 120 Cb 0.14 -0.38 -0.02 0.00 1.06 0.00 0.00 27.41 28.21 2gir h HIS 120 CO -0.10 0.62 -0.06 0.66 0.86 0.00 0.00 177.93 179.91 2gir h SER 121 N 1.16 0.73 -0.58 2.45 4.64 -0.73 -1.31 113.55 119.90 2gir h SER 121 Ca 0.41 -0.20 -0.09 0.00 -0.47 0.00 0.00 61.79 61.45 2gir h SER 121 Cb 0.12 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 2gir h SER 121 CO -0.16 0.84 0.02 0.58 -0.87 0.00 0.00 176.83 177.24 2gir h VAL 122 N 0.69 1.26 -0.17 0.95 2.07 -0.39 -2.46 116.25 118.20 2gir h VAL 122 Ca 0.13 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.55 2gir h VAL 122 Cb 0.52 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 2gir h VAL 122 CO 0.03 0.40 0.11 -0.25 0.02 0.00 0.00 177.57 177.88 2gir h TRP 123 N 0.91 0.22 -0.97 1.57 2.91 -0.81 -0.87 115.95 118.92 2gir h TRP 123 Ca 0.17 0.00 0.06 0.00 1.13 0.00 0.00 58.89 60.25 2gir h TRP 123 Cb 0.52 -0.07 -0.06 0.00 -0.51 0.00 0.00 29.16 29.03 2gir h TRP 123 CO 0.04 0.16 0.63 -0.22 -1.03 0.00 0.00 178.44 178.02 2gir h LYS 124 N 0.22 1.09 -0.31 2.65 3.64 -1.22 -1.90 116.57 120.74 2gir h LYS 124 Ca 0.06 -0.07 -0.15 0.00 -1.27 0.00 0.00 60.65 59.23 2gir h LYS 124 Cb -0.00 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.56 2gir h LYS 124 CO -0.01 0.72 -0.41 0.22 -2.27 0.00 0.00 179.45 177.70 2gir h ASP 125 N 1.13 0.82 -0.87 4.20 3.58 -1.07 -1.61 116.42 122.59 2gir h ASP 125 Ca 0.41 -0.38 0.01 0.00 0.42 0.00 0.00 57.03 57.49 2gir h ASP 125 Cb 0.17 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 40.94 2gir h ASP 125 CO -0.16 1.13 0.58 -0.07 -2.88 0.00 0.00 179.24 177.83 2gir h LEU 126 N 0.62 0.99 -0.82 2.28 3.38 -0.69 -0.52 115.31 120.57 2gir h LEU 126 Ca 0.05 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 2gir h LEU 126 Cb 0.97 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2gir h LEU 126 CO 0.09 0.72 -0.47 -0.07 0.09 0.00 0.00 178.44 178.80 2gir h LEU 127 N 1.17 0.30 0.00 1.67 3.38 -1.05 -3.32 115.31 117.47 2gir h LEU 127 Ca 0.32 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 58.00 2gir h LEU 127 Cb -0.13 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2gir h LEU 127 CO -0.07 0.73 -1.38 -0.62 0.09 0.00 0.00 178.44 177.19 2gir n GLU 128 N -3.98 0.62 -3.89 1.13 1.02 -0.63 -4.81 120.64 110.09 2gir n GLU 128 Ca -0.02 0.21 -0.26 0.00 -0.02 0.00 0.00 57.16 57.08 2gir n GLU 128 Cb 0.53 -1.81 -0.17 0.00 -0.02 0.00 0.00 31.44 29.97 2gir n GLU 128 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2gir s ASP 129 N -5.73 2.02 -0.15 1.62 -1.08 -0.22 -5.00 116.67 108.13 2gir s ASP 129 Ca -0.03 -0.25 0.17 0.00 -0.52 0.00 0.00 52.55 51.93 2gir s ASP 129 Cb 0.09 -0.74 0.32 0.00 -1.46 0.00 0.00 42.92 41.12 2gir s ASP 129 CO 0.81 -0.13 1.17 0.35 0.52 0.00 0.00 175.17 177.88 2gir n THR 130 N 4.96 1.96 0.00 1.71 -2.24 -1.26 -4.47 114.28 114.93 2gir n THR 130 Ca -0.12 -2.47 0.00 0.00 -2.27 0.00 0.00 64.05 59.19 2gir n THR 130 Cb 0.50 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 2gir n THR 130 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2gir n VAL 131 N -1.37 0.00 -2.31 2.28 0.31 -1.26 -4.61 118.33 111.37 2gir n VAL 131 Ca 0.17 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 64.07 2gir n VAL 131 Cb 0.65 -0.51 -0.02 0.00 -0.91 0.00 0.00 33.84 33.05 2gir n VAL 131 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2gir s THR 132 N -1.83 4.05 0.25 2.52 2.01 -1.26 -4.74 115.64 116.65 2gir s THR 132 Ca 0.00 1.24 -0.30 0.00 0.31 0.00 0.00 61.69 62.94 2gir s THR 132 Cb 0.00 -3.91 -0.14 0.00 0.01 0.00 0.00 72.50 68.46 2gir s THR 132 CO 0.00 -0.24 1.26 -2.65 -0.69 0.00 0.00 174.62 172.30 2gir n PRO 133 N 7.03 1.74 -3.29 4.92 -0.02 -1.26 -4.72 135.00 139.40 2gir n PRO 133 Ca 0.15 0.62 -0.38 0.00 -2.02 0.00 0.00 63.50 61.87 2gir n PRO 133 Cb 0.45 -2.17 -0.06 0.00 -0.02 0.00 0.00 33.50 31.70 2gir n PRO 133 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2gir s ILE 134 N -0.46 5.05 0.51 4.25 1.01 0.51 -4.92 121.20 127.15 2gir s ILE 134 Ca 0.65 1.06 -0.22 0.00 0.00 0.00 0.00 60.65 62.15 2gir s ILE 134 Cb -0.69 -3.85 -0.06 0.00 0.01 0.00 0.00 42.46 37.87 2gir s ILE 134 CO 0.54 0.40 1.22 -0.62 0.00 0.00 0.00 174.94 176.48 2gir s ASP 135 N 0.06 5.71 0.12 3.58 2.15 -1.26 -4.35 116.67 122.67 2gir s ASP 135 Ca 0.28 2.44 0.04 0.00 0.43 0.00 0.00 52.55 55.74 2gir s ASP 135 Cb -0.17 -2.61 -0.04 0.00 -0.30 0.00 0.00 42.92 39.80 2gir s ASP 135 CO 0.14 -1.24 -0.10 0.42 -0.17 0.00 0.00 175.17 174.22 2gir s THR 136 N -1.50 1.00 -0.12 1.71 -4.23 -1.03 -4.36 115.64 107.11 2gir s THR 136 Ca 0.69 -1.84 -0.06 0.00 -1.18 0.00 0.00 61.69 59.30 2gir s THR 136 Cb -0.32 -1.59 -0.04 0.00 1.34 0.00 0.00 72.50 71.89 2gir s THR 136 CO 0.37 -0.67 0.10 -0.89 -0.54 0.00 0.00 174.62 172.99 2gir s THR 137 N -2.93 5.12 -0.13 3.99 2.01 0.55 -0.98 115.64 123.27 2gir s THR 137 Ca 0.11 0.07 -0.00 0.00 0.31 0.00 0.00 61.69 62.17 2gir s THR 137 Cb 0.00 -3.22 -0.02 0.00 0.01 0.00 0.00 72.50 69.27 2gir s THR 137 CO -0.00 0.60 -0.12 -0.51 -0.69 0.00 0.00 174.62 173.89 2gir s ILE 138 N -0.82 3.12 0.12 1.82 2.07 0.07 -1.62 121.20 125.96 2gir s ILE 138 Ca 0.13 -0.64 0.04 0.00 -1.41 0.00 0.00 60.65 58.78 2gir s ILE 138 Cb -0.12 -2.32 -0.04 0.00 0.13 0.00 0.00 42.46 40.12 2gir s ILE 138 CO 0.03 0.52 -0.10 -0.04 -1.91 0.00 0.00 174.94 173.44 2gir s MET 139 N 0.36 0.95 -0.13 3.50 -1.94 -0.34 -4.37 119.30 117.32 2gir s MET 139 Ca -0.10 -1.29 -0.20 0.00 -1.71 0.00 0.00 55.69 52.39 2gir s MET 139 Cb -0.16 -0.59 -0.03 0.00 2.01 0.00 0.00 34.83 36.06 2gir s MET 139 CO 0.05 0.08 0.59 0.00 -0.01 0.00 0.00 175.02 175.73 2gir s ALA 140 N -2.82 3.46 0.39 3.03 0.00 -1.26 -0.81 121.76 123.76 2gir s ALA 140 Ca 0.10 -0.15 -0.25 0.00 0.00 0.00 0.00 51.96 51.66 2gir s ALA 140 Cb -0.01 -2.84 -0.09 0.00 0.00 0.00 0.00 23.12 20.19 2gir s ALA 140 CO 0.00 -0.23 1.16 0.15 0.00 0.00 0.00 175.76 176.84 2gir s LYS 141 N 1.14 4.11 -0.51 0.00 1.02 0.60 -4.74 119.74 121.35 2gir s LYS 141 Ca 0.30 1.82 -0.15 0.00 0.02 0.00 0.00 55.97 57.95 2gir s LYS 141 Cb -0.16 -2.70 0.11 0.00 -0.52 0.00 0.00 37.83 34.56 2gir s LYS 141 CO 0.12 -0.27 0.45 -0.80 -0.92 0.00 0.00 175.35 173.93 2gir s ASN 142 N -1.14 6.10 0.13 2.83 0.02 -1.26 -4.40 114.94 117.22 2gir s ASN 142 Ca 0.56 -1.69 0.09 0.00 -1.02 0.00 0.00 52.86 50.80 2gir s ASN 142 Cb -0.30 -2.17 -0.04 0.00 0.02 0.00 0.00 41.25 38.76 2gir s ASN 142 CO 0.38 -0.78 -0.20 -1.61 0.02 0.00 0.00 177.10 174.91 2gir s GLU 143 N 1.58 1.21 -0.11 -0.60 2.02 -1.25 -4.87 118.70 116.66 2gir s GLU 143 Ca 0.04 -1.28 -0.04 0.00 0.02 0.00 0.00 54.97 53.71 2gir s GLU 143 Cb -0.28 -1.40 -0.03 0.00 0.10 0.00 0.00 34.13 32.51 2gir s GLU 143 CO 0.03 0.31 0.03 0.08 0.02 0.00 0.00 175.26 175.73 2gir s VAL 144 N -1.52 4.54 0.24 2.63 1.01 -1.26 -0.44 120.40 125.60 2gir s VAL 144 Ca 0.11 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 61.95 2gir s VAL 144 Cb -0.08 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 2gir s VAL 144 CO 0.05 0.58 0.16 -0.36 0.00 0.00 0.00 175.10 175.53 2gir s PHE 145 N -0.64 1.34 -0.12 5.22 0.08 -0.10 -4.72 117.98 119.04 2gir s PHE 145 Ca 0.11 -1.41 -0.07 0.00 0.12 0.00 0.00 56.93 55.68 2gir s PHE 145 Cb -0.12 -0.65 -0.04 0.00 -0.57 0.00 0.00 43.02 41.65 2gir s PHE 145 CO 0.02 -0.64 0.12 0.00 -0.10 0.00 0.00 175.22 174.62 2gir n VAL 147 N 2.13 3.06 -3.63 0.00 0.24 0.10 -4.99 118.33 115.23 2gir n VAL 147 Ca -0.20 -0.50 -0.22 0.00 -2.04 0.00 0.00 64.34 61.38 2gir n VAL 147 Cb 0.55 -1.49 0.01 0.00 -1.47 0.00 0.00 33.84 31.44 2gir n VAL 147 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 2gir n GLN 148 N -0.39 -1.31 -4.20 7.34 7.27 -1.26 -5.07 117.38 119.77 2gir n GLN 148 Ca 0.09 0.81 -0.35 0.00 0.07 0.00 0.00 57.00 57.62 2gir n GLN 148 Cb 0.42 -3.43 -0.09 0.00 2.41 0.00 0.00 30.24 29.55 2gir n GLN 148 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2gir s ARG 154 N -4.92 3.43 0.26 3.69 0.52 -1.26 -5.25 118.95 115.42 2gir s ARG 154 Ca 0.13 -0.36 -0.29 0.00 -0.52 0.00 0.00 55.73 54.69 2gir s ARG 154 Cb -0.06 -2.99 -0.09 0.00 0.52 0.00 0.00 34.95 32.33 2gir s ARG 154 CO 0.86 0.53 0.96 0.15 0.02 0.00 0.00 175.30 177.83 2gir s LYS 155 N -0.38 4.76 0.72 3.54 1.02 -1.26 -5.05 119.74 123.09 2gir s LYS 155 Ca 0.08 1.50 -0.11 0.00 0.02 0.00 0.00 55.97 57.46 2gir s LYS 155 Cb -0.12 -3.16 0.03 0.00 -0.52 0.00 0.00 37.83 34.05 2gir s LYS 155 CO 0.02 0.42 1.08 -1.25 -0.92 0.00 0.00 175.35 174.70 2gir s PRO 156 N -1.41 2.66 0.44 -1.68 0.04 -1.26 -4.84 135.00 128.95 2gir s PRO 156 Ca 0.44 1.08 -0.26 0.00 0.04 0.00 0.00 61.00 62.29 2gir s PRO 156 Cb -0.25 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 2gir s PRO 156 CO 0.31 -1.33 1.43 0.00 0.04 0.00 0.00 177.00 177.46 2gir s ALA 157 N -2.93 3.29 0.62 8.56 0.00 -1.26 -4.95 121.76 125.09 2gir s ALA 157 Ca 0.60 1.48 -0.12 0.00 0.00 0.00 0.00 51.96 53.92 2gir s ALA 157 Cb -0.16 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.34 2gir s ALA 157 CO 0.54 -1.16 1.03 1.03 0.00 0.00 0.00 175.76 177.20 2gir s ARG 158 N -2.39 3.51 0.04 0.00 0.52 -1.26 -4.69 118.95 114.69 2gir s ARG 158 Ca 0.60 0.83 0.03 0.00 -0.52 0.00 0.00 55.73 56.67 2gir s ARG 158 Cb -0.44 -2.07 -0.04 0.00 0.52 0.00 0.00 34.95 32.92 2gir s ARG 158 CO 0.57 -0.64 -0.02 -0.51 0.02 0.00 0.00 175.30 174.73 2gir s LEU 159 N -5.08 3.39 -0.05 2.53 1.02 -1.26 -0.29 118.68 118.94 2gir s LEU 159 Ca 0.56 -0.12 0.05 0.00 0.02 0.00 0.00 54.13 54.64 2gir s LEU 159 Cb -0.12 -2.03 -0.01 0.00 0.02 0.00 0.00 46.19 44.06 2gir s LEU 159 CO 0.51 0.23 -0.21 -0.51 0.02 0.00 0.00 176.35 176.40 2gir s ILE 160 N -1.16 1.71 -0.13 -0.59 1.10 0.01 -4.87 121.20 117.27 2gir s ILE 160 Ca 0.21 -0.87 0.01 0.00 -0.51 0.00 0.00 60.65 59.50 2gir s ILE 160 Cb -0.11 -1.46 0.02 0.00 0.15 0.00 0.00 42.46 41.06 2gir s ILE 160 CO 0.13 0.48 -0.15 -0.69 -2.11 0.00 0.00 174.94 172.60 2gir s VAL 161 N -0.01 1.55 -0.06 4.00 1.01 -1.26 -1.20 120.40 124.44 2gir s VAL 161 Ca -0.05 -0.64 -0.10 0.00 0.00 0.00 0.00 61.98 61.19 2gir s VAL 161 Cb -0.13 -1.44 0.02 0.00 0.00 0.00 0.00 36.38 34.83 2gir s VAL 161 CO 0.03 0.45 0.25 0.72 0.00 0.00 0.00 175.10 176.55 2gir s PHE 162 N 1.28 -0.19 0.92 5.22 -0.71 -0.64 -0.36 117.98 123.51 2gir s PHE 162 Ca 0.00 0.41 -0.13 0.00 -1.04 0.00 0.00 56.93 56.18 2gir s PHE 162 Cb -0.14 0.07 0.19 0.00 -1.21 0.00 0.00 43.02 41.93 2gir s PHE 162 CO -0.07 -0.23 1.26 -1.25 -1.34 0.00 0.00 175.22 173.59 2gir s PRO 163 N -0.55 0.76 0.67 1.99 0.04 -1.26 -0.33 135.00 136.32 2gir s PRO 163 Ca -0.07 -0.62 -0.17 0.00 0.04 0.00 0.00 61.00 60.19 2gir s PRO 163 Cb -0.04 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.56 2gir s PRO 163 CO 0.02 -2.27 1.21 0.34 0.04 0.00 0.00 177.00 176.34 2gir s ASP 164 N -4.89 4.64 0.34 6.66 2.15 -1.26 -4.75 116.67 119.57 2gir s ASP 164 Ca 0.73 2.38 0.12 0.00 0.43 0.00 0.00 52.55 56.21 2gir s ASP 164 Cb -0.03 -2.59 0.92 0.00 -0.30 0.00 0.00 42.92 40.91 2gir s ASP 164 CO 0.51 -1.96 1.76 0.25 -0.17 0.00 0.00 175.17 175.56 2gir h LEU 165 N 0.23 0.63 -0.99 -1.34 5.85 -1.82 -0.48 115.31 117.39 2gir h LEU 165 Ca -0.49 0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.31 2gir h LEU 165 Cb 1.30 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.30 2gir h LEU 165 CO 0.52 0.15 0.34 1.23 -0.34 0.00 0.00 178.44 180.34 2gir h GLY 166 N 0.57 1.14 1.15 3.75 0.00 -1.95 -1.81 103.07 105.92 2gir h GLY 166 Ca 0.60 -0.56 -0.13 0.00 0.00 0.00 0.00 47.33 47.24 2gir h GLY 166 CO -0.38 0.53 -0.24 -2.08 0.00 0.00 0.00 176.54 174.37 2gir h VAL 167 N 1.05 1.27 -0.80 4.60 2.07 -1.46 -2.33 116.25 120.64 2gir h VAL 167 Ca 0.25 -1.40 -0.02 0.00 0.82 0.00 0.00 66.70 66.35 2gir h VAL 167 Cb 0.13 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 2gir h VAL 167 CO -0.03 0.48 0.42 0.03 0.02 0.00 0.00 177.57 178.49 2gir h ARG 168 N 0.83 1.12 -0.56 1.57 3.08 -0.86 0.11 114.38 119.67 2gir h ARG 168 Ca 0.10 -0.14 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 2gir h ARG 168 Cb 0.81 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 2gir h ARG 168 CO 0.07 0.84 -0.04 0.28 -1.07 0.00 0.00 179.97 180.05 2gir h VAL 169 N 1.13 1.27 -0.95 2.04 2.07 -1.27 -2.66 116.25 117.87 2gir h VAL 169 Ca 0.28 -1.18 0.01 0.00 0.82 0.00 0.00 66.70 66.63 2gir h VAL 169 Cb 0.06 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 30.69 2gir h VAL 169 CO -0.04 0.42 0.62 0.00 0.02 0.00 0.00 177.57 178.59 2gir h GLU 171 N 1.29 0.43 -0.49 0.00 5.08 -0.59 -1.82 114.58 118.48 2gir h GLU 171 Ca 0.35 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.72 2gir h GLU 171 Cb -0.13 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 28.98 2gir h GLU 171 CO -0.07 0.28 0.24 0.87 -1.00 0.00 0.00 179.01 179.33 2gir h LYS 172 N 0.44 0.47 -0.32 2.33 1.57 -1.09 0.15 116.57 120.11 2gir h LYS 172 Ca 0.22 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 59.03 2gir h LYS 172 Cb 0.17 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.33 2gir h LYS 172 CO -0.18 0.31 0.05 0.52 -0.57 0.00 0.00 179.45 179.57 2gir h MET 173 N 0.48 0.15 -0.07 3.15 2.86 -0.72 -0.84 114.93 119.94 2gir h MET 173 Ca 0.21 -0.01 -0.23 0.00 -2.06 0.00 0.00 59.70 57.62 2gir h MET 173 Cb 0.12 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 31.76 2gir h MET 173 CO -0.15 0.10 -0.86 0.00 1.06 0.00 0.00 176.91 177.05 2gir h ALA 174 N 1.25 0.34 0.00 6.32 0.00 -1.10 -1.58 119.26 124.49 2gir h ALA 174 Ca 0.15 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2gir h ALA 174 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2gir h ALA 174 CO -0.22 0.73 0.00 1.28 0.00 0.00 0.00 179.25 181.04 2gir n LEU 175 N -3.86 0.08 -0.09 0.00 4.77 0.51 -4.74 117.00 113.67 2gir n LEU 175 Ca -0.07 -0.32 -0.07 0.00 -0.03 0.00 0.00 56.01 55.51 2gir n LEU 175 Cb 0.79 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.88 2gir n LEU 175 CO 0.52 0.02 0.94 0.22 -1.33 0.00 0.00 177.39 177.77 2gir h TYR 176 N 0.00 0.23 -0.71 -1.77 3.20 -1.21 0.13 116.97 116.83 2gir h TYR 176 Ca 0.00 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.83 2gir h TYR 176 Cb 0.03 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 2gir h TYR 176 CO 0.00 0.11 0.23 0.22 -1.64 0.00 0.00 178.16 177.07 2gir h ASP 177 N 0.27 1.02 0.42 -2.11 3.58 -1.78 -2.04 116.42 115.78 2gir h ASP 177 Ca 0.14 -0.18 -0.02 0.00 0.42 0.00 0.00 57.03 57.39 2gir h ASP 177 Cb 0.10 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 40.89 2gir h ASP 177 CO -0.13 0.94 -0.20 0.58 -2.88 0.00 0.00 179.24 177.55 2gir h VAL 178 N 1.05 0.59 0.00 2.25 2.07 -1.64 -2.52 116.25 118.06 2gir h VAL 178 Ca 0.23 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.67 2gir h VAL 178 Cb 0.29 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2gir h VAL 178 CO -0.01 0.02 0.00 -0.37 0.02 0.00 0.00 177.57 177.23 2gir h VAL 179 N -0.61 0.00 0.00 2.57 -1.51 -0.70 0.11 116.25 116.11 2gir h VAL 179 Ca -0.06 -0.35 -0.03 0.00 -1.23 0.00 0.00 66.70 65.03 2gir h VAL 179 Cb 0.46 1.26 -0.01 0.00 -2.13 0.00 0.00 31.29 30.87 2gir h VAL 179 CO 0.09 0.00 -0.69 0.28 -1.23 0.00 0.00 177.57 176.03 2gir h SER 180 N 0.00 0.00 0.00 4.19 0.02 -1.24 -3.42 113.55 113.10 2gir h SER 180 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2gir h SER 180 Cb 0.39 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 2gir h SER 180 CO 0.00 0.13 -1.01 0.41 -1.14 0.00 0.00 176.83 175.23 2gir n THR 181 N -2.90 0.01 -0.07 -2.27 -1.04 -0.88 -4.71 114.28 102.42 2gir n THR 181 Ca 0.00 -0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 2gir n THR 181 Cb 0.60 -0.66 -0.06 0.00 -1.82 0.00 0.00 70.33 68.39 2gir n THR 181 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2gir h LEU 182 N 0.00 0.52 -1.04 -4.42 6.46 -1.03 -3.19 115.31 112.61 2gir h LEU 182 Ca -0.00 -0.49 0.02 0.00 -0.12 0.00 0.00 57.88 57.29 2gir h LEU 182 Cb 1.00 -0.15 -0.05 0.00 -0.73 0.00 0.00 40.66 40.74 2gir h LEU 182 CO -0.00 0.90 0.65 -0.65 -0.62 0.00 0.00 178.44 178.72 2gir h PRO 183 N 0.16 1.26 -0.30 5.25 0.11 -1.82 -0.43 132.00 136.22 2gir h PRO 183 Ca 0.03 -0.08 -0.08 0.00 0.11 0.00 0.00 66.00 65.98 2gir h PRO 183 Cb 0.76 -0.28 -0.02 0.00 0.11 0.00 0.00 31.00 31.57 2gir h PRO 183 CO 0.05 0.83 -0.17 0.37 -0.21 0.00 0.00 178.00 178.88 2gir h GLN 184 N 1.30 0.53 -0.25 1.05 -0.00 -1.88 -0.16 115.11 115.69 2gir h GLN 184 Ca 0.37 -0.17 -0.08 0.00 -0.00 0.00 0.00 58.65 58.77 2gir h GLN 184 Cb -0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 27.48 27.32 2gir h GLN 184 CO -0.09 0.68 -0.15 0.28 0.00 0.00 0.00 178.83 179.55 2gir h VAL 185 N 0.48 1.30 -0.22 2.39 2.07 -1.36 0.14 116.25 121.05 2gir h VAL 185 Ca 0.08 -1.26 -0.18 0.00 0.82 0.00 0.00 66.70 66.16 2gir h VAL 185 Cb 0.57 1.