#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 4.80 0.31 -0.41 1.00 -1.26 -1.51 119.30 122.23 2gir s MET 2 Ca 0.00 1.56 -0.01 0.00 0.00 0.00 0.00 55.69 57.24 2gir s MET 2 Cb 0.00 -3.26 0.47 0.00 0.00 0.00 0.00 34.83 32.04 2gir s MET 2 CO 0.00 0.44 1.95 0.66 0.00 0.00 0.00 175.02 178.07 2gir h SER 3 N 4.11 0.87 -5.07 3.03 4.64 -1.43 -3.41 113.55 116.29 2gir h SER 3 Ca -0.45 -0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 60.68 2gir h SER 3 Cb 1.20 -0.22 -0.18 0.00 -0.31 0.00 0.00 62.40 62.89 2gir h SER 3 CO 0.68 0.67 -0.55 -0.31 -0.87 0.00 0.00 176.83 176.45 2gir s TYR 4 N -5.74 0.21 0.07 4.77 2.02 -1.26 -1.08 117.35 116.33 2gir s TYR 4 Ca -0.11 -0.49 0.09 0.00 -0.37 0.00 0.00 57.07 56.19 2gir s TYR 4 Cb 0.17 -0.15 -0.03 0.00 -0.40 0.00 0.00 41.96 41.55 2gir s TYR 4 CO 0.79 -0.33 -0.25 0.95 -1.57 0.00 0.00 175.55 175.14 2gir s THR 5 N -2.35 2.05 0.05 -0.71 -4.23 -0.51 -4.86 115.64 105.09 2gir s THR 5 Ca -0.07 -1.46 0.08 0.00 -1.18 0.00 0.00 61.69 59.05 2gir s THR 5 Cb -0.03 -1.78 -0.03 0.00 1.34 0.00 0.00 72.50 72.00 2gir s THR 5 CO -0.03 0.23 -0.22 0.26 -0.54 0.00 0.00 174.62 174.32 2gir s TRP 6 N -0.90 1.90 -0.05 3.99 0.52 -1.26 -0.88 118.94 122.27 2gir s TRP 6 Ca 0.11 -0.38 0.13 0.00 0.02 0.00 0.00 56.10 55.98 2gir s TRP 6 Cb -0.10 -1.13 -0.20 0.00 -1.15 0.00 0.00 33.47 30.89 2gir s TRP 6 CO 0.03 0.10 0.79 1.79 0.02 0.00 0.00 176.95 179.68 2gir h THR 7 N 4.32 0.86 0.00 2.01 1.35 -1.22 -3.47 112.91 116.76 2gir h THR 7 Ca -0.43 -2.60 0.00 0.00 -0.55 0.00 0.00 66.41 62.83 2gir h THR 7 Cb 1.16 2.37 0.00 0.00 -1.73 0.00 0.00 68.15 69.95 2gir h THR 7 CO 0.44 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.80 2gir n GLY 8 N 1.49 1.40 3.76 5.82 0.00 -1.26 -5.07 105.19 111.32 2gir n GLY 8 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.14 2.89 0.44 4.61 0.00 -1.26 -4.99 121.76 121.31 2gir s ALA 9 Ca 0.00 1.19 -0.10 0.00 0.00 0.00 0.00 51.96 53.04 2gir s ALA 9 Cb 0.00 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.56 2gir s ALA 9 CO 0.00 -1.10 0.81 -0.51 0.00 0.00 0.00 175.76 174.96 2gir s LEU 10 N -3.31 3.75 -0.25 0.00 1.43 -1.26 -4.82 118.68 114.21 2gir s LEU 10 Ca 0.68 1.16 -0.28 0.00 -1.03 0.00 0.00 54.13 54.66 2gir s LEU 10 Cb -0.36 -4.07 0.01 0.00 0.03 0.00 0.00 46.19 41.80 2gir s LEU 10 CO 0.43 -0.47 