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.91 2gir h VAL 185 CO 0.04 0.39 -0.59 0.58 0.02 0.00 0.00 177.57 178.01 2gir h VAL 186 N 0.27 1.30 -0.01 2.57 2.07 -0.92 -3.34 116.25 118.19 2gir h VAL 186 Ca 0.05 -1.81 0.00 0.00 0.82 0.00 0.00 66.70 65.76 2gir h VAL 186 Cb 0.67 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2gir h VAL 186 CO 0.04 0.58 -0.16 0.23 0.02 0.00 0.00 177.57 178.28 2gir n MET 187 N -3.97 1.57 0.00 1.57 2.81 -0.09 -4.91 117.12 114.11 2gir n MET 187 Ca -0.04 -0.82 0.00 0.00 -1.81 0.00 0.00 57.70 55.03 2gir n MET 187 Cb 0.64 -1.15 0.00 0.00 -0.71 0.00 0.00 33.22 32.00 2gir n MET 187 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gir n GLY 188 N 0.85 2.97 0.14 3.03 0.00 0.49 -1.31 105.19 111.35 2gir n GLY 188 Ca 0.05 -0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2gir n GLY 188 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gir n SER 189 N 2.71 0.63 0.11 1.61 3.41 -1.26 -2.04 113.62 118.79 2gir n SER 189 Ca 0.00 0.69 0.12 0.00 -0.26 0.00 0.00 58.87 59.42 2gir n SER 189 Cb 0.00 -0.81 0.46 0.00 -0.26 0.00 0.00 64.21 63.60 2gir n SER 189 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2gir n SER 190 N -2.23 0.64 -4.60 4.04 7.64 -0.43 -4.70 113.62 113.98 2gir n SER 190 Ca 0.01 0.63 -0.43 0.00 1.01 0.00 0.00 58.87 60.09 2gir n SER 190 Cb 0.18 -0.77 -0.02 0.00 -1.01 0.00 0.00 64.21 62.58 2gir n SER 190 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2gir s TYR 191 N -3.24 2.65 0.35 1.43 5.04 -0.87 -1.05 117.35 121.66 2gir s TYR 191 Ca 0.06 0.70 0.06 0.00 -2.44 0.00 0.00 57.07 55.45 2gir s TYR 191 Cb 0.10 -4.40 0.64 0.00 0.35 0.00 0.00 41.96 38.66 2gir s TYR 191 CO 0.43 -1.56 1.86 0.78 -1.34 0.00 0.00 175.55 175.73 2gir h GLY 192 N 11.63 0.42 1.58 8.97 0.00 -1.01 -3.24 103.07 121.41 2gir h GLY 192 Ca -0.25 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 46.82 2gir h GLY 192 CO 1.11 0.25 0.00 0.69 0.00 0.00 0.00 176.54 178.59 2gir n PHE 193 N -4.24 0.00 1.32 5.60 3.72 -1.26 -2.45 117.46 120.15 2gir n PHE 193 Ca 0.00 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.54 2gir n PHE 193 Cb 0.29 -0.29 0.70 0.00 -0.94 0.00 0.00 39.48 39.24 2gir n PHE 193 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2gir n GLN 194 N -1.29 0.41 -4.50 -1.08 10.64 -1.22 -3.26 117.38 117.08 2gir n GLN 194 Ca 0.14 0.02 -0.34 0.00 -1.83 0.00 0.00 57.00 54.99 2gir n GLN 194 Cb 0.23 -1.50 -0.12 0.00 -0.86 0.00 0.00 30.24 27.99 2gir n GLN 194 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2gir s TYR 195 N -2.55 2.98 1.04 2.61 2.02 -1.03 -4.65 117.35 117.77 2gir s TYR 195 Ca 0.27 -0.24 -0.12 0.00 -0.37 0.00 0.00 57.07 56.61 2gir s TYR 195 Cb 0.19 -1.88 0.21 0.00 -0.40 0.00 0.00 41.96 40.08 2gir s TYR 195 CO 0.42 0.06 1.07 -1.54 -1.57 0.00 0.00 175.55 173.99 2gir s SER 196 N 0.02 2.08 0.23 2.29 1.04 -1.26 -4.74 113.70 113.35 2gir s SER 196 Ca -0.00 1.66 -0.07 0.00 0.48 0.00 0.00 55.95 58.02 2gir s SER 196 Cb -0.13 -2.32 0.33 0.00 0.10 0.00 0.00 66.02 64.00 2gir s SER 196 CO 0.03 -3.54 1.78 -0.65 0.98 0.00 0.00 173.24 171.84 2gir h PRO 197 N -2.17 0.61 -0.79 4.02 0.11 -1.89 -0.46 132.00 131.42 2gir h PRO 197 Ca -0.54 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.53 2gir h PRO 197 Cb 1.31 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 2gir h PRO 197 CO 0.49 0.40 0.46 0.78 -0.21 0.00 0.00 178.00 179.93 2gir h GLY 198 N 0.62 1.16 1.50 -0.55 0.00 -1.93 -1.14 103.07 102.75 2gir h GLY 198 Ca 0.35 -0.49 -0.17 0.00 0.00 0.00 0.00 47.33 47.02 2gir h GLY 198 CO -0.26 0.47 -0.61 1.46 0.00 0.00 0.00 176.54 177.61 2gir h GLN 199 N 1.10 0.51 -0.32 4.80 4.20 -1.73 -1.29 115.11 122.38 2gir h GLN 199 Ca 0.28 -0.35 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 2gir h GLN 199 Cb -0.02 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 2gir h GLN 199 CO -0.05 0.96 0.20 -0.09 -0.67 0.00 0.00 178.83 179.18 2gir h ARG 200 N 0.38 0.43 -0.45 1.46 2.43 -0.73 0.24 114.38 118.14 2gir h ARG 200 Ca -0.00 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2gir h ARG 200 Cb 1.16 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.59 2gir h ARG 200 CO 0.11 0.32 0.30 0.28 -1.51 0.00 0.00 179.97 179.47 2gir h VAL 201 N 0.42 1.11 -0.68 0.20 2.07 -1.06 -0.50 116.25 117.81 2gir h VAL 201 Ca 0.12 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2gir h VAL 201 Cb -0.00 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 2gir h VAL 201 CO -0.02 0.11 0.43 -0.08 0.02 0.00 0.00 177.57 178.03 2gir h GLU 202 N 0.61 0.90 -0.53 1.57 4.81 -1.00 0.31 114.58 121.24 2gir h GLU 202 Ca 0.17 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.30 2gir h GLU 202 Cb -0.06 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.10 2gir h GLU 202 CO -0.04 0.62 0.22 0.35 -0.73 0.00 0.00 179.01 179.42 2gir h PHE 203 N 0.92 0.81 -0.20 0.92 3.57 -0.52 -1.04 116.94 121.40 2gir h PHE 203 Ca 0.25 -0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 2gir h PHE 203 Cb -0.07 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 38.42 2gir h PHE 203 CO -0.02 0.66 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.50 2gir h LEU 204 N 0.72 0.48 -0.17 0.59 3.38 -0.73 -1.26 115.31 118.34 2gir h LEU 204 Ca 0.18 -0.45 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2gir h LEU 204 Cb 0.19 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2gir h LEU 204 CO -0.02 0.83 0.05 0.58 0.09 0.00 0.00 178.44 179.97 2gir h VAL 205 N 0.14 1.19 -0.92 1.22 2.07 -0.93 -0.29 116.25 118.73 2gir h VAL 205 Ca 0.04 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 2gir h VAL 205 Cb 0.67 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 2gir h VAL 205 CO 0.04 0.18 0.53 0.78 0.02 0.00 0.00 177.57 179.12 2gir h ASN 206 N 0.09 1.14 -0.15 0.57 2.35 -1.20 -0.72 115.58 117.66 2gir h ASN 206 Ca 0.05 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 2gir h ASN 206 Cb 0.24 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 2gir h ASN 206 CO -0.00 0.89 0.06 0.74 -1.65 0.00 0.00 177.43 177.47 2gir h THR 207 N 1.29 1.15 -0.51 2.81 2.02 -1.09 -1.18 112.91 117.39 2gir h THR 207 Ca 0.33 -0.44 0.07 0.00 0.77 0.00 0.00 66.41 67.14 2gir h THR 207 Cb -0.01 1.17 -0.06 0.00 -1.74 0.00 0.00 68.15 67.51 2gir h THR 207 CO -0.06 0.14 0.18 -0.25 0.37 0.00 0.00 175.52 175.90 2gir h TRP 208 N 0.09 0.32 0.00 3.16 2.91 -0.81 -2.29 115.95 119.34 2gir h TRP 208 Ca 0.05 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.07 2gir h TRP 208 Cb 0.16 -0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 28.74 2gir h TRP 208 CO -0.02 0.10 -0.13 0.87 -1.03 0.00 0.00 178.44 178.24 2gir h LYS 209 N 0.36 0.00 0.00 2.65 1.57 -0.96 -3.03 116.57 117.16 2gir h LYS 209 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2gir h LYS 209 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2gir h LYS 209 CO -0.25 0.13 0.00 -1.13 -0.57 0.00 0.00 179.45 177.63 2gir n SER 210 N -3.27 0.23 -4.88 0.86 3.41 -0.46 -4.78 113.62 104.72 2gir n SER 210 Ca 0.00 0.53 -0.34 0.00 -0.26 0.00 0.00 58.87 58.81 2gir n SER 210 Cb 0.38 -0.59 -0.05 0.00 -0.26 0.00 0.00 64.21 63.69 2gir n SER 210 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2gir s LYS 211 N -3.04 3.69 0.04 4.33 -0.14 -1.15 -5.01 119.74 118.45 2gir s LYS 211 Ca 0.11 0.05 -0.23 0.00 -1.36 0.00 0.00 55.97 54.54 2gir s LYS 211 Cb 0.15 -2.95 -0.16 0.00 -1.68 0.00 0.00 37.83 33.19 2gir s LYS 211 CO 0.49 0.54 1.48 0.87 -0.76 0.00 0.00 175.35 177.97 2gir h LYS 212 N 3.44 0.10 -2.67 1.68 1.57 -1.88 -3.38 116.57 115.43 2gir h LYS 212 Ca -0.48 -0.03 -0.60 0.00 -1.87 0.00 0.00 60.65 57.67 2gir h LYS 212 Cb 1.18 -0.01 -0.39 0.00 0.08 0.00 0.00 32.23 33.09 2gir h LYS 212 CO 0.68 0.36 -0.83 -0.80 -0.57 0.00 0.00 179.45 178.29 2gir s ASN 213 N -5.59 2.81 0.49 0.86 0.01 -1.26 -5.08 114.94 107.18 2gir s ASN 213 Ca -0.14 -2.88 -0.23 0.00 -0.71 0.00 0.00 52.86 48.90 2gir s ASN 213 Cb 0.04 -0.75 -0.07 0.00 0.41 0.00 0.00 41.25 40.89 2gir s ASN 213 CO 0.69 -0.21 1.24 -2.16 -1.51 0.00 0.00 177.10 175.14 2gir s PRO 214 N 0.14 3.55 0.02 -0.60 0.04 -1.26 0.00 135.00 136.89 2gir s PRO 214 Ca 0.25 1.96 0.01 0.00 0.04 0.00 0.00 61.00 63.25 2gir s PRO 214 Cb -0.10 -2.37 -0.01 0.00 0.04 0.00 0.00 34.50 32.05 2gir s PRO 214 CO -0.10 -0.77 -0.04 1.41 0.04 0.00 0.00 177.00 177.54 2gir s MET 215 N -2.74 0.31 0.06 4.56 1.75 -0.27 -4.64 119.30 118.32 2gir s MET 215 Ca 0.66 -0.40 -0.03 0.00 -1.25 0.00 0.00 55.69 54.67 2gir s MET 215 Cb -0.33 -0.12 -0.03 0.00 2.84 0.00 0.00 34.83 37.18 2gir s MET 215 CO 0.40 0.02 0.01 0.20 -0.65 0.00 0.00 175.02 175.01 2gir s GLY 216 N -0.85 0.39 0.11 2.11 0.00 -0.59 -0.36 107.32 108.13 2gir s GLY 216 Ca -0.07 -1.07 -0.16 0.00 0.00 0.00 0.00 44.72 43.42 2gir s GLY 216 CO -0.00 -1.20 0.40 -0.11 0.00 0.00 0.00 173.10 172.19 2gir s PHE 217 N -3.84 -0.21 0.08 1.90 -0.71 0.14 -0.35 117.98 114.98 2gir s PHE 217 Ca 0.06 -0.06 0.04 0.00 -1.04 0.00 0.00 56.93 55.92 2gir s PHE 217 Cb 0.07 0.25 -0.04 0.00 -1.21 0.00 0.00 43.02 42.09 2gir s PHE 217 CO -0.10 -0.68 0.03 -1.54 -1.34 0.00 0.00 175.22 171.59 2gir s SER 218 N -2.69 5.25 -0.17 1.98 1.04 -1.26 -0.55 113.70 117.30 2gir s SER 218 Ca 0.02 -0.09 0.01 0.00 0.48 0.00 0.00 55.95 56.36 2gir s SER 218 Cb 0.01 -1.33 0.02 0.00 0.10 0.00 0.00 66.02 64.83 2gir s SER 218 CO -0.11 0.18 -0.19 -0.47 0.98 0.00 0.00 173.24 173.64 2gir s TYR 219 N -1.33 2.64 -0.41 5.02 5.04 -0.74 -4.49 117.35 123.07 2gir s TYR 219 Ca 0.27 -1.54 -0.13 0.00 -2.44 0.00 0.00 57.07 53.23 2gir s TYR 219 Cb -0.12 -1.84 0.04 0.00 0.35 0.00 0.00 41.96 40.39 2gir s TYR 219 CO 0.19 -0.77 0.29 0.34 -1.34 0.00 0.00 175.55 174.26 2gir s ASP 220 N 1.31 5.96 0.14 4.32 2.15 -1.26 -4.09 116.67 125.20 2gir s ASP 220 Ca 0.04 -1.08 -0.30 0.00 0.43 0.00 0.00 52.55 51.64 2gir s ASP 220 Cb -0.13 -2.11 -0.07 0.00 -0.30 0.00 0.00 42.92 40.32 2gir s ASP 220 CO -0.12 -0.48 0.99 -0.89 -0.17 0.00 0.00 175.17 174.49 2gir s THR 221 N 1.61 4.32 -0.14 1.71 2.01 -1.26 0.34 115.64 124.23 2gir s THR 221 Ca 0.04 1.99 -0.29 0.00 0.31 0.00 0.00 61.69 63.73 2gir s THR 221 Cb -0.21 -4.27 -0.02 0.00 0.01 0.00 0.00 72.50 68.01 2gir s THR 221 CO 0.07 0.33 1.37 -0.60 -0.69 0.00 0.00 174.62 175.11 2gir s ARG 222 N -0.22 4.20 -1.08 4.92 3.52 -0.39 -4.03 118.95 125.87 2gir s ARG 222 Ca 0.47 1.78 -0.16 0.00 -0.13 0.00 0.00 55.73 57.68 2gir s ARG 222 Cb -0.25 -3.83 -0.02 0.00 -1.56 0.00 0.00 34.95 29.30 2gir s ARG 222 CO 0.31 -0.77 0.79 0.00 -0.81 0.00 0.00 175.30 174.82 2gir h PHE 224 N -1.52 0.32 -0.95 0.00 3.04 -1.96 -0.36 116.94 115.51 2gir h PHE 224 Ca -0.61 0.03 0.10 0.00 3.98 0.00 0.00 57.97 61.48 2gir h PHE 224 Cb 1.33 -0.05 -0.07 0.00 2.56 0.00 0.00 35.95 39.72 2gir h PHE 224 CO 0.31 0.03 0.61 -0.44 -2.02 0.00 0.00 178.31 176.80 2gir h ASP 225 N 0.34 0.88 1.44 0.41 3.32 -1.91 -1.05 116.42 119.85 2gir h ASP 225 Ca 0.33 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.38 2gir h ASP 225 Cb 0.47 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 2gir h ASP 225 CO -0.37 0.51 -0.14 0.28 -1.72 0.00 0.00 179.24 177.80 2gir h SER 226 N 0.96 0.00 1.35 6.45 0.02 -1.37 -2.49 113.55 118.48 2gir h SER 226 Ca 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.39 2gir h SER 226 Cb 0.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.95 2gir h SER 226 CO -0.20 0.14 0.00 0.71 -1.14 0.00 0.00 176.83 176.34 2gir h THR 227 N 0.00 0.00 -2.98 -2.27 1.35 -0.76 -3.44 112.91 104.81 2gir h THR 227 Ca -0.00 -0.46 -0.56 0.00 -0.55 0.00 0.00 66.41 64.84 2gir h THR 227 Cb 0.90 1.41 -0.03 0.00 -1.73 0.00 0.00 68.15 68.70 2gir h THR 227 CO 0.02 0.00 0.81 -0.69 -0.25 0.00 0.00 175.52 175.41 2gir s VAL 228 N -3.16 4.17 0.46 6.82 1.01 -1.06 -4.79 120.40 123.85 2gir s VAL 228 Ca 0.09 1.47 0.07 0.00 0.00 0.00 0.00 61.98 63.61 2gir s VAL 228 Cb 0.11 -3.95 0.02 0.00 0.00 0.00 0.00 36.38 32.57 2gir s VAL 228 CO 0.56 -0.05 0.63 0.42 0.00 0.00 0.00 175.10 176.66 2gir s THR 229 N 2.79 2.83 0.21 3.92 -4.23 -1.26 -3.86 115.64 116.03 2gir s THR 229 Ca 0.57 -0.94 -0.10 0.00 -1.18 0.00 0.00 61.69 60.04 2gir s THR 229 Cb -0.25 -2.89 0.13 0.00 1.34 0.00 0.00 72.50 70.83 2gir s THR 229 CO 0.20 0.00 1.77 -0.08 -0.54 0.00 0.00 174.62 175.97 2gir h GLU 230 N 0.48 0.49 -0.58 3.99 4.81 -1.87 -1.62 114.58 120.28 2gir h GLU 230 Ca -0.39 -0.03 0.12 0.00 -0.13 0.00 0.00 59.36 58.93 2gir h GLU 230 Cb 1.28 -0.11 -0.10 0.00 0.63 0.00 0.00 28.75 30.45 2gir h GLU 230 CO 0.45 0.32 -0.02 -0.97 -0.73 0.00 0.00 179.01 178.06 2gir h ASN 231 N 0.50 -0.31 -0.81 1.04 -0.73 -1.97 -0.62 115.58 112.69 2gir h ASN 231 Ca 0.29 0.15 0.00 0.00 1.87 0.00 0.00 56.30 58.62 2gir h ASN 231 Cb 0.29 0.27 -0.04 0.00 0.27 0.00 0.00 38.32 39.12 2gir h ASN 231 CO -0.25 -0.12 0.52 0.44 -0.37 0.00 0.00 177.43 177.65 2gir h ASP 232 N 0.09 0.95 0.09 1.15 3.32 -1.69 0.51 116.42 120.84 2gir h ASP 232 Ca 0.30 -0.04 -0.21 0.00 0.02 0.00 0.00 57.03 57.10 2gir h ASP 232 Cb 0.47 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2gir h ASP 232 CO -0.51 0.71 -0.77 0.40 -1.72 0.00 0.00 179.24 177.34 2gir h ILE 233 N 1.10 1.34 -0.66 0.35 2.04 -0.83 -0.10 117.51 120.76 2gir h ILE 233 Ca 0.29 -2.09 -0.08 0.00 1.00 0.00 0.00 64.86 63.98 2gir h ILE 233 Cb -0.09 2.08 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 2gir h ILE 233 CO -0.06 0.64 0.11 0.03 0.00 0.00 0.00 178.15 178.87 2gir h ARG 234 N 0.39 1.07 -0.50 2.37 3.08 -0.85 -1.41 114.38 118.54 2gir h ARG 234 Ca -0.05 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.72 2gir h ARG 234 Cb 1.38 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 31.27 2gir h ARG 234 CO 0.14 0.98 0.29 0.28 -1.07 0.00 0.00 179.97 180.60 2gir h VAL 235 N 1.01 1.16 -0.35 2.04 2.07 -0.61 0.15 116.25 121.71 2gir h VAL 235 Ca 0.20 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.40 2gir h VAL 235 Cb 0.43 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 2gir h VAL 235 CO 0.01 0.16 0.06 -0.33 0.02 0.00 0.00 177.57 177.49 2gir h GLU 236 N 0.67 0.17 -0.87 1.57 5.08 -0.84 -1.55 114.58 118.79 2gir h GLU 236 Ca 0.18 -0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.59 2gir h GLU 236 Cb 0.01 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.16 2gir h GLU 236 CO -0.03 0.11 0.54 1.49 -1.00 0.00 0.00 179.01 180.12 2gir h GLU 237 N 0.17 0.95 -0.53 2.33 4.81 -0.74 -0.97 114.58 120.61 2gir h GLU 237 Ca 0.17 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.33 2gir h GLU 237 Cb 0.20 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 2gir h GLU 237 CO -0.23 0.63 0.30 0.66 -0.73 0.00 0.00 179.01 179.64 2gir h SER 238 N 0.98 0.63 -0.13 1.04 4.64 0.16 -1.14 113.55 119.73 2gir h SER 238 Ca 0.38 -0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.63 2gir h SER 238 Cb 0.19 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2gir h SER 238 CO -0.18 0.50 -0.06 0.40 -0.87 0.00 0.00 176.83 176.62 2gir h ILE 239 N 0.73 1.32 -0.84 0.95 2.04 -0.38 -2.87 117.51 118.45 2gir h ILE 239 Ca 0.19 -1.09 0.10 0.00 1.00 0.00 0.00 64.86 65.05 2gir h ILE 239 Cb -0.00 1.77 -0.07 0.00 -0.74 0.00 0.00 36.82 37.77 2gir h ILE 239 CO -0.03 0.32 0.48 1.88 0.00 0.00 0.00 178.15 180.80 2gir h TYR 240 N -0.07 0.88 0.00 1.37 0.05 -0.68 -1.09 116.97 117.43 2gir h TYR 240 Ca 0.03 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.84 2gir h TYR 240 Cb 0.53 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 38.00 2gir h TYR 240 CO 0.07 0.35 0.00 1.04 -1.05 0.00 0.00 178.16 178.57 2gir n GLN 241 N -4.74 0.06 0.22 4.88 1.13 -0.48 -2.03 117.38 116.43 2gir n GLN 241 Ca 0.14 0.24 0.07 0.00 -1.94 0.00 0.00 57.00 55.52 2gir n GLN 241 Cb 0.29 -1.60 0.53 0.00 0.11 0.00 0.00 30.24 29.57 2gir n GLN 241 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2gir s ASP 244 N -2.72 6.30 0.19 0.00 -1.08 0.35 -4.98 116.67 114.72 2gir s ASP 244 Ca 0.67 -0.39 0.10 0.00 -0.52 0.00 0.00 52.55 52.41 2gir s ASP 244 Cb -0.23 -2.48 -0.04 0.00 -1.46 0.00 0.00 42.92 38.71 2gir s ASP 244 CO 0.55 -1.45 -0.20 -0.76 0.52 0.00 0.00 175.17 173.82 2gir s LEU 245 N 4.57 2.45 0.54 -1.34 1.43 -1.26 -1.68 118.68 123.39 2gir s LEU 245 Ca 0.33 -0.88 -0.21 0.00 -1.03 0.00 0.00 54.13 52.34 2gir s LEU 245 Cb -0.11 -0.97 -0.05 0.00 0.03 0.00 0.00 46.19 45.08 2gir s LEU 245 CO 0.18 0.03 1.25 0.00 0.23 0.00 0.00 176.35 178.03 2gir s ALA 246 N -1.96 2.75 0.34 4.21 0.00 -1.26 -4.85 121.76 120.98 2gir s ALA 246 Ca 0.19 1.10 0.09 0.00 0.00 0.00 0.00 51.96 53.34 2gir s ALA 246 Cb -0.06 -3.47 0.83 0.00 0.00 0.00 0.00 23.12 20.42 2gir s ALA 246 CO 0.08 -1.10 1.80 -1.35 0.00 0.00 0.00 175.76 175.20 2gir h PRO 247 N 1.38 0.65 -0.48 0.00 0.11 -2.00 -1.12 132.00 130.54 2gir h PRO 247 Ca -0.50 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.44 2gir h PRO 247 Cb 1.29 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 2gir h PRO 247 CO 0.57 0.43 -0.22 1.49 -0.21 0.00 0.00 178.00 180.07 2gir h GLU 248 N 0.67 0.99 -0.38 1.05 4.81 -2.00 -2.31 114.58 117.41 2gir h GLU 248 Ca 0.54 -0.42 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2gir h GLU 248 Cb 0.96 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 2gir h GLU 248 CO -0.31 1.09 0.17 0.00 -0.73 0.00 0.00 179.01 179.23 2gir h ALA 249 N 0.89 0.49 -0.96 2.92 0.00 -1.61 -1.04 119.26 119.95 2gir h ALA 249 Ca 0.11 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2gir h ALA 249 Cb 0.79 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.36 2gir h ALA 249 CO 0.07 0.08 0.61 0.00 0.00 0.00 0.00 179.25 180.00 2gir h ARG 250 N 0.47 1.06 -0.21 0.00 3.08 -1.10 -0.06 114.38 117.61 2gir h ARG 250 Ca 0.13 -0.06 -0.13 0.00 0.07 0.00 0.00 59.98 59.99 2gir h ARG 250 Cb 0.15 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 2gir h ARG 250 CO -0.01 0.70 -0.36 0.37 -1.07 0.00 0.00 179.97 179.60 2gir h GLN 251 N 1.09 0.62 -0.68 0.04 5.75 -1.17 -1.45 115.11 119.31 2gir h GLN 251 Ca 0.43 -0.38 -0.03 0.00 -0.15 0.00 0.00 58.65 58.52 2gir h GLN 251 Cb 0.22 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.77 2gir h GLN 251 CO -0.19 0.99 0.32 0.00 -2.65 0.00 0.00 178.83 177.30 2gir h ALA 252 N 0.62 1.29 -0.23 3.38 0.00 -0.81 -0.81 119.26 122.69 2gir h ALA 252 Ca 0.01 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 2gir h ALA 252 Cb 0.95 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2gir h ALA 252 CO 0.08 0.55 -0.19 0.82 0.00 0.00 0.00 179.25 180.51 2gir h ILE 253 N 0.96 1.32 -0.12 0.00 2.04 -0.90 0.43 117.51 121.23 2gir h ILE 253 Ca 0.23 -1.32 0.03 0.00 1.00 0.00 0.00 64.86 64.80 2gir h ILE 253 Cb 0.11 1.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 2gir h ILE 253 CO -0.03 0.41 -0.07 0.50 0.00 0.00 0.00 178.15 178.97 2gir h LYS 254 N 0.24 -0.06 0.01 2.37 3.64 -1.15 -0.84 116.57 120.78 2gir h LYS 254 Ca 0.04 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 2gir h LYS 254 Cb 0.72 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 2gir h LYS 254 CO 0.05 -0.04 -0.06 1.03 -2.27 0.00 0.00 179.45 178.16 2gir h SER 255 N -0.06 -0.17 -0.60 4.20 0.87 -1.05 -0.92 113.55 115.83 2gir h SER 255 Ca 0.07 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 2gir h SER 255 Cb 0.16 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.17 2gir h SER 255 CO -0.16 -0.09 0.26 -0.07 -0.53 0.00 0.00 176.83 176.24 2gir h LEU 256 N -0.11 0.84 0.15 2.23 3.38 -0.86 0.15 115.31 121.09 2gir h LEU 256 Ca 0.02 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2gir h LEU 256 Cb 0.14 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2gir h LEU 256 CO -0.06 0.75 -0.07 0.74 0.09 0.00 0.00 178.44 179.89 2gir h THR 257 N 0.91 0.89 -0.39 0.22 2.02 -0.80 0.12 112.91 115.87 2gir h THR 257 Ca 0.21 -0.13 -0.11 0.00 0.77 0.00 0.00 66.41 67.15 2gir h THR 257 Cb 0.17 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 2gir h THR 257 CO -0.02 0.03 -0.22 -0.33 0.37 0.00 0.00 175.52 175.35 2gir h GLU 258 N -0.26 0.78 0.00 6.66 4.39 -0.81 -1.18 114.58 124.16 2gir h GLU 258 Ca -0.02 -0.31 -0.22 0.00 0.34 0.00 0.00 59.36 59.15 2gir h GLU 258 Cb 0.20 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.78 2gir h GLU 258 CO 0.03 0.92 -1.89 0.54 -1.16 0.00 0.00 179.01 177.45 2gir n ARG 259 N -4.11 0.65 0.04 2.33 1.74 0.50 -4.66 116.66 113.15 2gir n ARG 259 Ca 0.00 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.15 2gir n ARG 259 Cb 0.43 -1.65 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 2gir n ARG 259 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2gir n LEU 260 N -2.74 0.39 -0.14 0.55 7.94 0.08 -0.36 117.00 122.72 2gir n LEU 260 Ca -0.18 0.13 -0.09 0.00 -1.11 0.00 0.00 56.01 54.76 2gir n LEU 260 Cb 0.93 -0.06 0.04 0.00 0.53 0.00 0.00 43.42 44.86 2gir n LEU 260 CO 0.44 -0.48 0.71 1.88 -1.11 0.00 0.00 177.39 178.83 2gir h TYR 261 N 0.00 1.04 0.00 1.96 0.05 -0.74 -2.81 116.97 116.47 2gir h TYR 261 Ca 0.00 -0.23 -0.08 0.00 0.05 0.00 0.00 58.73 58.47 2gir h TYR 261 Cb 0.33 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 2gir h TYR 261 CO 0.00 1.02 -0.37 0.82 -1.05 0.00 0.00 178.16 178.58 2gir h ILE 262 N 0.81 1.04 0.00 -2.88 2.04 -1.46 -3.41 117.51 113.63 2gir h ILE 262 Ca 0.11 -1.36 0.00 0.00 1.00 0.00 0.00 64.86 64.61 2gir h ILE 262 Cb 0.73 1.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 2gir h ILE 262 CO 0.06 0.36 0.00 0.61 0.00 0.00 0.00 178.15 179.18 2gir n GLY 263 N -0.14 -0.45 0.00 5.37 0.00 -1.06 -4.02 105.19 104.89 2gir n GLY 263 Ca -0.01 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.75 2gir n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gir n GLY 264 N -0.90 1.00 3.78 -0.02 0.00 -0.61 -4.16 105.19 104.28 2gir n GLY 264 Ca 0.00 -1.17 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 2gir n GLY 264 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gir s PRO 265 N -2.00 3.78 -0.18 1.61 0.04 -1.26 -1.25 135.00 135.74 2gir s PRO 265 Ca 0.00 1.66 -0.02 0.00 0.04 0.00 0.00 61.00 62.68 2gir s PRO 265 Cb 0.00 -2.35 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 2gir s PRO 265 CO 0.00 -0.50 -0.08 -0.51 0.04 0.00 0.00 177.00 175.95 2gir s LEU 266 N -3.10 2.83 -0.05 -3.56 1.43 0.12 -2.45 118.68 113.90 2gir s LEU 266 Ca 0.64 -0.36 0.06 0.00 -1.03 0.00 0.00 54.13 53.44 2gir s LEU 266 Cb -0.26 -1.69 -0.01 0.00 0.03 0.00 0.00 46.19 44.26 2gir s LEU 266 CO 0.31 0.06 -0.24 -0.89 0.23 0.00 0.00 176.35 175.82 2gir s THR 267 N 0.99 2.15 0.87 5.49 2.01 -0.15 0.08 115.64 127.07 2gir s THR 267 Ca -0.01 -1.04 -0.11 0.00 0.31 0.00 0.00 61.69 60.84 2gir s THR 267 Cb -0.15 -1.77 0.16 0.00 0.01 0.00 0.00 72.50 70.74 2gir s THR 267 CO -0.00 0.57 1.20 0.54 -0.69 0.00 0.00 174.62 176.24 2gir s ASN 268 N -0.28 3.72 0.43 3.53 2.20 -0.36 -0.75 114.94 123.42 2gir s ASN 268 Ca 0.00 0.22 0.30 0.00 -0.94 0.00 0.00 52.86 52.44 2gir s ASN 268 Cb -0.13 -0.45 1.36 0.00 -2.00 0.00 0.00 41.25 40.04 2gir s ASN 268 CO 0.03 -2.33 1.89 0.77 -2.94 0.00 0.00 177.10 174.51 2gir h SER 269 N -1.23 0.00 1.11 3.54 4.64 -1.76 -0.81 113.55 119.04 2gir h SER 269 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2gir h SER 269 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2gir h SER 269 CO 0.44 0.00 -0.25 0.29 -0.87 0.00 0.00 176.83 176.44 2gir n LYS 270 N -2.64 0.21 -0.32 4.77 5.02 -1.26 -4.95 118.16 118.98 2gir n LYS 270 Ca 0.00 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 2gir n LYS 270 Cb 0.20 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 2gir n LYS 270 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gir n GLY 271 N 1.37 0.83 3.82 0.72 0.00 -0.31 -5.08 105.19 106.53 2gir n GLY 271 Ca 0.05 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 2gir n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2gir s GLN 272 N -0.67 4.25 -0.08 1.61 -0.21 -1.26 -4.84 119.66 118.46 2gir s GLN 272 Ca 0.00 0.91 -0.30 0.00 0.02 0.00 0.00 55.36 56.00 2gir s GLN 272 Cb 0.00 -2.74 -0.04 0.00 1.00 0.00 0.00 33.01 31.24 2gir s GLN 272 CO 0.00 0.31 1.36 1.21 -2.12 0.00 0.00 175.29 176.05 2gir s ASN 273 N -1.80 6.88 -0.04 5.90 3.04 -1.26 -1.23 114.94 126.44 2gir s ASN 273 Ca 0.47 1.93 0.20 0.00 0.04 0.00 0.00 52.86 55.50 2gir s ASN 273 Cb -0.15 -2.55 -0.24 0.00 -1.54 0.00 0.00 41.25 36.78 2gir s ASN 273 CO 0.20 -0.75 0.49 0.00 -3.04 0.00 0.00 177.10 174.00 2gir n GLY 275 N 1.42 -0.20 3.01 0.00 0.00 -1.16 -1.14 105.19 107.13 2gir n GLY 275 Ca -0.13 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 2gir n GLY 275 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2gir s TYR 276 N -3.87 -0.25 -0.15 1.61 5.04 0.28 -0.71 117.35 119.31 2gir s TYR 276 Ca 0.00 0.62 -0.09 0.00 -2.44 0.00 0.00 57.07 55.17 2gir s TYR 276 Cb 0.00 0.01 -0.04 0.00 0.35 0.00 0.00 41.96 42.27 2gir s TYR 276 CO 0.00 -0.18 0.15 0.50 -1.34 0.00 0.00 175.55 174.68 2gir s ARG 277 N 1.00 3.78 -0.17 4.97 3.52 -0.38 -1.11 118.95 130.56 2gir s ARG 277 Ca -0.07 -0.14 0.16 0.00 -0.13 0.00 0.00 55.73 55.54 2gir s ARG 277 Cb -0.09 -3.29 0.44 0.00 -1.56 0.00 0.00 34.95 30.45 2gir s ARG 277 CO -0.06 0.57 1.19 0.54 -0.81 0.00 0.00 175.30 176.73 2gir n ARG 278 N 2.65 1.46 -2.39 5.12 1.74 0.06 -1.57 116.66 123.73 2gir n ARG 278 Ca -0.18 -3.09 -0.04 0.00 -0.77 0.00 0.00 57.85 53.78 2gir n ARG 278 Cb 0.54 -1.26 -0.01 0.00 -1.02 0.00 0.00 32.46 30.70 2gir n ARG 278 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gir n ARG 280 N -0.13 2.76 -2.49 0.00 3.00 -0.96 -4.58 116.66 114.27 2gir n ARG 280 Ca 0.01 1.00 -0.42 0.00 -0.00 0.00 0.00 57.85 58.44 2gir n ARG 280 Cb 0.12 -2.85 -0.03 0.00 0.00 0.00 0.00 32.46 29.70 2gir n ARG 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2gir s ALA 281 N 1.36 3.35 -0.55 5.13 0.00 -1.26 -4.76 121.76 125.02 2gir s ALA 281 Ca 0.76 0.79 0.26 0.00 0.00 0.00 0.00 51.96 53.77 2gir s ALA 281 Cb -0.51 -3.41 0.87 0.00 0.00 0.00 0.00 23.12 20.07 2gir s ALA 281 CO 0.33 -0.36 1.76 0.66 0.00 0.00 0.00 175.76 178.15 2gir h SER 282 N 6.51 0.00 -1.06 0.00 4.64 -1.90 -3.36 113.55 118.39 2gir h SER 282 Ca -0.42 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.38 2gir h SER 282 Cb 1.21 0.00 -0.42 0.00 -0.31 0.00 0.00 62.40 62.88 2gir h SER 282 CO 0.79 0.00 -0.85 0.61 -0.87 0.00 0.00 176.83 176.51 2gir n GLY 283 N 0.74 5.31 3.55 -0.77 0.00 0.52 -4.31 105.19 110.23 2gir n GLY 283 Ca 0.04 -2.42 -0.26 0.00 0.00 0.00 0.00 46.02 43.38 2gir n GLY 283 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gir s VAL 284 N -4.76 2.11 0.33 1.61 -7.23 -1.16 -4.37 120.40 106.92 2gir s VAL 284 Ca 0.45 -2.14 0.01 0.00 -1.81 0.00 0.00 61.98 58.49 2gir s VAL 284 Cb 0.40 -2.73 0.24 0.00 0.56 0.00 0.00 36.38 34.86 2gir s VAL 284 CO -0.06 -0.15 1.97 0.25 -0.31 0.00 0.00 175.10 176.80 2gir h LEU 285 N 1.98 0.78 -0.48 1.32 5.85 -1.80 -2.39 115.31 120.57 2gir h LEU 285 Ca -0.42 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2gir h LEU 285 Cb 1.25 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.08 2gir h LEU 285 CO 0.73 0.60 0.00 0.35 -0.34 0.00 0.00 178.44 179.78 2gir n THR 286 N -4.40 0.09 0.11 1.05 -2.24 -1.26 -4.27 114.28 103.35 2gir n THR 286 Ca 0.07 -0.15 -0.12 0.00 -2.27 0.00 0.00 64.05 61.57 2gir n THR 286 Cb 0.07 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.24 2gir n THR 286 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2gir h THR 287 N 0.94 0.62 0.20 4.28 2.02 -1.68 0.25 112.91 119.54 2gir h THR 287 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2gir h THR 287 Cb 0.21 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2gir h THR 287 CO 0.00 0.00 -0.10 -1.28 0.37 0.00 0.00 175.52 174.51 2gir h SER 288 N -0.34 -0.23 -0.51 4.18 0.87 -1.74 -1.31 113.55 114.47 2gir h SER 288 Ca 0.02 -0.27 -0.03 0.00 -1.23 0.00 0.00 61.79 60.28 2gir h SER 288 Cb 0.34 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.34 2gir h SER 288 CO -0.08 0.18 0.20 0.00 -0.53 0.00 0.00 176.83 176.61 2gir h GLY 290 N 0.69 0.14 1.04 0.00 0.00 -0.57 -0.69 103.07 103.68 2gir h GLY 290 Ca 0.17 0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.49 2gir h GLY 290 CO -0.01 -0.04 0.36 3.43 0.00 0.00 0.00 176.54 180.28 2gir h ASN 291 N 0.03 1.09 -0.15 0.19 2.35 -0.99 -1.11 115.58 116.99 2gir h ASN 291 Ca 0.08 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 2gir h ASN 291 Cb 0.10 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 2gir h ASN 291 CO -0.14 0.94 0.05 0.74 -1.65 0.00 0.00 177.43 177.37 2gir h THR 292 N 1.16 1.18 -0.22 2.81 2.02 -0.56 0.30 112.91 119.60 2gir h THR 292 Ca 0.27 -0.55 -0.00 0.00 0.77 0.00 0.00 66.41 66.90 2gir h THR 292 Cb 0.16 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 2gir h THR 292 CO -0.03 0.17 0.13 -0.07 0.37 0.00 0.00 175.52 176.09 2gir h LEU 293 N 0.07 0.27 -0.42 2.58 3.38 -1.01 -0.03 115.31 120.15 2gir h LEU 293 Ca 0.05 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 2gir h LEU 293 Cb 0.22 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2gir h LEU 293 CO -0.00 0.25 -0.41 0.74 0.09 0.00 0.00 178.44 179.11 2gir h THR 294 N 0.27 1.28 -0.42 0.22 2.02 -1.10 0.86 112.91 116.02 2gir h THR 294 Ca 0.08 -1.59 -0.02 0.00 0.77 0.00 0.00 66.41 65.65 2gir h THR 294 Cb 0.03 1.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 2gir h THR 294 CO -0.01 0.53 0.18 0.00 0.37 0.00 0.00 175.52 176.58 2gir h TYR 296 N 0.54 0.59 0.43 0.00 5.03 -0.77 0.32 116.97 123.10 2gir h TYR 296 Ca 0.14 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.44 2gir h TYR 296 Cb 0.17 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 38.26 2gir h TYR 296 CO -0.00 0.39 -0.23 1.25 -1.32 0.00 0.00 178.16 178.25 2gir h LEU 297 N 0.62 -0.55 -0.52 2.82 5.85 -0.64 0.88 115.31 123.77 2gir h LEU 297 Ca 0.17 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 2gir h LEU 297 Cb -0.04 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 2gir h LEU 297 CO -0.03 -0.38 0.15 0.11 -0.34 0.00 0.00 178.44 177.95 2gir h LYS 298 N -0.61 0.82 -0.45 1.25 1.57 -1.11 -2.22 116.57 115.83 2gir h LYS 298 Ca -0.05 -0.19 -0.09 0.00 -1.87 0.00 0.00 60.65 58.45 2gir h LYS 298 Cb 0.48 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2gir h LYS 298 CO 0.08 0.77 -0.08 0.00 -0.57 0.00 0.00 179.45 179.64 2gir h ALA 299 N 1.01 0.61 -0.67 3.86 0.00 -0.88 0.17 119.26 123.36 2gir h ALA 299 Ca 0.17 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2gir h ALA 299 Cb 0.30 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2gir h ALA 299 CO -0.00 0.48 0.33 0.77 0.00 0.00 0.00 179.25 180.83 2gir h SER 300 N 0.68 0.87 -0.61 0.00 0.02 -0.77 0.37 113.55 114.11 2gir h SER 300 Ca 0.12 -0.12 -0.08 0.00 -0.84 0.00 0.00 61.79 60.86 2gir h SER 300 Cb 0.62 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.91 2gir h SER 300 CO 0.04 0.75 0.07 0.00 -1.14 0.00 0.00 176.83 176.55 2gir h ALA 301 N 1.16 0.81 -0.46 3.77 0.00 -1.22 -2.71 119.26 120.61 2gir h ALA 301 Ca 0.23 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 2gir h ALA 301 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2gir h ALA 301 CO -0.03 0.59 -0.09 0.00 0.00 0.00 0.00 179.25 179.72 2gir h ALA 302 N 1.01 0.98 -0.70 0.00 0.00 -0.63 -0.70 119.26 119.22 2gir h ALA 302 Ca 0.18 -0.31 0.10 0.00 0.00 0.00 0.00 54.91 54.88 2gir h ALA 302 Cb 0.46 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 2gir h ALA 302 CO 0.02 0.61 0.32 0.00 0.00 0.00 0.00 179.25 180.20 2gir h ARG 304 N 0.53 0.79 -0.68 0.00 3.08 -1.13 -0.84 114.38 116.13 2gir h ARG 304 Ca 0.36 -0.40 0.03 0.00 0.07 0.00 0.00 59.98 60.03 2gir h ARG 304 Cb 0.43 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 2gir h ARG 304 CO -0.30 1.03 0.43 0.00 -1.07 0.00 0.00 179.97 180.05 2gir h ALA 305 N 0.75 0.89 0.00 0.04 0.00 -0.72 -2.31 119.26 117.90 2gir h ALA 305 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2gir h ALA 305 Cb 0.86 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2gir h ALA 305 CO 0.07 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.52 2gir n ALA 306 N -2.31 2.36 -3.24 0.00 0.00 0.73 -4.91 120.51 113.13 2gir n ALA 306 Ca 0.07 -0.12 -0.23 0.00 0.00 0.00 0.00 53.44 53.15 2gir n ALA 306 Cb 0.08 -1.45 0.04 0.00 0.00 0.00 0.00 19.45 18.12 2gir n ALA 306 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2gir n LYS 307 N -1.34 -5.34 -2.06 0.00 4.76 -0.40 -4.89 118.16 108.89 2gir n LYS 307 Ca 0.12 0.81 -0.41 0.00 -2.87 0.00 0.00 58.31 55.96 2gir n LYS 307 Cb 0.25 -5.70 -0.03 0.00 -1.84 0.00 0.00 35.03 27.71 2gir n LYS 307 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2gir s LEU 308 N -6.83 4.39 -0.19 -0.35 1.02 -0.73 -4.97 118.68 111.02 2gir s LEU 308 Ca 0.40 2.59 -0.19 0.00 0.02 0.00 0.00 54.13 56.96 2gir s LEU 308 Cb -0.18 -3.62 -0.03 0.00 0.02 0.00 0.00 46.19 42.38 2gir s LEU 308 CO 0.49 -0.66 0.53 -1.10 0.02 0.00 0.00 176.35 175.63 2gir s GLN 309 N -0.20 4.20 -1.16 1.70 -1.52 -1.26 -4.32 119.66 117.10 2gir s GLN 309 Ca 0.59 0.44 -0.14 0.00 -1.95 0.00 0.00 55.36 54.30 2gir s GLN 309 Cb -0.41 -3.55 -0.02 0.00 -0.22 0.00 0.00 33.01 28.81 2gir s GLN 309 CO 0.41 -0.14 0.78 -3.47 -0.25 0.00 0.00 175.29 172.62 2gir n ASP 310 N 4.74 -4.63 -4.73 5.90 -0.08 -1.26 -0.81 116.55 115.68 2gir n ASP 310 Ca -0.04 -0.93 -0.42 0.00 -1.51 0.00 0.00 54.79 51.89 2gir n ASP 310 Cb 0.50 -3.79 -0.03 0.00 2.34 0.00 0.00 41.12 40.15 2gir n ASP 310 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2gir s THR 312 N 0.45 1.95 0.09 0.00 2.01 0.33 -5.00 115.64 115.46 2gir s THR 312 Ca 0.59 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.71 2gir s THR 312 Cb -0.36 -1.74 -0.04 0.00 0.01 0.00 0.00 72.50 70.38 2gir s THR 312 CO 0.35 0.53 0.10 -0.04 -0.69 0.00 0.00 174.62 174.87 2gir s MET 313 N 0.93 2.93 -0.10 4.92 -1.94 -1.26 -1.02 119.30 123.76 2gir s MET 313 Ca -0.05 -0.69 -0.01 0.00 -1.71 0.00 0.00 55.69 53.23 2gir s MET 313 Cb -0.15 -2.74 0.03 0.00 2.01 0.00 0.00 34.83 33.97 2gir s MET 313 CO -0.04 0.56 -0.04 -1.17 -0.01 0.00 0.00 175.02 174.33 2gir s LEU 314 N -2.49 0.90 -0.08 -0.03 2.96 0.07 -4.24 118.68 115.78 2gir s LEU 314 Ca 0.30 -0.21 0.02 0.00 -0.22 0.00 0.00 54.13 54.02 2gir s LEU 314 Cb -0.12 -0.64 0.01 0.00 0.50 0.00 0.00 46.19 45.94 2gir s LEU 314 CO 0.23 -0.16 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.27 2gir s VAL 315 N 1.84 1.30 -0.31 1.68 1.01 -0.21 -1.21 120.40 124.50 2gir s VAL 315 Ca 0.05 -0.56 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 2gir s VAL 315 Cb -0.13 -1.19 0.10 0.00 0.00 0.00 0.00 36.38 35.17 2gir s VAL 315 CO -0.07 0.40 0.10 0.20 0.00 0.00 0.00 175.10 175.73 2gir s ASN 316 N 0.75 3.94 1.48 3.32 -0.87 -0.44 -0.40 114.94 122.71 2gir s ASN 316 Ca -0.12 -1.58 0.00 0.00 -1.57 0.00 0.00 52.86 49.58 2gir s ASN 316 Cb -0.16 -0.77 0.00 0.00 -0.02 0.00 0.00 41.25 40.30 2gir s ASN 316 CO 0.03 -0.42 0.00 0.61 -2.57 0.00 0.00 177.10 174.75 2gir n GLY 317 N 4.91 3.55 0.22 0.66 0.00 -1.26 -1.07 105.19 112.20 2gir n GLY 317 Ca -0.03 0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.16 2gir n GLY 317 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2gir n ASP 318 N 5.39 0.65 -4.70 1.61 5.75 -1.26 -3.85 116.55 120.14 2gir n ASP 318 Ca 0.00 -1.47 -0.37 0.00 -0.01 0.00 0.00 54.79 52.94 2gir n ASP 318 Cb 0.00 -0.03 -0.08 0.00 -1.03 0.00 0.00 41.12 39.98 2gir n ASP 318 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2gir s ASP 319 N -1.66 6.38 -0.05 -1.12 -1.08 -0.23 -4.64 116.67 114.27 2gir s ASP 319 Ca 0.32 0.44 0.00 0.00 -0.52 0.00 0.00 52.55 52.80 2gir s ASP 319 Cb 0.16 -2.18 0.02 0.00 -1.46 0.00 0.00 42.92 39.46 2gir s ASP 319 CO 0.26 0.04 -0.03 -0.22 0.52 0.00 0.00 175.17 175.74 2gir s LEU 320 N 0.81 1.16 -0.03 -1.34 2.96 -1.26 -1.33 118.68 119.65 2gir s LEU 320 Ca 0.16 -0.11 0.07 0.00 -0.22 0.00 0.00 54.13 54.03 2gir s LEU 320 Cb -0.13 -0.42 -0.02 0.00 0.50 0.00 0.00 46.19 46.12 2gir s LEU 320 CO 0.05 -0.09 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.06 2gir s VAL 321 N 1.15 1.93 -0.07 1.68 1.01 -0.35 -1.80 120.40 123.95 2gir s VAL 321 Ca -0.08 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 60.90 2gir s VAL 321 Cb -0.14 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.64 2gir s VAL 321 CO -0.01 0.54 -0.17 -0.69 0.00 0.00 0.00 175.10 174.77 2gir s VAL 322 N -0.46 1.52 -0.13 2.92 1.01 0.29 -0.75 120.40 124.81 2gir s VAL 322 Ca 0.06 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.34 2gir s VAL 322 Cb -0.10 -1.34 -0.00 0.00 0.00 0.00 0.00 36.38 34.93 2gir s VAL 322 CO 0.00 0.44 -0.18 -0.63 0.00 0.00 0.00 175.10 174.73 2gir s ILE 323 N 0.43 2.51 0.29 2.22 1.01 -0.19 -0.68 121.20 126.78 2gir s ILE 323 Ca -0.14 -0.84 0.03 0.00 0.00 0.00 0.00 60.65 59.70 2gir s ILE 323 Cb -0.16 -2.02 -0.01 0.00 0.01 0.00 0.00 42.46 40.28 2gir s ILE 323 CO 0.05 0.54 0.31 0.00 0.00 0.00 0.00 174.94 175.84 2gir s GLU 325 N -2.93 4.68 0.28 0.00 0.41 0.01 -1.11 118.70 120.05 2gir s GLU 325 Ca 0.29 1.50 -0.29 0.00 -0.41 0.00 0.00 54.97 56.07 2gir s GLU 325 Cb 0.01 -3.36 -0.09 0.00 -1.78 0.00 0.00 34.13 28.90 2gir s GLU 325 CO 0.21 0.19 1.00 0.45 -0.49 0.00 0.00 175.26 176.63 2gir s SER 326 N -0.04 7.39 -0.34 -0.19 0.15 0.10 -4.54 113.70 116.23 2gir s SER 326 Ca 0.47 2.05 0.08 0.00 0.70 0.00 0.00 55.95 59.25 2gir s SER 326 Cb -0.24 -2.61 0.61 0.00 -1.71 0.00 0.00 66.02 62.07 2gir s SER 326 CO 0.31 -0.04 1.68 0.00 1.20 0.00 0.00 173.24 176.39 2gir n ALA 327 N 1.10 4.65 0.00 5.45 0.00 -1.26 -4.90 120.51 125.54 2gir n ALA 327 Ca -0.00 -2.81 0.00 0.00 0.00 0.00 0.00 53.44 50.63 2gir n ALA 327 Cb 0.47 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.85 2gir n ALA 327 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gir n GLY 328 N -0.86 -0.87 0.16 0.00 0.00 -1.26 -4.37 105.19 97.98 2gir n GLY 328 Ca 0.42 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.72 2gir n GLY 328 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2gir h THR 329 N 0.00 1.19 -0.37 2.61 1.35 -1.99 -0.01 112.91 115.70 2gir h THR 329 Ca 0.00 -0.61 -0.14 0.00 -0.55 0.00 0.00 66.41 65.12 2gir h THR 329 Cb 0.00 1.02 -0.01 0.00 -1.73 0.00 0.00 68.15 67.43 2gir h THR 329 CO 0.00 0.21 -0.31 1.56 -0.25 0.00 0.00 175.52 176.73 2gir h GLN 330 N 0.34 0.81 -0.21 4.72 1.08 -2.00 -1.55 115.11 118.30 2gir h GLN 330 Ca 0.10 -0.38 -0.12 0.00 -1.45 0.00 0.00 58.65 56.80 2gir h GLN 330 Cb 0.22 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.64 2gir h GLN 330 CO -0.01 1.01 -0.35 1.49 -0.95 0.00 0.00 178.83 180.02 2gir h GLU 331 N 0.68 0.61 -0.87 1.46 4.57 -1.73 -2.68 114.58 116.61 2gir h GLU 331 Ca 0.07 -0.37 0.09 0.00 -1.18 0.00 0.00 59.36 57.98 2gir h GLU 331 Cb 0.86 0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 29.41 2gir h GLU 331 CO 0.08 0.98 0.52 -0.44 -1.18 0.00 0.00 179.01 178.96 2gir h ASP 332 N 0.29 0.76 -0.52 1.04 3.32 -0.88 0.49 116.42 120.92 2gir h ASP 332 Ca 0.02 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2gir h ASP 332 Cb 0.94 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.36 2gir h ASP 332 CO 0.08 0.44 0.30 0.00 -1.72 0.00 0.00 179.24 178.34 2gir h ALA 333 N 1.46 0.66 -0.37 3.45 0.00 -1.19 -1.26 119.26 122.02 2gir h ALA 333 Ca 0.41 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 2gir h ALA 333 Cb 0.35 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2gir h ALA 333 CO -0.24 0.16 0.17 0.00 0.00 0.00 0.00 179.25 179.34 2gir h ALA 334 N 1.14 0.48 -0.83 0.00 0.00 -1.00 -2.09 119.26 116.96 2gir h ALA 334 Ca 0.18 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.02 2gir h ALA 334 Cb 0.01 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 2gir h ALA 334 CO -0.03 0.05 0.53 0.77 0.00 0.00 0.00 179.25 180.57 2gir h SER 335 N 0.46 0.87 -0.21 0.00 0.02 -0.70 -1.83 113.55 112.16 2gir h SER 335 Ca 0.13 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.99 2gir h SER 335 Cb 0.14 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 2gir h SER 335 CO -0.01 0.59 -0.16 -0.07 -1.14 0.00 0.00 176.83 176.04 2gir h LEU 336 N 1.02 0.61 -0.88 5.07 3.38 -1.02 0.23 115.31 123.72 2gir h LEU 336 Ca 0.34 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 2gir h LEU 336 Cb 0.04 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2gir h LEU 336 CO -0.13 0.79 -0.05 0.03 0.09 0.00 0.00 178.44 179.18 2gir h ARG 337 N 0.56 0.78 -0.18 1.13 3.08 -1.02 0.39 114.38 119.13 2gir h ARG 337 Ca 0.09 -0.23 -0.21 0.00 0.07 0.00 0.00 59.98 59.70 2gir h ARG 337 Cb 0.59 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.57 2gir h ARG 337 CO 0.04 0.82 -0.71 0.28 -1.07 0.00 0.00 179.97 179.33 2gir h VAL 338 N 0.72 1.28 -0.25 2.04 2.07 -0.75 -1.49 116.25 119.86 2gir h VAL 338 Ca 0.13 -1.91 0.06 0.00 0.82 0.00 0.00 66.70 65.80 2gir h VAL 338 Cb 0.51 1.93 -0.06 0.00 -1.52 0.00 0.00 31.29 32.15 2gir h VAL 338 CO 0.03 0.61 -0.11 0.15 0.02 0.00 0.00 177.57 178.27 2gir h PHE 339 N 0.53 -0.25 -0.90 1.57 3.57 -0.42 -0.93 116.94 120.11 2gir h PHE 339 Ca -0.04 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.50 2gir h PHE 339 Cb 1.34 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 40.18 2gir h PHE 339 CO 0.09 -0.17 0.60 1.15 -2.23 0.00 0.00 178.31 177.75 2gir h THR 340 N -0.06 1.21 -0.63 4.41 2.02 -0.79 -0.53 112.91 118.54 2gir h THR 340 Ca 0.13 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.90 2gir h THR 340 Cb 0.26 -0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.54 2gir h THR 340 CO -0.30 0.22 0.40 -0.33 0.37 0.00 0.00 175.52 175.88 2gir h GLU 341 N 1.21 0.84 -0.18 6.66 5.08 -0.91 0.33 114.58 127.60 2gir h GLU 341 Ca 0.34 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.61 2gir h GLU 341 Cb -0.11 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 28.95 2gir h GLU 341 CO -0.08 0.58 0.03 0.00 -1.00 0.00 0.00 179.01 178.54 2gir h ALA 342 N 1.21 0.24 -0.77 3.43 0.00 -0.63 -1.49 119.26 121.25 2gir h ALA 342 Ca 0.23 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.05 2gir h ALA 342 Cb -0.06 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 2gir h ALA 342 CO -0.05 -0.10 0.44 0.52 0.00 0.00 0.00 179.25 180.07 2gir h MET 343 N 0.10 0.77 -0.51 0.00 2.86 -0.92 -1.56 114.93 115.66 2gir h MET 343 Ca 0.06 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2gir h MET 343 Cb 0.30 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 2gir h MET 343 CO 0.00 0.51 0.31 1.15 1.06 0.00 0.00 176.91 179.94 2gir h THR 344 N 0.79 1.15 -0.27 2.22 2.02 -0.72 0.13 112.91 118.23 2gir h THR 344 Ca 0.35 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 2gir h THR 344 Cb 0.25 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 2gir h THR 344 CO -0.21 0.15 0.14 0.03 0.37 0.00 0.00 175.52 176.01 2gir h ARG 345 N 0.69 0.36 -0.13 6.66 3.08 -0.55 -0.31 114.38 124.17 2gir h ARG 345 Ca 0.18 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2gir h ARG 345 Cb -0.02 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.95 2gir h ARG 345 CO -0.04 0.27 0.00 0.66 -1.07 0.00 0.00 179.97 179.80 2gir n TYR 346 N -4.46 0.18 -3.00 3.04 4.01 -0.66 -0.94 117.16 115.33 2gir n TYR 346 Ca 0.01 -0.09 -0.13 0.00 -0.16 0.00 0.00 57.90 57.53 2gir n TYR 346 Cb 0.10 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.19 2gir n TYR 346 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2gir n SER 347 N -0.11 -4.78 -3.03 7.72 2.88 -0.13 -4.92 113.62 111.25 2gir n SER 347 Ca 0.09 -0.56 -0.17 0.00 -1.33 0.00 0.00 58.87 56.90 2gir n SER 347 Cb 0.16 -4.34 -0.01 0.00 -0.75 0.00 0.00 64.21 59.27 2gir n SER 347 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2gir n ALA 348 N -3.09 1.07 -1.29 -1.46 0.00 0.35 -4.60 120.51 111.49 2gir n ALA 348 Ca -0.11 -2.72 -0.31 0.00 0.00 0.00 0.00 53.44 50.30 2gir n ALA 348 Cb 0.61 -1.00 0.09 0.00 0.00 0.00 0.00 19.45 19.14 2gir n ALA 348 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2gir s PRO 349 N -0.93 2.33 0.50 0.00 0.04 -1.26 -3.86 135.00 131.82 2gir s PRO 349 Ca 0.34 1.19 -0.18 0.00 0.04 0.00 0.00 61.00 62.39 2gir s PRO 349 Cb 0.25 -1.90 -0.08 0.00 0.04 0.00 0.00 34.50 32.80 2gir s PRO 349 CO -0.12 -1.59 0.98 -1.25 0.04 0.00 0.00 177.00 175.06 2gir s PRO 350 N -4.81 3.97 0.00 0.56 0.04 -1.26 -1.27 135.00 132.23 2gir s PRO 350 Ca 0.62 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.68 2gir s PRO 350 Cb -0.17 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.23 2gir s PRO 350 CO 0.54 -0.25 0.00 0.41 0.04 0.00 0.00 177.00 177.74 2gir n GLY 351 N -1.28 1.54 3.75 0.56 0.00 0.15 -4.24 105.19 105.68 2gir n GLY 351 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 2gir n GLY 351 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gir s ASP 352 N -1.00 7.55 0.30 1.61 1.01 -1.26 -4.95 116.67 119.93 2gir s ASP 352 Ca 0.00 2.01 -0.29 0.00 0.71 0.00 0.00 52.55 54.98 2gir s ASP 352 Cb 0.00 -2.61 -0.10 0.00 1.01 0.00 0.00 42.92 41.22 2gir s ASP 352 CO 0.00 0.08 1.28 -2.16 0.21 0.00 0.00 175.17 174.57 2gir s PRO 353 N -1.14 4.41 0.46 8.23 0.04 -1.26 -4.48 135.00 141.25 2gir s PRO 353 Ca 0.42 2.12 -0.25 0.00 0.04 0.00 0.00 61.00 63.33 2gir s PRO 353 Cb -0.27 -3.11 -0.08 0.00 0.04 0.00 0.00 34.50 31.07 2gir s PRO 353 CO 0.34 -0.14 1.44 -1.25 0.04 0.00 0.00 177.00 177.43 2gir s PRO 354 N -1.38 3.63 -0.09 0.56 0.04 -1.26 -5.02 135.00 131.49 2gir s PRO 354 Ca 0.50 2.45 0.05 0.00 0.04 0.00 0.00 61.00 64.03 2gir s PRO 354 Cb -0.38 -2.63 -0.00 0.00 0.04 0.00 0.00 34.50 31.53 2gir s PRO 354 CO 0.48 -0.87 -0.24 -0.65 0.04 0.00 0.00 177.00 175.75 2gir s GLN 355 N -2.49 2.88 0.25 4.56 -0.21 -1.26 -4.96 119.66 118.43 2gir s GLN 355 Ca 0.62 -0.89 -0.30 0.00 0.02 0.00 0.00 55.36 54.81 2gir s GLN 355 Cb -0.44 -2.25 -0.10 0.00 1.00 0.00 0.00 33.01 31.22 2gir s GLN 355 CO 0.57 0.25 1.35 -2.14 -2.12 0.00 0.00 175.29 173.20 2gir s PRO 356 N 0.17 4.34 0.04 2.91 0.02 -1.26 -4.55 135.00 136.67 2gir s PRO 356 Ca -0.14 2.17 0.08 0.00 0.02 0.00 0.00 61.00 63.13 2gir s PRO 356 Cb -0.17 -3.14 -0.03 0.00 0.02 0.00 0.00 34.50 31.19 2gir s PRO 356 CO 0.07 -0.29 -0.23 -1.21 -0.33 0.00 0.00 177.00 175.01 2gir s GLU 357 N -0.57 1.61 -0.03 5.54 0.41 0.52 -4.97 118.70 121.21 2gir s GLU 357 Ca 0.56 -1.01 0.05 0.00 -0.41 0.00 0.00 54.97 54.16 2gir s GLU 357 Cb -0.39 -1.74 0.08 0.00 -1.78 0.00 0.00 34.13 30.30 2gir s GLU 357 CO 0.43 0.45 1.04 0.66 -0.49 0.00 0.00 175.26 177.35 2gir n TYR 358 N 1.87 0.01 -3.85 1.61 4.01 -1.26 -1.54 117.16 118.01 2gir n TYR 358 Ca -0.17 -0.62 -0.26 0.00 -0.16 0.00 0.00 57.90 56.69 2gir n TYR 358 Cb 0.53 -0.08 -0.17 0.00 -0.31 0.00 0.00 39.34 39.31 2gir n TYR 358 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2gir s ASP 359 N -1.46 2.08 0.47 7.72 -1.08 -1.26 -5.00 116.67 118.13 2gir s ASP 359 Ca 0.08 -0.29 0.12 0.00 -0.52 0.00 0.00 52.55 51.94 2gir s ASP 359 Cb 0.07 -0.70 1.07 0.00 -1.46 0.00 0.00 42.92 41.90 2gir s ASP 359 CO 0.01 -0.16 2.10 0.25 0.52 0.00 0.00 175.17 177.89 2gir h LEU 360 N 8.23 0.22 -1.46 -1.34 5.85 -1.96 -0.82 115.31 124.03 2gir h LEU 360 Ca -0.25 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.46 2gir h LEU 360 Cb 1.13 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.10 2gir h LEU 360 CO 0.35 0.17 0.00 -0.33 -0.34 0.00 0.00 178.44 178.29 2gir h GLU 361 N 0.26 0.00 -0.05 1.25 5.08 -1.97 -2.77 114.58 116.38 2gir h GLU 361 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2gir h GLU 361 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2gir h GLU 361 CO -0.01 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.28 2gir n LEU 362 N -2.69 2.22 -4.62 1.33 4.77 -0.31 -4.55 117.00 113.14 2gir n LEU 362 Ca 0.00 -0.76 -0.39 0.00 -0.03 0.00 0.00 56.01 54.83 2gir n LEU 362 Cb 0.20 -0.02 -0.08 0.00 -2.33 0.00 0.00 43.42 41.20 2gir n LEU 362 CO 0.21 0.38 0.16 -0.63 -1.33 0.00 0.00 177.39 176.18 2gir s ILE 363 N -1.97 5.13 -0.22 -0.08 1.01 -1.05 -5.04 121.20 118.99 2gir s ILE 363 Ca 0.34 0.74 -0.06 0.00 0.00 0.00 0.00 60.65 61.67 2gir s ILE 363 Cb 0.20 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 2gir s ILE 363 CO 0.32 0.14 0.04 -0.89 0.00 0.00 0.00 174.94 174.55 2gir s THR 364 N 2.03 4.24 -0.05 2.92 2.01 -1.26 -4.40 115.64 121.12 2gir s THR 364 Ca 0.19 -0.21 -0.12 0.00 0.31 0.00 0.00 61.69 61.85 2gir s THR 364 Cb -0.16 -2.95 0.02 0.00 0.01 0.00 0.00 72.50 69.43 2gir s THR 364 CO 0.09 0.39 0.29 -0.94 -0.69 0.00 0.00 174.62 173.77 2gir s SER 365 N 1.22 -0.23 -1.51 3.53 1.04 0.20 -4.71 113.70 113.24 2gir s SER 365 Ca 0.04 0.28 -0.14 0.00 0.48 0.00 0.00 55.95 56.61 2gir s SER 365 Cb -0.14 0.44 0.10 0.00 0.10 0.00 0.00 66.02 66.51 2gir s SER 365 CO 0.03 -0.30 0.78 0.00 0.98 0.00 0.00 173.24 174.73 2gir n SER 367 N -2.62 -5.45 -4.22 0.00 7.64 -1.26 -4.94 113.62 102.77 2gir n SER 367 Ca 0.03 0.47 -0.13 0.00 1.01 0.00 0.00 58.87 60.25 2gir n SER 367 Cb 0.52 -4.61 -0.10 0.00 -1.01 0.00 0.00 64.21 59.02 2gir n SER 367 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2gir s SER 368 N -2.74 1.31 0.06 6.43 0.01 -0.55 -4.37 113.70 113.84 2gir s SER 368 Ca 0.00 -1.09 -0.03 0.00 1.31 0.00 0.00 55.95 56.14 2gir s SER 368 Cb 0.00 0.09 -0.03 0.00 0.21 0.00 0.00 66.02 66.29 2gir s SER 368 CO 0.00 -0.49 0.03 0.54 0.41 0.00 0.00 173.24 173.72 2gir s ASN 369 N -3.14 0.39 0.16 2.44 4.22 0.32 -0.63 114.94 118.70 2gir s ASN 369 Ca 0.19 -0.89 -0.30 0.00 -2.14 0.00 0.00 52.86 49.72 2gir s ASN 369 Cb 0.05 0.23 -0.07 0.00 1.28 0.00 0.00 41.25 42.75 2gir s ASN 369 CO 0.01 -0.62 0.99 -0.69 -2.04 0.00 0.00 177.10 174.74 2gir s VAL 370 N -3.83 4.26 0.32 3.54 1.01 -1.26 -0.84 120.40 123.60 2gir s VAL 370 Ca 0.06 1.98 0.06 0.00 0.00 0.00 0.00 61.98 64.08 2gir s VAL 370 Cb 0.07 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 2gir s VAL 370 CO -0.10 0.35 0.25 -0.55 0.00 0.00 0.00 175.10 175.05 2gir s SER 371 N -0.31 1.60 0.01 3.32 0.15 0.05 -4.21 113.70 114.30 2gir s SER 371 Ca 0.46 -1.71 0.05 0.00 0.70 0.00 0.00 55.95 55.45 2gir s SER 371 Cb -0.25 0.53 -0.02 0.00 -1.71 0.00 0.00 66.02 64.57 2gir s SER 371 CO 0.31 -1.03 -0.16 0.54 1.20 0.00 0.00 173.24 174.11 2gir s VAL 372 N -3.51 1.29 0.00 4.45 0.11 -1.26 -1.08 120.40 120.40 2gir s VAL 372 Ca 0.39 -0.82 0.00 0.00 -2.93 0.00 0.00 61.98 58.62 2gir s VAL 372 Cb 0.03 -1.10 0.00 0.00 -1.53 0.00 0.00 36.38 33.78 2gir s VAL 372 CO 0.25 0.27 0.00 0.00 -3.33 0.00 0.00 175.10 172.28 2gir n ALA 373 N 2.41 0.00 -2.42 1.54 0.00 -0.76 -3.03 120.51 118.26 2gir n ALA 373 Ca -0.16 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.01 2gir n ALA 373 Cb 0.54 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.84 2gir n ALA 373 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2gir s HIS 374 N -3.73 1.89 0.37 0.00 3.76 0.16 -0.16 115.29 117.58 2gir s HIS 374 Ca 0.00 -0.36 -0.04 0.00 -0.15 0.00 0.00 55.06 54.51 2gir s HIS 374 Cb 0.00 -1.21 0.08 0.00 1.11 0.00 0.00 32.58 32.56 2gir s HIS 374 CO 0.00 -0.02 0.50 -0.40 -0.85 0.00 0.00 174.74 173.97 2gir n ASP 375 N 2.48 0.31 -0.27 1.40 5.75 -0.41 -0.87 116.55 124.93 2gir n ASP 375 Ca -0.15 -1.35 0.06 0.00 -0.01 0.00 0.00 54.79 53.34 2gir n ASP 375 Cb 0.53 -0.36 0.29 0.00 -1.03 0.00 0.00 41.12 40.55 2gir n ASP 375 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2gir h ALA 376 N -1.22 1.62 0.00 2.12 0.00 -1.91 -0.62 119.26 119.24 2gir h ALA 376 Ca -0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2gir h ALA 376 Cb 0.52 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2gir h ALA 376 CO 0.14 0.23 0.00 -1.13 0.00 0.00 0.00 179.25 178.49 2gir n SER 377 N -4.51 0.00 0.00 0.00 3.41 -1.26 -4.90 113.62 106.37 2gir n SER 377 Ca 0.14 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 2gir n SER 377 Cb 0.26 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 2gir n SER 377 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gir n GLY 378 N 0.95 0.68 3.77 5.00 0.00 -0.24 -5.05 105.19 110.30 2gir n GLY 378 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2gir n GLY 378 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2gir s LYS 379 N -0.64 4.23 0.22 1.61 2.20 -1.26 -4.69 119.74 121.40 2gir s LYS 379 Ca 0.00 2.20 -0.30 0.00 -0.36 0.00 0.00 55.97 57.51 2gir s LYS 379 Cb 0.00 -2.96 -0.09 0.00 -1.51 0.00 0.00 37.83 33.27 2gir s LYS 379 CO 0.00 -0.29 1.31 1.03 -0.36 0.00 0.00 175.35 177.04 2gir s ARG 380 N -1.95 4.38 -0.07 4.03 0.52 -1.26 -1.29 118.95 123.31 2gir s ARG 380 Ca 0.52 2.09 0.00 0.00 -0.52 0.00 0.00 55.73 57.82 2gir s ARG 380 Cb -0.39 -3.17 0.02 0.00 0.52 0.00 0.00 34.95 31.93 2gir s ARG 380 CO 0.52 -0.24 -0.05 0.54 0.02 0.00 0.00 175.30 176.08 2gir s VAL 381 N -0.09 0.71 0.26 3.52 0.11 0.77 -4.91 120.40 120.77 2gir s VAL 381 Ca 0.56 -0.15 -0.29 0.00 -2.93 0.00 0.00 61.98 59.16 2gir s VAL 381 Cb -0.37 -0.75 -0.09 0.00 -1.53 0.00 0.00 36.38 33.63 2gir s VAL 381 CO 0.40 0.29 0.94 -0.31 -3.33 0.00 0.00 175.10 173.10 2gir s TYR 382 N 1.38 3.91 0.17 1.54 2.02 -1.26 -1.83 117.35 123.29 2gir s TYR 382 Ca -0.03 1.89 -0.12 0.00 -0.37 0.00 0.00 57.07 58.43 2gir s TYR 382 Cb -0.13 -2.97 0.01 0.00 -0.40 0.00 0.00 41.96 38.46 2gir s TYR 382 CO -0.03 0.38 0.37 1.52 -1.57 0.00 0.00 175.55 176.23 2gir s TYR 383 N -1.28 0.18 -0.14 2.71 1.13 -0.24 -4.99 117.35 114.72 2gir s TYR 383 Ca 0.43 -0.54 -0.12 0.00 -1.41 0.00 0.00 57.07 55.44 2gir s TYR 383 Cb -0.24 0.12 -0.05 0.00 -1.10 0.00 0.00 41.96 40.69 2gir s TYR 383 CO 0.30 -0.79 0.23 -1.17 -2.51 0.00 0.00 175.55 171.62 2gir s LEU 384 N -2.92 4.29 0.00 -3.49 2.96 -1.26 -0.77 118.68 117.48 2gir s LEU 384 Ca 0.13 0.48 0.06 0.00 -0.22 0.00 0.00 54.13 54.59 2gir s LEU 384 Cb 0.02 -2.27 -0.02 0.00 0.50 0.00 0.00 46.19 44.42 2gir s LEU 384 CO -0.02 0.21 0.24 1.07 -1.32 0.00 0.00 176.35 176.52 2gir n THR 385 N 3.05 0.00 -3.77 3.68 5.66 -0.02 -4.76 114.28 118.12 2gir n THR 385 Ca -0.15 -2.44 -0.09 0.00 -3.05 0.00 0.00 64.05 58.33 2gir n THR 385 Cb 0.53 1.10 -0.03 0.00 -1.55 0.00 0.00 70.33 70.37 2gir n THR 385 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2gir s ARG 386 N -3.44 1.53 0.20 1.09 1.70 -1.26 -0.52 118.95 118.25 2gir s ARG 386 Ca 0.33 -0.90 -0.32 0.00 -0.47 0.00 0.00 55.73 54.37 2gir s ARG 386 Cb 0.02 0.56 -0.12 0.00 -0.57 0.00 0.00 34.95 34.83 2gir s ARG 386 CO 0.24 -0.67 1.73 -3.47 -1.08 0.00 0.00 175.30 172.04 2gir n ASP 387 N -0.39 3.94 -0.07 -2.89 -0.08 -1.26 -4.90 116.55 110.89 2gir n ASP 387 Ca -0.08 1.05 0.15 0.00 -1.51 0.00 0.00 54.79 54.41 2gir n ASP 387 Cb 0.61 -1.56 0.88 0.00 2.34 0.00 0.00 41.12 43.39 2gir n ASP 387 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2gir n PRO 388 N 4.11 1.10 0.09 -0.67 -0.04 -1.26 -4.39 135.00 133.93 2gir n PRO 388 Ca 0.16 -0.14 -0.13 0.00 -0.04 0.00 0.00 63.50 63.35 2gir n PRO 388 Cb 0.35 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 32.24 2gir n PRO 388 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2gir h THR 389 N 0.34 0.95 -0.18 0.52 2.02 -1.96 -0.71 112.91 113.87 2gir h THR 389 Ca 0.00 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.85 2gir h THR 389 Cb 0.07 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 2gir h THR 389 CO 0.00 0.07 -0.02 0.74 0.37 0.00 0.00 175.52 176.68 2gir h THR 390 N -0.31 1.27 -0.90 3.16 2.02 -1.95 -1.00 112.91 115.20 2gir h THR 390 Ca -0.02 -0.95 0.17 0.00 0.77 0.00 0.00 66.41 66.39 2gir h THR 390 Cb 0.25 1.54 -0.10 0.00 -1.74 0.00 0.00 68.15 68.09 2gir h THR 390 CO 0.03 0.28 0.48 -0.65 0.37 0.00 0.00 175.52 176.04 2gir h PRO 391 N 0.06 0.62 -0.11 6.66 0.11 -1.79 -0.68 132.00 136.87 2gir h PRO 391 Ca 0.05 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.94 2gir h PRO 391 Cb 0.44 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.41 2gir h PRO 391 CO 0.01 0.41 -0.69 -0.07 -0.21 0.00 0.00 178.00 177.45 2gir h LEU 392 N 0.64 0.55 -0.41 2.35 3.38 -0.86 -0.60 115.31 120.36 2gir h LEU 392 Ca 0.51 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 2gir h LEU 392 Cb 0.78 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 2gir h LEU 392 CO -0.39 1.08 0.07 0.00 0.09 0.00 0.00 178.44 179.29 2gir h ALA 393 N 0.91 0.54 -0.41 1.53 0.00 -0.86 -1.30 119.26 119.66 2gir h ALA 393 Ca -0.02 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 2gir h ALA 393 Cb 1.26 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 2gir h ALA 393 CO 0.12 0.25 -0.11 0.00 0.00 0.00 0.00 179.25 179.51 2gir h ARG 394 N 0.52 0.74 -0.95 0.00 3.08 -1.06 -2.37 114.38 114.34 2gir h ARG 394 Ca 0.12 -0.24 0.01 0.00 0.07 0.00 0.00 59.98 59.95 2gir h ARG 394 Cb 0.36 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.30 2gir h ARG 394 CO 0.01 0.82 0.63 0.00 -1.07 0.00 0.00 179.97 180.36 2gir h ALA 395 N 1.21 1.32 -0.55 0.04 0.00 -0.94 -0.37 119.26 119.98 2gir h ALA 395 Ca 0.12 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2gir h ALA 395 Cb 0.57 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2gir h ALA 395 CO 0.04 0.63 0.17 0.00 0.00 0.00 0.00 179.25 180.09 2gir h ALA 396 N 1.40 0.72 -0.57 0.00 0.00 -0.88 0.72 119.26 120.65 2gir h ALA 396 Ca 0.35 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2gir h ALA 396 Cb -0.15 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 2gir h ALA 396 CO -0.08 0.38 0.29 2.35 0.00 0.00 0.00 179.25 182.19 2gir h TRP 397 N 0.76 0.82 0.00 0.00 2.91 -0.97 -2.70 115.95 116.77 2gir h TRP 397 Ca 0.18 -0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.16 2gir h TRP 397 Cb 0.29 -0.25 0.00 0.00 -0.51 0.00 0.00 29.16 28.68 2gir h TRP 397 CO 0.02 0.62 0.00 0.93 -1.03 0.00 0.00 178.44 178.98 2gir h GLU 398 N 0.78 0.00 -0.26 2.65 5.08 -0.73 -0.93 114.58 121.16 2gir h GLU 398 Ca 0.20 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.49 2gir h GLU 398 Cb 0.10 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2gir h GLU 398 CO -0.03 0.00 -0.13 1.15 -1.00 0.00 0.00 179.01 179.01 2gir h THR 399 N 0.00 1.22 0.00 1.13 2.02 -0.51 -3.32 112.91 113.45 2gir h THR 399 Ca 0.00 -0.98 0.00 0.00 0.77 0.00 0.00 66.41 66.20 2gir h THR 399 Cb 0.53 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 68.11 2gir h THR 399 CO 0.00 0.32 -1.39 0.00 0.37 0.00 0.00 175.52 174.82 2gir n ALA 400 N -2.48 3.26 -3.08 6.16 0.00 -0.84 -4.89 120.51 118.64 2gir n ALA 400 Ca 0.00 -0.44 -0.13 0.00 0.00 0.00 0.00 53.44 52.88 2gir n ALA 400 Cb 0.31 -0.60 -0.14 0.00 0.00 0.00 0.00 19.45 19.02 2gir n ALA 400 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2gir s ARG 401 N -2.95 0.01 -0.03 0.00 1.81 -0.42 -4.95 118.95 112.43 2gir s ARG 401 Ca -0.01 0.07 -0.30 0.00 -1.72 0.00 0.00 55.73 53.77 2gir s ARG 401 Cb 0.12 -0.05 -0.03 0.00 -0.45 0.00 0.00 34.95 34.54 2gir s ARG 401 CO 0.71 -0.04 0.98 -1.01 -0.68 0.00 0.00 175.30 175.26 2gir s HIS 402 N 0.25 3.63 0.15 -0.53 3.76 -1.26 -4.30 115.29 116.99 2gir s HIS 402 Ca -0.02 1.66 0.11 0.00 -0.15 0.00 0.00 55.06 56.66 2gir s HIS 402 Cb -0.03 -3.13 -0.04 0.00 1.11 0.00 0.00 32.58 30.49 2gir s HIS 402 CO -0.01 -0.06 -0.25 0.95 -0.85 0.00 0.00 174.74 174.52 2gir s THR 403 N 1.23 2.26 0.55 1.30 -4.23 -1.26 -5.03 115.64 110.45 2gir s THR 403 Ca 0.51 -1.86 0.25 0.00 -1.18 0.00 0.00 61.69 59.41 2gir s THR 403 Cb -0.20 -2.02 0.32 0.00 1.34 0.00 0.00 72.50 71.93 2gir s THR 403 CO 0.26 -0.01 2.20 1.55 -0.54 0.00 0.00 174.62 178.07 2gir h PRO 404 N 3.60 0.00 -4.61 3.99 0.13 -1.96 -3.38 132.00 129.77 2gir h PRO 404 Ca -0.49 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.09 2gir h PRO 404 Cb 1.19 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.97 2gir h PRO 404 CO 0.43 0.02 -0.82 0.08 -0.23 0.00 0.00 178.00 177.48 2gir s VAL 405 N -4.70 1.33 -0.83 1.56 1.01 -1.26 -4.67 120.40 112.84 2gir s VAL 405 Ca -0.05 -0.54 -0.22 0.00 0.00 0.00 0.00 61.98 61.17 2gir s VAL 405 Cb 0.15 -1.23 0.08 0.00 0.00 0.00 0.00 36.38 35.39 2gir s VAL 405 CO 0.59 0.41 1.14 0.20 0.00 0.00 0.00 175.10 177.44 2gir s ASN 406 N 1.00 6.39 0.46 3.32 0.01 0.08 -4.88 114.94 121.32 2gir s ASN 406 Ca -0.07 -1.39 0.13 0.00 -0.71 0.00 0.00 52.86 50.82 2gir s ASN 406 Cb -0.15 -2.45 1.07 0.00 0.41 0.00 0.00 41.25 40.13 2gir s ASN 406 CO -0.01 -1.36 2.05 0.77 -1.51 0.00 0.00 177.10 177.04 2gir h SER 407 N 9.40 0.27 -0.51 -1.22 4.64 -1.92 -2.21 113.55 122.00 2gir h SER 407 Ca -0.04 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.25 2gir h SER 407 Cb 1.04 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.04 2gir h SER 407 CO 1.21 0.18 0.24 4.11 -0.87 0.00 0.00 176.83 181.71 2gir h TRP 408 N 0.31 0.77 -0.01 4.77 5.08 -1.90 0.41 115.95 125.38 2gir h TRP 408 Ca 0.16 -0.03 -0.18 0.00 1.08 0.00 0.00 58.89 59.92 2gir h TRP 408 Cb 0.25 -0.24 0.01 0.00 -3.00 0.00 0.00 29.16 26.18 2gir h TRP 408 CO -0.00 0.58 -0.71 1.25 -1.28 0.00 0.00 178.44 178.27 2gir h LEU 409 N 0.77 0.65 -0.86 0.11 5.85 -1.79 -0.47 115.31 119.56 2gir h LEU 409 Ca 0.19 -0.74 -0.01 0.00 0.84 0.00 0.00 57.88 58.16 2gir h LEU 409 Cb 0.11 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 2gir h LEU 409 CO -0.02 1.31 0.51 1.23 -0.34 0.00 0.00 178.44 181.12 2gir h GLY 410 N 0.06 1.26 1.15 3.75 0.00 -1.30 -1.90 103.07 106.09 2gir h GLY 410 Ca -0.09 -0.54 -0.11 0.00 0.00 0.00 0.00 47.33 46.59 2gir h GLY 410 CO 0.14 0.52 -0.12 3.43 0.00 0.00 0.00 176.54 180.52 2gir h ASN 411 N 1.19 1.00 -0.72 0.19 2.35 -0.77 -1.09 115.58 117.72 2gir h ASN 411 Ca 0.31 -0.33 -0.04 0.00 -0.55 0.00 0.00 56.30 55.68 2gir h ASN 411 Cb -0.02 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.04 2gir h ASN 411 CO -0.06 1.11 0.28 0.40 -1.65 0.00 0.00 177.43 177.51 2gir h ILE 412 N 0.88 1.25 -0.16 2.81 2.04 -0.89 0.14 117.51 123.58 2gir h ILE 412 Ca 0.14 -0.81 -0.02 0.00 1.00 0.00 0.00 64.86 65.17 2gir h ILE 412 Cb 0.68 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 2gir h ILE 412 CO 0.05 0.32 0.02 0.40 0.00 0.00 0.00 178.15 178.94 2gir h ILE 413 N 1.04 1.23 0.06 -0.67 2.04 -0.98 0.07 117.51 120.31 2gir h ILE 413 Ca 0.24 -0.74 -0.26 0.00 1.00 0.00 0.00 64.86 65.11 2gir h ILE 413 Cb 0.23 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2gir h ILE 413 CO -0.02 0.22 -1.24 0.24 0.00 0.00 0.00 178.15 177.35 2gir h MET 414 N 0.05 0.13 -0.23 2.37 2.86 -1.15 -3.32 114.93 115.65 2gir h MET 414 Ca 0.05 -0.22 -0.11 0.00 -2.06 0.00 0.00 59.70 57.35 2gir h MET 414 Cb 0.32 0.08 -0.07 0.00 0.06 0.00 0.00 31.60 31.99 2gir h MET 414 CO 0.00 1.04 -0.22 0.66 1.06 0.00 0.00 176.91 179.45 2gir n TYR 415 N -3.40 0.70 -0.34 -0.22 4.01 0.47 -4.83 117.16 113.56 2gir n TYR 415 Ca -0.07 -1.55 0.16 0.00 -0.16 0.00 0.00 57.90 56.27 2gir n TYR 415 Cb 1.00 -0.40 0.35 0.00 -0.31 0.00 0.00 39.34 39.98 2gir n TYR 415 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2gir h ALA 416 N 1.00 1.69 0.00 -0.72 0.00 -1.08 -1.78 119.26 118.36 2gir h ALA 416 Ca 0.14 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2gir h ALA 416 Cb 1.43 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2gir h ALA 416 CO 0.25 -0.24 0.00 -2.30 0.00 0.00 0.00 179.25 176.96 2gir n PRO 417 N -4.90 0.03 -2.19 0.00 -0.02 -1.26 -4.48 135.00 122.19 2gir n PRO 417 Ca 0.25 0.14 -0.33 0.00 -2.02 0.00 0.00 63.50 61.54 2gir n PRO 417 Cb 0.69 -1.50 -0.00 0.00 -0.02 0.00 0.00 33.50 32.67 2gir n PRO 417 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2gir s THR 418 N -2.95 3.73 0.17 3.45 -4.23 -0.67 -4.84 115.64 110.30 2gir s THR 418 Ca 0.11 0.91 -0.14 0.00 -1.18 0.00 0.00 61.69 61.39 2gir s THR 418 Cb 0.13 -3.38 0.07 0.00 1.34 0.00 0.00 72.50 70.66 2gir s THR 418 CO 0.37 -0.40 1.75 0.25 -0.54 0.00 0.00 174.62 176.05 2gir h LEU 419 N 0.78 0.19 -0.11 4.79 5.85 -1.90 -2.70 115.31 122.21 2gir h LEU 419 Ca -0.48 0.05 -0.22 0.00 0.84 0.00 0.00 57.88 58.07 2gir h LEU 419 Cb 1.22 0.03 0.01 0.00 0.37 0.00 0.00 40.66 42.29 2gir h LEU 419 CO 0.58 0.14 -0.80 4.11 -0.34 0.00 0.00 178.44 182.13 2gir h TRP 420 N 0.35 1.02 -0.64 1.25 5.08 -1.93 -0.13 115.95 120.95 2gir h TRP 420 Ca 0.21 -0.47 -0.06 0.00 1.08 0.00 0.00 58.89 59.65 2gir h TRP 420 Cb 0.20 -0.15 -0.03 0.00 -3.00 0.00 0.00 29.16 26.19 2gir h TRP 420 CO -0.15 1.30 0.16 0.00 -1.28 0.00 0.00 178.44 178.47 2gir h ALA 421 N 0.50 1.07 0.00 0.11 0.00 -1.80 -1.98 119.26 117.16 2gir h ALA 421 Ca -0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2gir h ALA 421 Cb 1.44 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2gir h ALA 421 CO 0.16 0.62 -0.05 0.00 0.00 0.00 0.00 179.25 179.98 2gir h ARG 422 N 0.96 0.03 -0.23 0.00 3.08 -1.48 -0.86 114.38 115.88 2gir h ARG 422 Ca 0.20 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 2gir h ARG 422 Cb 0.34 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2gir h ARG 422 CO 0.00 0.89 -0.03 1.98 -1.07 0.00 0.00 179.97 181.73 2gir h MET 423 N -0.82 0.42 0.00 0.04 4.05 -1.06 -3.34 114.93 114.23 2gir h MET 423 Ca -0.01 -0.15 -0.04 0.00 -0.28 0.00 0.00 59.70 59.23 2gir h MET 423 Cb 0.91 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.67 2gir h MET 423 CO 0.01 0.64 -1.04 -0.89 0.23 0.00 0.00 176.91 175.86 2gir n ILE 424 N -4.61 1.49 -0.06 1.77 5.41 -0.75 -4.24 119.36 118.36 2gir n ILE 424 Ca -0.04 0.11 -0.12 0.00 1.00 0.00 0.00 62.75 63.70 2gir n ILE 424 Cb 0.27 -2.32 -0.06 0.00 -0.71 0.00 0.00 39.64 36.82 2gir n ILE 424 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2gir h LEU 425 N -1.00 0.35 -0.29 1.39 3.38 -1.38 -0.30 115.31 117.46 2gir h LEU 425 Ca -0.05 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 2gir h LEU 425 Cb 0.98 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2gir h LEU 425 CO -0.03 0.68 0.10 0.24 0.09 0.00 0.00 178.44 179.52 2gir h MET 426 N 0.02 0.45 0.17 1.13 2.86 -1.31 -1.80 114.93 116.45 2gir h MET 426 Ca 0.04 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2gir h MET 426 Cb 0.54 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.14 2gir h MET 426 CO 0.02 0.48 -0.09 1.15 1.06 0.00 0.00 176.91 179.53 2gir h THR 427 N 0.32 0.80 0.04 2.22 2.02 -1.65 -1.28 112.91 115.39 2gir h THR 427 Ca 0.10 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.27 2gir h THR 427 Cb 0.21 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2gir h THR 427 CO -0.01 0.00 -0.02 -0.74 0.37 0.00 0.00 175.52 175.12 2gir h HIS 428 N -0.25 -0.06 -0.06 3.16 6.17 -1.00 -2.32 115.15 120.80 2gir h HIS 428 Ca -0.02 -0.00 -0.22 0.00 0.71 0.00 0.00 60.37 60.84 2gir h HIS 428 Cb 0.20 0.02 0.01 0.00 2.52 0.00 0.00 27.41 30.15 2gir h HIS 428 CO -0.08 0.18 -0.86 0.74 0.71 0.00 0.00 177.93 178.62 2gir h PHE 429 N -0.28 0.78 -0.37 5.26 0.04 -1.34 -2.46 116.94 118.58 2gir h PHE 429 Ca -0.01 -0.38 -0.03 0.00 2.80 0.00 0.00 57.97 60.35 2gir h PHE 429 Cb 0.26 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 2gir h PHE 429 CO 0.00 1.19 0.09 0.74 -0.60 0.00 0.00 178.31 179.73 2gir h PHE 430 N 0.35 0.54 -0.39 -0.55 -1.00 -1.28 0.23 116.94 114.84 2gir h PHE 430 Ca -0.07 -0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.70 2gir h PHE 430 Cb 1.48 -0.17 -0.03 0.00 3.61 0.00 0.00 35.95 40.84 2gir h PHE 430 CO 0.07 0.47 0.21 1.03 -1.61 0.00 0.00 178.31 178.48 2gir h SER 431 N 0.53 0.33 -0.19 2.17 0.87 -1.21 -0.51 113.55 115.55 2gir h SER 431 Ca 0.12 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.67 2gir h SER 431 Cb 0.20 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2gir h SER 431 CO -0.00 0.24 0.01 0.40 -0.53 0.00 0.00 176.83 176.94 2gir h ILE 432 N 0.43 1.25 -0.89 2.23 2.04 -0.96 -1.94 117.51 119.68 2gir h ILE 432 Ca 0.16 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.19 2gir h ILE 432 Cb 0.04 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.51 2gir h ILE 432 CO -0.09 0.25 0.56 -0.07 0.00 0.00 0.00 178.15 178.80 2gir h LEU 433 N 0.09 1.05 0.26 1.44 3.38 -0.81 -1.29 115.31 119.42 2gir h LEU 433 Ca 0.05 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2gir h LEU 433 Cb 0.37 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2gir h LEU 433 CO 0.01 0.78 -0.19 -0.07 0.09 0.00 0.00 178.44 179.06 2gir h LEU 434 N 1.21 -0.50 -1.64 1.67 3.38 -1.01 0.29 115.31 118.72 2gir h LEU 434 Ca 0.32 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.35 2gir h LEU 434 Cb -0.09 0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2gir h LEU 434 CO -0.06 -0.30 0.27 0.00 0.09 0.00 0.00 178.44 178.44 2gir h ALA 435 N 0.25 1.79 -0.43 1.53 0.00 -0.98 -1.96 119.26 119.45 2gir h ALA 435 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2gir h ALA 435 Cb 0.40 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2gir h ALA 435 CO -0.01 0.17 0.00 1.04 0.00 0.00 0.00 179.25 180.46 2gir n GLN 436 N -4.48 2.34 -3.89 0.00 1.13 -0.52 -4.96 117.38 107.01 2gir n GLN 436 Ca 0.04 -2.04 -0.26 0.00 -1.94 0.00 0.00 57.00 52.79 2gir n GLN 436 Cb 0.12 -1.48 0.01 0.00 0.11 0.00 0.00 30.24 29.00 2gir n GLN 436 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2gir n GLU 437 N 1.21 -4.41 -0.16 -1.09 1.02 -0.63 -4.90 120.64 111.68 2gir n GLU 437 Ca 0.19 0.52 0.09 0.00 -0.02 0.00 0.00 57.16 57.94 2gir n GLU 437 Cb 0.53 -5.06 0.16 0.00 -0.02 0.00 0.00 31.44 27.04 2gir n GLU 437 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2gir n GLN 438 N -4.43 1.92 -0.21 3.49 6.02 -0.00 -4.72 117.38 119.45 2gir n GLN 438 Ca -0.18 -2.52 0.06 0.00 -0.01 0.00 0.00 57.00 54.35 2gir n GLN 438 Cb 0.62 -1.53 0.33 0.00 1.02 0.00 0.00 30.24 30.68 2gir n GLN 438 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2gir h LEU 439 N 0.53 0.71 -0.47 1.08 4.07 -1.91 -2.34 115.31 116.98 2gir h LEU 439 Ca 0.00 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.97 2gir h LEU 439 Cb 1.05 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.65 2gir h LEU 439 CO 0.06 0.46 -0.23 -0.62 -1.08 0.00 0.00 178.44 177.03 2gir n GLU 440 N -4.48 0.85 -2.65 1.13 1.02 -1.26 -3.56 120.64 111.68 2gir n GLU 440 Ca 0.11 -0.47 -0.43 0.00 -0.02 0.00 0.00 57.16 56.35 2gir n GLU 440 Cb 0.23 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.14 2gir n GLU 440 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2gir s LYS 441 N -2.48 4.33 0.22 3.49 2.20 -0.88 -4.94 119.74 121.69 2gir s LYS 441 Ca 0.25 1.40 -0.30 0.00 -0.36 0.00 0.00 55.97 56.97 2gir s LYS 441 Cb 0.19 -3.60 -0.09 0.00 -1.51 0.00 0.00 37.83 32.82 2gir s LYS 441 CO 0.51 -0.49 1.33 0.00 -0.36 0.00 0.00 175.35 176.34 2gir s ALA 442 N 2.65 3.54 0.17 3.13 0.00 -1.26 -4.42 121.76 125.57 2gir s ALA 442 Ca 0.47 1.16 0.10 0.00 0.00 0.00 0.00 51.96 53.70 2gir s ALA 442 Cb -0.17 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.41 2gir s ALA 442 CO 0.12 -0.58 -0.23 -0.51 0.00 0.00 0.00 175.76 174.57 2gir s LEU 443 N -0.33 2.41 -0.04 0.00 1.43 0.07 -4.83 118.68 117.40 2gir s LEU 443 Ca 0.56 -0.84 -0.17 0.00 -1.03 0.00 0.00 54.13 52.65 2gir s LEU 443 Cb -0.38 -1.07 -0.05 0.00 0.03 0.00 0.00 46.19 44.72 2gir s LEU 443 CO 0.40 0.08 0.47 -1.81 0.23 0.00 0.00 176.35 175.72 2gir s ASP 444 N -2.56 6.80 0.26 2.29 1.01 -1.26 0.06 116.67 123.27 2gir s ASP 444 Ca 0.18 0.95 0.02 0.00 0.71 0.00 0.00 52.55 54.41 2gir s ASP 444 Cb -0.08 -2.28 -0.03 0.00 1.01 0.00 0.00 42.92 41.53 2gir s ASP 444 CO 0.08 0.18 0.21 0.00 0.21 0.00 0.00 175.17 175.85 2gir s GLN 446 N -3.84 2.57 -0.14 0.00 -0.21 -1.26 -0.24 119.66 116.54 2gir s GLN 446 Ca 0.39 -0.77 -0.00 0.00 0.02 0.00 0.00 55.36 55.00 2gir s GLN 446 Cb 0.05 -2.03 0.03 0.00 1.00 0.00 0.00 33.01 32.06 2gir s GLN 446 CO 0.18 0.19 -0.09 0.42 -2.12 0.00 0.00 175.29 173.88 2gir s ILE 447 N 0.28 1.22 -1.52 1.08 1.09 0.38 -4.76 121.20 118.97 2gir s ILE 447 Ca -0.14 -0.51 -0.13 0.00 -1.10 0.00 0.00 60.65 58.78 2gir s ILE 447 Cb -0.16 -1.26 0.08 0.00 -1.06 0.00 0.00 42.46 40.06 2gir s ILE 447 CO 0.06 0.31 0.94 -1.22 -0.10 0.00 0.00 174.94 174.93 2gir n TYR 448 N 4.87 -2.22 0.00 3.97 4.01 -1.26 -2.03 117.16 124.50 2gir n TYR 448 Ca -0.13 0.89 0.00 0.00 -0.16 0.00 0.00 57.90 58.50 2gir n TYR 448 Cb 0.49 -3.94 0.00 0.00 -0.31 0.00 0.00 39.34 35.58 2gir n TYR 448 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2gir n GLY 449 N -1.67 3.04 3.82 2.72 0.00 -1.26 -0.70 105.19 111.14 2gir n GLY 449 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 2gir n GLY 449 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gir s ALA 450 N -1.52 3.40 -0.08 4.61 0.00 -0.86 -4.44 121.76 122.87 2gir s ALA 450 Ca 0.00 0.15 -0.18 0.00 0.00 0.00 0.00 51.96 51.93 2gir s ALA 450 Cb 0.00 -2.81 -0.05 0.00 0.00 0.00 0.00 23.12 20.26 2gir s ALA 450 CO 0.00 0.33 0.47 0.00 0.00 0.00 0.00 175.76 176.56 2gir s TYR 452 N 0.11 1.56 -0.23 0.00 1.51 0.67 0.17 117.35 121.14 2gir s TYR 452 Ca 0.26 -0.32 -0.14 0.00 -1.01 0.00 0.00 57.07 55.85 2gir s TYR 452 Cb -0.16 -0.97 -0.04 0.00 -0.11 0.00 0.00 41.96 40.68 2gir s TYR 452 CO 0.12 0.02 0.31 0.45 -1.11 0.00 0.00 175.55 175.33 2gir s SER 453 N -0.75 6.29 -0.04 2.29 0.15 -1.26 -1.11 113.70 119.27 2gir s SER 453 Ca 0.06 0.33 0.01 0.00 0.70 0.00 0.00 55.95 57.05 2gir s SER 453 Cb -0.07 -2.18 0.02 0.00 -1.71 0.00 0.00 66.02 62.08 2gir s SER 453 CO 0.00 -0.04 -0.03 -0.63 1.20 0.00 0.00 173.24 173.74 2gir s ILE 454 N 1.35 0.40 -0.27 6.45 1.01 0.11 -4.89 121.20 125.36 2gir s ILE 454 Ca 0.14 -0.04 -0.26 0.00 0.00 0.00 0.00 60.65 60.49 2gir s ILE 454 Cb -0.14 -0.46 0.00 0.00 0.01 0.00 0.00 42.46 41.87 2gir s ILE 454 CO 0.07 0.20 0.91 -1.61 0.00 0.00 0.00 174.94 174.51 2gir s GLU 455 N 0.99 4.13 0.36 2.79 2.02 -1.26 -0.75 118.70 126.97 2gir s GLU 455 Ca -0.10 0.98 0.15 0.00 0.02 0.00 0.00 54.97 56.02 2gir s GLU 455 Cb -0.14 -3.68 1.05 0.00 0.10 0.00 0.00 34.13 31.46 2gir s GLU 455 CO -0.01 -0.65 1.71 -1.35 0.02 0.00 0.00 175.26 174.98 2gir h PRO 456 N 7.81 0.40 0.00 0.39 0.11 -1.77 -0.38 132.00 138.55 2gir h PRO 456 Ca -0.22 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.87 2gir h PRO 456 Cb 1.08 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 2gir h PRO 456 CO 0.93 0.26 -0.01 -0.07 -0.21 0.00 0.00 178.00 178.91 2gir h LEU 457 N 0.41 0.00 -0.13 2.35 3.38 -1.93 -0.30 115.31 119.10 2gir h LEU 457 Ca 0.67 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.64 2gir h LEU 457 Cb 1.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.31 2gir h LEU 457 CO -0.46 0.01 -0.03 0.47 0.09 0.00 0.00 178.44 178.52 2gir n ASP 458 N -3.17 0.23 -0.32 -0.43 8.00 -0.15 -4.43 116.55 116.27 2gir n ASP 458 Ca -0.02 -0.68 0.04 0.00 0.71 0.00 0.00 54.79 54.84 2gir n ASP 458 Cb 0.13 -0.10 0.19 0.00 -0.02 0.00 0.00 41.12 41.31 2gir n ASP 458 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2gir h LEU 459 N 0.31 0.78 -0.98 0.64 3.38 -1.15 -1.12 115.31 117.18 2gir h LEU 459 Ca 0.00 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2gir h LEU 459 Cb 0.21 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 2gir h LEU 459 CO 0.00 0.44 0.65 -0.65 0.09 0.00 0.00 178.44 178.97 2gir h PRO 460 N 0.89 1.29 -0.25 1.13 0.11 -1.82 0.16 132.00 133.50 2gir h PRO 460 Ca 0.43 -0.08 -0.19 0.00 0.11 0.00 0.00 66.00 66.27 2gir h PRO 460 Cb 0.38 -0.29 0.00 0.00 0.11 0.00 0.00 31.00 31.20 2gir h PRO 460 CO -0.24 0.85 -0.59 1.96 -0.21 0.00 0.00 178.00 179.77 2gir h GLN 461 N 1.32 0.80 -0.28 1.05 7.50 -1.66 0.11 115.11 123.95 2gir h GLN 461 Ca 0.36 -0.53 -0.01 0.00 0.50 0.00 0.00 58.65 58.98 2gir h GLN 461 Cb -0.14 0.07 -0.01 0.00 0.05 0.00 0.00 27.48 27.45 2gir h GLN 461 CO -0.08 1.15 0.14 0.82 -1.50 0.00 0.00 178.83 179.36 2gir h ILE 462 N 0.60 1.14 -0.16 2.54 2.04 -0.98 -1.19 117.51 121.51 2gir h ILE 462 Ca 0.00 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 2gir h ILE 462 Cb 1.19 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 2gir h ILE 462 CO 0.12 0.14 0.05 0.40 0.00 0.00 0.00 178.15 178.86 2gir h ILE 463 N 0.32 1.18 -0.67 -0.67 2.04 -0.53 -0.50 117.51 118.68 2gir h ILE 463 Ca 0.10 -0.55 0.07 0.00 1.00 0.00 0.00 64.86 65.48 2gir h ILE 463 Cb 0.09 1.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.36 2gir h ILE 463 CO -0.01 0.17 0.35 -0.08 0.00 0.00 0.00 178.15 178.57 2gir h GLU 464 N 0.08 0.61 -0.57 2.37 4.81 -0.72 0.20 114.58 121.35 2gir h GLU 464 Ca 0.05 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 2gir h GLU 464 Cb 0.21 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 2gir h GLU 464 CO -0.00 0.41 -0.00 -0.09 -0.73 0.00 0.00 179.01 178.59 2gir h ARG 465 N 0.63 1.01 0.20 1.92 9.65 -1.00 0.19 114.38 126.97 2gir h ARG 465 Ca 0.31 -0.33 -0.32 0.00 -1.10 0.00 0.00 59.98 58.54 2gir h ARG 465 Cb 0.25 -0.09 0.02 0.00 -1.39 0.00 0.00 29.97 28.76 2gir h ARG 465 CO -0.21 1.01 -1.50 -0.07 2.80 0.00 0.00 179.97 181.99 2gir h LEU 466 N 0.90 0.65 0.00 3.80 3.38 -0.61 -3.41 115.31 120.03 2gir h LEU 466 Ca 0.16 -0.77 0.00 0.00 0.09 0.00 0.00 57.88 57.36 2gir h LEU 466 Cb 0.55 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2gir h LEU 466 CO 0.03 1.62 -1.01 1.41 0.09 0.00 0.00 178.44 180.58 2gir n HIS 467 N -3.61 0.00 0.00 1.13 8.25 0.65 -4.59 115.22 117.05 2gir n HIS 467 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 2gir n HIS 467 Cb 1.08 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 32.14 2gir n HIS 467 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gir n GLY 468 N 2.23 -1.33 0.29 -1.41 0.00 0.66 -4.47 105.19 101.16 2gir n GLY 468 Ca -0.00 -1.59 0.18 0.00 0.00 0.00 0.00 46.02 44.60 2gir n GLY 468 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2gir h LEU 469 N 0.00 0.00 -2.06 0.99 3.38 -1.89 -2.44 115.31 113.29 2gir h LEU 469 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2gir h LEU 469 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2gir h LEU 469 CO 0.00 0.04 0.10 0.77 0.09 0.00 0.00 178.44 179.45 2gir h SER 470 N 0.00 0.00 -0.05 -0.43 4.64 -1.97 -1.51 113.55 114.23 2gir h SER 470 Ca -0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.33 2gir h SER 470 Cb 0.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 2gir h SER 470 CO 0.01 0.00 0.10 0.00 -0.87 0.00 0.00 176.83 176.06 2gir h ALA 471 N 1.92 1.42 -0.22 5.18 0.00 -1.66 0.12 119.26 126.03 2gir h ALA 471 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2gir h ALA 471 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2gir h ALA 471 CO -0.00 -0.12 0.00 1.19 0.00 0.00 0.00 179.25 180.32 2gir n PHE 472 N -3.49 0.27 -0.27 0.00 3.72 -0.57 -4.35 117.46 112.77 2gir n PHE 472 Ca -0.02 -0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 2gir n PHE 472 Cb 0.18 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 2gir n PHE 472 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2gir n SER 473 N 0.88 0.35 -4.77 4.37 7.64 -0.04 -4.54 113.62 117.51 2gir n SER 473 Ca 0.17 -0.73 -0.40 0.00 1.01 0.00 0.00 58.87 58.92 2gir n SER 473 Cb 0.47 0.21 0.01 0.00 -1.01 0.00 0.00 64.21 63.89 2gir n SER 473 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2gir s LEU 474 N -0.42 4.18 0.38 -3.43 1.43 -0.78 -3.91 118.68 116.12 2gir s LEU 474 Ca 0.00 2.93 -0.16 0.00 -1.03 0.00 0.00 54.13 55.87 2gir s LEU 474 Cb 0.00 -3.86 0.06 0.00 0.03 0.00 0.00 46.19 42.41 2gir s LEU 474 CO 0.00 -1.06 0.80 -1.38 0.23 0.00 0.00 176.35 174.93 2gir s HIS 475 N -1.19 0.12 -1.13 0.29 -3.43 -0.05 -4.96 115.29 104.94 2gir s HIS 475 Ca 0.58 -0.79 -0.18 0.00 -0.80 0.00 0.00 55.06 53.88 2gir s HIS 475 Cb -0.44 0.84 -0.02 0.00 -1.43 0.00 0.00 32.58 31.53 2gir s HIS 475 CO 0.57 -1.56 0.81 0.43 -2.00 0.00 0.00 174.74 173.00 2gir n SER 476 N -1.40 -5.45 -4.71 7.38 7.64 -1.26 -0.67 113.62 115.15 2gir n SER 476 Ca -0.08 -0.96 -0.30 0.00 1.01 0.00 0.00 58.87 58.53 2gir n SER 476 Cb 0.60 -3.69 0.13 0.00 -1.01 0.00 0.00 64.21 60.24 2gir n SER 476 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2gir s TYR 477 N -3.46 2.28 0.66 1.43 1.51 -1.26 -3.86 117.35 114.64 2gir s TYR 477 Ca 0.46 1.36 -0.13 0.00 -1.01 0.00 0.00 57.07 57.76 2gir s TYR 477 Cb -0.15 -3.15 -0.01 0.00 -0.11 0.00 0.00 41.96 38.55 2gir s TYR 477 CO 0.84 -2.36 1.06 -1.54 -1.11 0.00 0.00 175.55 172.44 2gir s SER 478 N -3.31 5.49 0.25 2.29 1.04 -1.17 -4.83 113.70 113.45 2gir s SER 478 Ca 0.63 1.71 -0.05 0.00 0.48 0.00 0.00 55.95 58.72 2gir s SER 478 Cb -0.18 -2.51 0.27 0.00 0.10 0.00 0.00 66.02 63.69 2gir s SER 478 CO 0.57 -1.37 1.86 -0.65 0.98 0.00 0.00 173.24 174.64 2gir h PRO 479 N -0.27 1.17 -0.59 4.02 0.11 -1.94 -0.86 132.00 133.64 2gir h PRO 479 Ca -0.45 -0.14 0.01 0.00 0.11 0.00 0.00 66.00 65.52 2gir h PRO 479 Cb 1.22 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 2gir h PRO 479 CO 0.57 0.87 0.38 0.78 -0.21 0.00 0.00 178.00 180.39 2gir h GLY 480 N 1.19 0.83 0.97 -0.55 0.00 -1.99 -0.02 103.07 103.50 2gir h GLY 480 Ca 0.29 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 2gir h GLY 480 CO -0.04 0.29 -0.09 -2.09 0.00 0.00 0.00 176.54 174.60 2gir h GLU 481 N 0.78 0.74 -0.04 4.80 4.57 -1.79 -1.32 114.58 122.34 2gir h GLU 481 Ca 0.22 -0.28 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2gir h GLU 481 Cb -0.07 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.47 2gir h GLU 481 CO -0.06 0.88 0.02 0.82 -1.18 0.00 0.00 179.01 179.50 2gir h ILE 482 N 0.55 1.08 -0.63 2.32 2.04 -1.04 -1.05 117.51 120.78 2gir h ILE 482 Ca 0.10 -0.24 0.11 0.00 1.00 0.00 0.00 64.86 65.83 2gir h ILE 482 Cb 0.61 1.18 -0.08 0.00 -0.74 0.00 0.00 36.82 37.78 2gir h ILE 482 CO 0.04 0.07 0.20 0.78 0.00 0.00 0.00 178.15 179.24 2gir h ASN 483 N -0.04 0.15 -0.28 1.72 2.35 -0.95 0.59 115.58 119.12 2gir h ASN 483 Ca 0.01 0.10 -0.05 0.00 -0.55 0.00 0.00 56.30 55.81 2gir h ASN 483 Cb 0.09 0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 2gir h ASN 483 CO -0.00 0.08 -0.03 -0.09 -1.65 0.00 0.00 177.43 175.74 2gir h ARG 484 N 0.36 0.52 -0.03 0.81 2.43 -0.94 0.29 114.38 117.82 2gir h ARG 484 Ca 0.33 -0.18 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2gir h ARG 484 Cb 0.46 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2gir h ARG 484 CO -0.36 0.70 0.01 0.28 -1.51 0.00 0.00 179.97 179.09 2gir h VAL 485 N 0.29 1.15 -0.44 0.20 2.07 -1.00 -1.00 116.25 117.51 2gir h VAL 485 Ca 0.08 -0.45 0.07 0.00 0.82 0.00 0.00 66.70 67.21 2gir h VAL 485 Cb 0.49 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 2gir h VAL 485 CO 0.02 0.12 0.11 0.00 0.02 0.00 0.00 177.57 177.84 2gir h ALA 486 N 0.83 0.50 -0.78 1.67 0.00 -0.80 -0.43 119.26 120.25 2gir h ALA 486 Ca 0.01 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2gir h ALA 486 Cb 0.19 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2gir h ALA 486 CO -0.00 -0.29 0.48 1.03 0.00 0.00 0.00 179.25 180.47 2gir h SER 487 N 0.25 0.92 -0.24 0.00 0.87 -0.81 -1.80 113.55 112.74 2gir h SER 487 Ca 0.21 -0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.67 2gir h SER 487 Cb 0.25 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 2gir h SER 487 CO -0.26 0.69 -0.08 0.00 -0.53 0.00 0.00 176.83 176.65 2gir h LEU 489 N 0.22 1.08 -0.46 0.00 3.38 -0.85 -1.16 115.31 117.52 2gir h LEU 489 Ca 0.06 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2gir h LEU 489 Cb 0.56 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2gir h LEU 489 CO 0.03 0.87 0.12 0.03 0.09 0.00 0.00 178.44 179.58 2gir h ARG 490 N 1.22 0.74 -0.38 1.13 3.08 -1.27 0.96 114.38 119.86 2gir h ARG 490 Ca 0.31 -0.17 0.02 0.00 0.07 0.00 0.00 59.98 60.20 2gir h ARG 490 Cb 0.02 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 2gir h ARG 490 CO -0.05 0.72 0.21 -0.22 -1.07 0.00 0.00 179.97 179.56 2gir h LYS 491 N 0.62 0.41 0.00 0.04 3.64 -0.69 -2.98 116.57 117.61 2gir h LYS 491 Ca 0.15 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2gir h LYS 491 Cb 0.31 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 2gir h LYS 491 CO 0.00 0.27 -0.68 1.28 -2.27 0.00 0.00 179.45 178.05 2gir n LEU 492 N -4.90 0.64 -1.47 5.20 4.32 -0.49 -4.86 117.00 115.43 2gir n LEU 492 Ca 0.01 0.14 -0.06 0.00 -0.02 0.00 0.00 56.01 56.08 2gir n LEU 492 Cb 0.07 -0.18 0.02 0.00 -1.62 0.00 0.00 43.42 41.72 2gir n LEU 492 CO 0.31 -0.00 0.05 0.61 -1.22 0.00 0.00 177.39 177.14 2gir n GLY 493 N 1.37 0.41 3.79 -0.72 0.00 -0.21 -1.72 105.19 108.11 2gir n GLY 493 Ca 0.03 -0.38 -0.39 0.00 0.00 0.00 0.00 46.02 45.28 2gir n GLY 493 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gir s VAL 494 N -3.09 4.79 0.74 1.61 1.01 0.16 -1.04 120.40 124.58 2gir s VAL 494 Ca 0.08 1.24 -0.15 0.00 0.00 0.00 0.00 61.98 63.15 2gir s VAL 494 Cb -0.04 -3.91 0.04 0.00 0.00 0.00 0.00 36.38 32.47 2gir s VAL 494 CO 0.19 0.51 1.23 -2.65 0.00 0.00 0.00 175.10 174.38 2gir n PRO 495 N 2.06 0.58 -1.39 2.72 -0.02 -1.26 -4.70 135.00 132.98 2gir n PRO 495 Ca -0.09 0.26 -0.29 0.00 -2.02 0.00 0.00 63.50 61.36 2gir n PRO 495 Cb 0.51 -2.47 0.17 0.00 -0.02 0.00 0.00 33.50 31.69 2gir n PRO 495 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2gir s PRO 496 N -3.77 0.53 0.26 0.52 0.04 -1.26 -4.81 135.00 126.51 2gir s PRO 496 Ca 0.77 0.24 -0.02 0.00 0.04 0.00 0.00 61.00 62.04 2gir s PRO 496 Cb -0.33 -1.77 0.54 0.00 0.04 0.00 0.00 34.50 32.98 2gir s PRO 496 CO 0.46 -2.60 1.70 1.25 0.04 0.00 0.00 177.00 177.85 2gir h LEU 497 N -1.79 0.18 -0.74 -3.56 5.85 -1.99 -1.53 115.31 111.73 2gir h LEU 497 Ca -0.51 0.14 0.17 0.00 0.84 0.00 0.00 57.88 58.52 2gir h LEU 497 Cb 1.32 0.15 -0.13 0.00 0.37 0.00 0.00 40.66 42.37 2gir h LEU 497 CO 0.55 0.01 0.01 -0.09 -0.34 0.00 0.00 178.44 178.59 2gir h ARG 498 N 0.36 0.10 -0.02 1.25 2.43 -1.99 0.41 114.38 116.92 2gir h ARG 498 Ca 0.46 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.61 2gir h ARG 498 Cb 0.79 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.31 2gir h ARG 498 CO -0.49 0.07 -0.02 0.28 -1.51 0.00 0.00 179.97 178.30 2gir h VAL 499 N 0.11 1.37 -0.64 0.20 2.07 -1.64 -2.50 116.25 115.21 2gir h VAL 499 Ca 0.40 -1.12 -0.05 0.00 0.82 0.00 0.00 66.70 66.75 2gir h VAL 499 Cb 0.71 2.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.52 2gir h VAL 499 CO -0.65 0.30 0.19 -0.50 0.02 0.00 0.00 177.57 176.92 2gir h TRP 500 N -0.40 1.01 -0.84 1.57 4.06 -0.99 -1.34 115.95 119.03 2gir h TRP 500 Ca 0.00 -0.09 -0.03 0.00 2.06 0.00 0.00 58.89 60.83 2gir h TRP 500 Cb 0.49 -0.30 -0.04 0.00 -1.00 0.00 0.00 29.16 28.32 2gir h TRP 500 CO 0.09 0.82 0.41 -0.09 -3.56 0.00 0.00 178.44 176.11 2gir h ARG 501 N 0.95 1.20 -0.17 0.49 2.43 -0.22 0.16 114.38 119.22 2gir h ARG 501 Ca 0.21 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2gir h ARG 501 Cb 0.29 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2gir h ARG 501 CO -0.01 0.92 0.11 1.25 -1.51 0.00 0.00 179.97 180.73 2gir h HIS 502 N 1.19 0.21 -0.60 2.20 2.76 -0.93 -1.91 115.15 118.07 2gir h HIS 502 Ca 0.29 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.39 2gir h HIS 502 Cb 0.10 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 28.97 2gir h HIS 502 CO 0.01 0.13 0.07 0.00 -1.30 0.00 0.00 177.93 176.84 2gir h ARG 503 N 0.23 0.98 -0.66 5.26 3.08 -0.96 -2.00 114.38 120.31 2gir h ARG 503 Ca 0.06 -0.26 -0.08 0.00 0.07 0.00 0.00 59.98 59.77 2gir h ARG 503 Cb -0.03 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 29.88 2gir h ARG 503 CO -0.01 0.93 0.11 0.00 -1.07 0.00 0.00 179.97 179.92 2gir h ALA 504 N 1.15 0.87 -0.63 0.04 0.00 -0.56 0.16 119.26 120.29 2gir h ALA 504 Ca 0.18 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2gir h ALA 504 Cb 0.44 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2gir h ALA 504 CO 0.02 0.64 0.13 0.00 0.00 0.00 0.00 179.25 180.04 2gir h ARG 505 N 1.01 1.00 0.34 0.00 3.08 -1.13 0.20 114.38 118.87 2gir h ARG 505 Ca 0.20 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 2gir h ARG 505 Cb 0.43 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.35 2gir h ARG 505 CO 0.01 0.90 -0.16 1.03 -1.07 0.00 0.00 179.97 180.67 2gir h SER 506 N 0.95 -0.39 -0.68 7.04 0.87 -0.96 -1.13 113.55 119.25 2gir h SER 506 Ca 0.20 -0.11 0.11 0.00 -1.23 0.00 0.00 61.79 60.75 2gir h SER 506 Cb 0.36 0.10 -0.08 0.00 -0.44 0.00 0.00 62.40 62.35 2gir h SER 506 CO 0.00 -0.10 0.28 0.58 -0.53 0.00 0.00 176.83 177.06 2gir h VAL 507 N -0.68 0.76 -0.11 2.23 2.07 -0.62 -1.98 116.25 117.91 2gir h VAL 507 Ca -0.05 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 2gir h VAL 507 Cb 0.48 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2gir h VAL 507 CO 0.08 0.09 0.07 -0.09 0.02 0.00 0.00 177.57 177.73 2gir h ARG 508 N 0.47 0.16 -0.83 1.57 2.43 -0.50 -1.48 114.38 116.20 2gir h ARG 508 Ca 0.35 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.54 2gir h ARG 508 Cb 0.45 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.91 2gir h ARG 508 CO -0.32 0.15 0.53 0.00 -1.51 0.00 0.00 179.97 178.81 2gir h ALA 509 N 1.00 1.10 -0.56 2.80 0.00 -0.82 -1.19 119.26 121.59 2gir h ALA 509 Ca 0.04 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 2gir h ALA 509 Cb 0.03 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2gir h ALA 509 CO -0.01 0.33 -0.06 0.00 0.00 0.00 0.00 179.25 179.51 2gir h ARG 510 N 1.01 1.03 -0.60 0.00 -0.00 -1.11 -2.86 114.38 111.85 2gir h ARG 510 Ca 0.34 -0.36 -0.08 0.00 -0.50 0.00 0.00 59.98 59.38 2gir h ARG 510 Cb 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 29.97 29.91 2gir h ARG 510 CO -0.13 1.05 0.05 -0.07 0.00 0.00 0.00 179.97 180.87 2gir h LEU 511 N 0.91 0.97 -1.23 3.04 3.38 -0.88 -2.77 115.31 118.73 2gir h LEU 511 Ca 0.15 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2gir h LEU 511 Cb 0.63 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2gir h LEU 511 CO 0.04 1.00 0.17 -0.07 0.09 0.00 0.00 178.44 179.67 2gir h LEU 512 N 0.93 0.64 -1.12 1.67 3.38 -1.14 -1.49 115.31 118.19 2gir h LEU 512 Ca 0.18 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 2gir h LEU 512 Cb 0.47 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2gir h LEU 512 CO 0.02 0.60 -0.22 0.28 0.09 0.00 0.00 178.44 179.21 2gir h SER 513 N 0.69 0.35 1.00 -0.43 0.02 -1.26 -2.60 113.55 111.32 2gir h SER 513 Ca 0.17 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 2gir h SER 513 Cb 0.18 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 2gir h SER 513 CO -0.01 0.58 -0.04 1.56 -1.14 0.00 0.00 176.83 177.78 2gir h GLN 514 N 0.32 0.00 0.00 3.45 4.20 -1.42 -3.49 115.11 118.17 2gir h GLN 514 Ca 0.05 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.81 2gir h GLN 514 Cb 0.57 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 2gir h GLN 514 CO 0.04 0.04 -0.07 0.41 -0.67 0.00 0.00 178.83 178.58 2gir n GLY 515 N 0.05 -1.87 7.00 3.46 0.00 -0.98 -4.86 105.19 107.98 2gir n GLY 515 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.70 2gir n GLY 515 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gir n GLY 516 N -0.79 2.92 0.20 -0.02 0.00 -1.26 -2.14 105.19 104.10 2gir n GLY 516 Ca 0.00 -0.31 0.01 0.00 0.00 0.00 0.00 46.02 45.73 2gir n GLY 516 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2gir h ARG 517 N 0.00 0.11 -0.17 1.61 3.08 -1.92 -2.76 114.38 114.34 2gir h ARG 517 Ca 0.00 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 2gir h ARG 517 Cb 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2gir h ARG 517 CO 0.00 0.43 0.08 0.00 -1.07 0.00 0.00 179.97 179.40 2gir h ALA 518 N 1.57 0.21 -0.80 0.04 0.00 -1.75 -1.04 119.26 117.50 2gir h ALA 518 Ca 0.01 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.88 2gir h ALA 518 Cb 0.63 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2gir h ALA 518 CO 0.05 -0.21 0.52 0.00 0.00 0.00 0.00 179.25 179.61 2gir h ALA 519 N 0.93 1.57 -0.63 0.00 0.00 -0.74 -0.68 119.26 119.71 2gir h ALA 519 Ca 0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2gir h ALA 519 Cb 0.14 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2gir h ALA 519 CO -0.01 0.33 0.25 1.15 0.00 0.00 0.00 179.25 180.97 2gir h THR 520 N 0.93 1.23 -0.44 0.00 2.02 -1.18 0.17 112.91 115.65 2gir h THR 520 Ca 0.33 -0.74 0.07 0.00 0.77 0.00 0.00 66.41 66.84 2gir h THR 520 Cb 0.13 0.55 -0.06 0.00 -1.74 0.00 0.00 68.15 67.02 2gir h THR 520 CO -0.11 0.29 0.07 0.00 0.37 0.00 0.00 175.52 176.14 2gir h GLY 522 N 0.20 -0.13 0.94 0.00 0.00 -0.42 0.57 103.07 104.22 2gir h GLY 522 Ca 0.22 0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.59 2gir h GLY 522 CO -0.30 -0.05 0.09 1.70 0.00 0.00 0.00 176.54 177.99 2gir h LYS 523 N -0.13 0.24 0.02 4.80 3.64 -0.51 -3.03 116.57 121.59 2gir h LYS 523 Ca -0.01 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.23 2gir h LYS 523 Cb 0.10 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2gir h LYS 523 CO 0.02 0.24 -0.60 1.88 -2.27 0.00 0.00 179.45 178.72 2gir h TYR 524 N 0.18 0.06 -0.04 1.91 -1.99 -1.10 -3.18 116.97 112.80 2gir h TYR 524 Ca 0.06 -0.04 -0.09 0.00 2.00 0.00 0.00 58.73 60.65 2gir h TYR 524 Cb 0.07 -0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.78 2gir h TYR 524 CO -0.04 1.23 -0.41 -0.07 -0.00 0.00 0.00 178.16 178.88 2gir h LEU 525 N -0.92 0.09 -3.01 3.88 3.38 -1.01 -3.30 115.31 114.43 2gir h LEU 525 Ca -0.15 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 2gir h LEU 525 Cb 1.20 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 2gir h LEU 525 CO -0.06 0.49 -0.02 0.49 0.09 0.00 0.00 178.44 179.42 2gir n PHE 526 N -4.04 0.04 0.11 1.13 3.72 -1.14 -4.66 117.46 112.61 2gir n PHE 526 Ca -0.02 -1.02 0.06 0.00 -0.05 0.00 0.00 57.45 56.42 2gir n PHE 526 Cb 0.45 -0.16 0.51 0.00 -0.94 0.00 0.00 39.48 39.34 2gir n PHE 526 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 2gir h ASN 527 N 0.12 0.27 -0.08 4.37 -0.00 -1.63 -1.28 115.58 117.36 2gir h ASN 527 Ca 0.00 -0.01 0.02 0.00 -0.00 0.00 0.00 56.30 56.32 2gir h ASN 527 Cb 1.02 -0.07 -0.00 0.00 -0.00 0.00 0.00 38.32 39.27 2gir h ASN 527 CO 0.01 0.20 0.12 4.11 -0.00 0.00 0.00 177.43 181.87 2gir h TRP 528 N 0.32 0.00 -0.00 0.67 5.08 -1.83 -2.89 115.95 117.30 2gir h TRP 528 Ca 0.09 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.06 2gir h TRP 528 Cb -0.03 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.13 2gir h TRP 528 CO 0.00 0.00 -0.38 0.00 -1.28 0.00 0.00 178.44 176.78 2gir n ALA 529 N -2.24 3.30 -2.81 0.11 0.00 -0.48 -4.91 120.51 113.48 2gir n ALA 529 Ca -0.01 -0.36 -0.26 0.00 0.00 0.00 0.00 53.44 52.82 2gir n ALA 529 Cb 0.22 -1.15 -0.05 0.00 0.00 0.00 0.00 19.45 18.47 2gir n ALA 529 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2gir s VAL 530 N -2.80 4.56 0.02 0.00 -7.23 -1.09 -4.79 120.40 109.07 2gir s VAL 530 Ca 0.17 -1.07 -0.18 0.00 -1.81 0.00 0.00 61.98 59.09 2gir s VAL 530 Cb 0.18 -3.34 -0.30 0.00 0.56 0.00 0.00 36.38 33.47 2gir s VAL 530 CO 0.62 -0.13 1.03 0.07 -0.31 0.00 0.00 175.10 176.38 2gir h LYS 531 N 2.30 0.50 -4.34 4.82 2.10 -1.91 -3.39 116.57 116.65 2gir h LYS 531 Ca -0.48 -0.72 -0.74 0.00 -2.00 0.00 0.00 60.65 56.71 2gir h LYS 531 Cb 1.20 0.25 -0.22 0.00 -0.90 0.00 0.00 32.23 32.56 2gir h LYS 531 CO 0.63 1.32 0.04 -0.08 -2.00 0.00 0.00 179.45 179.37 2gir s THR 532 N -2.79 5.09 0.36 0.07 -1.32 -1.26 -5.03 115.64 110.76 2gir s THR 532 Ca -0.11 -1.48 -0.25 0.00 -1.21 0.00 0.00 61.69 58.64 2gir s THR 532 Cb 0.04 -4.45 -0.09 0.00 -1.51 0.00 0.00 72.50 66.48 2gir s THR 532 CO 0.90 -1.04 1.01 -0.54 -2.21 0.00 0.00 174.62 172.73 2gir s LYS 533 N 1.85 4.39 0.67 7.08 3.01 -1.26 -5.04 119.74 130.44 2gir s LYS 533 Ca 0.11 1.45 -0.11 0.00 -1.01 0.00 0.00 55.97 56.41 2gir s LYS 533 Cb -0.23 -2.70 -0.01 0.00 -1.01 0.00 0.00 37.83 33.88 2gir s LYS 533 CO 0.01 0.08 1.05 -0.51 0.51 0.00 0.00 175.35 176.49 2gir s LEU 534 N -2.29 3.16 -0.47 3.17 1.02 -1.26 -5.02 118.68 116.98 2gir s LEU 534 Ca 0.53 1.53 -0.17 0.00 0.02 0.00 0.00 54.13 56.04 2gir s LEU 534 Cb -0.21 -4.47 0.06 0.00 0.02 0.00 0.00 46.19 41.59 2gir s LEU 534 CO 0.27 -1.23 0.48 -1.59 0.02 0.00 0.00 176.35 174.30 2gir s LYS 535 N -5.10 3.05 -0.11 1.70 0.00 -1.26 -5.04 119.74 112.98 2gir s LYS 535 Ca 0.57 -1.07 -0.30 0.00 0.00 0.00 0.00 55.97 55.17 2gir s LYS 535 Cb -0.13 -4.09 -0.01 0.00 0.00 0.00 0.00 37.83 33.60 2gir s LYS 535 CO 0.55 -1.06 1.01 -0.51 0.00 0.00 0.00 175.35 175.34 2gir s LEU 536 N 2.09 4.24 0.24 2.77 1.02 -1.26 -5.04 118.68 122.74 2gir s LEU 536 Ca 0.09 1.53 0.09 0.00 0.02 0.00 0.00 54.13 55.86 2gir s LEU 536 Cb -0.21 -3.56 -0.04 0.00 0.02 0.00 0.00 46.19 42.40 2gir s LEU 536 CO 0.10 -0.46 -0.02 0.42 0.02 0.00 0.00 176.35 176.41 2gir s THR 537 N 2.06 3.42 0.28 5.49 -4.23 -1.26 -5.06 115.64 116.33 2gir s THR 537 Ca 0.48 -1.82 -0.29 0.00 -1.18 0.00 0.00 61.69 58.88 2gir s THR 537 Cb -0.18 -2.79 -0.14 0.00 1.34 0.00 0.00 72.50 70.73 2gir s THR 537 CO 0.17 -0.30 1.07 -2.65 -0.54 0.00 0.00 174.62 172.38 2gir n PRO 538 N -0.64 1.44 -3.08 3.99 -0.02 -1.26 -4.93 135.00 130.50 2gir n PRO 538 Ca -0.08 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.49 2gir n PRO 538 Cb 0.58 -1.92 -0.06 0.00 -0.02 0.00 0.00 33.50 32.07 2gir n PRO 538 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2gir s ILE 539 N -0.92 4.83 0.20 4.25 1.01 -1.26 -4.96 121.20 124.34 2gir s ILE 539 Ca 0.60 0.43 -0.15 0.00 0.00 0.00 0.00 60.65 61.52 2gir s ILE 539 Cb -0.70 -4.16 0.19 0.00 0.01 0.00 0.00 42.46 37.80 2gir s ILE 539 CO 0.59 -0.47 1.63 -0.65 0.00 0.00 0.00 174.94 176.04 2gir h PRO 540 N 8.67 -0.04 -0.46 2.79 0.11 -2.04 0.40 132.00 141.44 2gir h PRO 540 Ca -0.26 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.99 2gir h PRO 540 Cb 1.10 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2gir h PRO 540 CO 0.88 -0.02 0.41 0.00 -0.21 0.00 0.00 178.00 179.05 2gir h ALA 541 N 1.47 2.27 0.00 -0.75 0.00 -2.00 -2.01 119.26 118.23 2gir h ALA 541 Ca 0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2gir h ALA 541 Cb 0.45 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2gir h ALA 541 CO -0.60 -0.65 -0.08 0.00 0.00 0.00 0.00 179.25 177.92 2gir h ALA 542 N 1.61 1.63 0.00 0.00 0.00 -1.23 -1.56 119.26 119.71 2gir h ALA 542 Ca 0.22 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2gir h ALA 542 Cb 1.04 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2gir h ALA 542 CO -0.00 0.10 -0.11 1.03 0.00 0.00 0.00 179.25 180.26 2gir h SER 543 N 0.00 0.00 -0.62 0.00 0.87 -1.48 -3.22 113.55 109.10 2gir h SER 543 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2gir h SER 543 Cb 0.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 2gir h SER 543 CO 0.01 0.11 0.00 0.54 -0.53 0.00 0.00 176.83 176.96 2gir n ARG 544 N -3.26 3.52 -2.78 2.24 1.74 -0.59 -4.93 116.66 112.59 2gir n ARG 544 Ca 0.00 -2.80 -0.41 0.00 -0.77 0.00 0.00 57.85 53.87 2gir n ARG 544 Cb 0.36 -1.81 -0.04 0.00 -1.02 0.00 0.00 32.46 29.95 2gir n ARG 544 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2gir s LEU 545 N -1.73 4.45 -0.92 0.55 1.43 -1.22 -5.01 118.68 116.23 2gir s LEU 545 Ca 0.49 1.67 -0.19 0.00 -1.03 0.00 0.00 54.13 55.07 2gir s LEU 545 Cb 0.31 -3.50 0.13 0.00 0.03 0.00 0.00 46.19 43.15 2gir s LEU 545 CO 0.24 -0.10 1.13 -0.62 0.23 0.00 0.00 176.35 177.23 2gir s ASP 546 N 0.28 6.60 -0.38 2.29 2.15 -1.26 -4.83 116.67 121.52 2gir s ASP 546 Ca 0.46 -1.98 0.06 0.00 0.43 0.00 0.00 52.55 51.52 2gir s ASP 546 Cb -0.22 -2.41 0.66 0.00 -0.30 0.00 0.00 42.92 40.66 2gir s ASP 546 CO 0.28 -1.09 1.82 0.18 -0.17 0.00 0.00 175.17 176.18 2gir n LEU 547 N 6.68 6.28 -4.78 -1.34 4.32 -1.26 -4.93 117.00 121.96 2gir n LEU 547 Ca 0.23 -3.32 -0.37 0.00 -0.02 0.00 0.00 56.01 52.54 2gir n LEU 547 Cb 0.49 -0.79 -0.04 0.00 -1.62 0.00 0.00 43.42 41.47 2gir n LEU 547 CO 0.51 0.92 0.75 -0.94 -1.22 0.00 0.00 177.39 177.41 2gir s SER 548 N -1.06 6.72 0.00 -1.43 1.04 -1.26 -2.94 113.70 114.77 2gir s SER 548 Ca 0.53 2.09 0.00 0.00 0.48 0.00 0.00 55.95 59.05 2gir s SER 548 Cb 0.44 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.97 2gir s SER 548 CO 0.11 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.42 2gir n GLY 549 N 0.40 3.08 3.75 7.32 0.00 -1.26 -5.03 105.19 113.45 2gir n GLY 549 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 2gir n GLY 549 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2gir s TRP 550 N -2.15 3.83 -1.33 1.61 0.52 -1.15 -4.19 118.94 116.07 2gir s TRP 550 Ca 0.00 1.62 -0.04 0.00 0.02 0.00 0.00 56.10 57.70 2gir s TRP 550 Cb 0.00 -2.86 0.02 0.00 -1.15 0.00 0.00 33.47 29.48 2gir s TRP 550 CO 0.00 0.36 0.92 1.19 0.02 0.00 0.00 176.95 179.44 2gir n PHE 551 N 2.28 -2.23 -0.09 -1.98 3.72 -1.26 -4.89 117.46 113.01 2gir n PHE 551 Ca -0.03 0.91 -0.18 0.00 -0.05 0.00 0.00 57.45 58.11 2gir n PHE 551 Cb 0.49 -4.60 -0.07 0.00 -0.94 0.00 0.00 39.48 34.36 2gir n PHE 551 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2gir n VAL 552 N -4.45 0.98 -3.79 -4.37 0.31 -1.20 -4.12 118.33 101.69 2gir n VAL 552 Ca -0.18 -0.28 -0.09 0.00 -0.01 0.00 0.00 64.34 63.78 2gir n VAL 552 Cb 0.63 -1.60 -0.04 0.00 -0.91 0.00 0.00 33.84 31.92 2gir n VAL 552 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gir s ALA 553 N -2.33 -0.83 0.05 3.52 0.00 -1.24 -3.91 121.76 117.01 2gir s ALA 553 Ca -0.25 -0.33 -0.09 0.00 0.00 0.00 0.00 51.96 51.29 2gir s ALA 553 Cb 0.09 0.88 -0.05 0.00 0.00 0.00 0.00 23.12 24.03 2gir s ALA 553 CO 0.33 -0.82 0.36 0.20 0.00 0.00 0.00 175.76 175.83 2gir s GLY 554 N -2.90 2.32 -0.01 0.00 0.00 -1.26 -4.91 107.32 100.57 2gir s GLY 554 Ca 0.11 -0.43 0.10 0.00 0.00 0.00 0.00 44.72 44.50 2gir s GLY 554 CO -0.01 -0.21 1.07 -1.72 0.00 0.00 0.00 173.10 172.22 2gir n TYR 555 N 1.05 0.00 -1.68 1.90 4.01 0.12 -4.53 117.16 118.03 2gir n TYR 555 Ca -0.10 -0.22 -0.50 0.00 -0.16 0.00 0.00 57.90 56.92 2gir n TYR 555 Cb 0.52 -0.09 -0.05 0.00 -0.31 0.00 0.00 39.34 39.41 2gir n TYR 555 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2gir n SER 556 N 0.13 3.00 0.00 7.72 2.88 -1.25 0.02 113.62 126.12 2gir n SER 556 Ca 0.03 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.59 2gir n SER 556 Cb 0.86 -1.31 0.00 0.00 -0.75 0.00 0.00 64.21 63.00 2gir n SER 556 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gir n GLY 557 N 4.03 1.52 0.95 0.46 0.00 -1.26 -3.89 105.19 107.01 2gir n GLY 557 Ca 0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 2gir n GLY 557 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gir n GLY 558 N -2.00 1.20 3.22 -0.02 0.00 0.10 -3.00 105.19 104.70 2gir n GLY 558 Ca 0.00 -0.64 -0.15 0.00 0.00 0.00 0.00 46.02 45.23 2gir n GLY 558 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2gir n ASP 559 N 1.12 -2.95 -4.30 1.61 2.03 -1.26 -4.55 116.55 108.25 2gir n ASP 559 Ca 0.18 -0.59 -0.32 0.00 0.52 0.00 0.00 54.79 54.58 2gir n ASP 559 Cb 0.52 -4.81 -0.16 0.00 -0.72 0.00 0.00 41.12 35.96 2gir n ASP 559 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2gir s ILE 560 N -3.34 2.38 -0.13 5.18 -1.09 -1.26 -4.34 121.20 118.60 2gir s ILE 560 Ca 0.09 -0.93 0.01 0.00 -2.23 0.00 0.00 60.65 57.59 2gir s ILE 560 Cb -0.01 -1.92 0.02 0.00 -1.58 0.00 0.00 42.46 38.97 2gir s ILE 560 CO 0.68 0.56 -0.16 -0.47 -1.23 0.00 0.00 174.94 174.32 2gir s TYR 561 N 0.01 2.20 0.00 3.97 5.04 0.41 -0.36 117.35 128.62 2gir s TYR 561 Ca -0.07 -1.14 0.00 0.00 -2.44 0.00 0.00 57.07 53.42 2gir s TYR 561 Cb -0.15 -1.58 0.00 0.00 0.35 0.00 0.00 41.96 40.59 2gir s TYR 561 CO 0.05 -0.59 0.00 0.72 -1.34 0.00 0.00 175.55 174.40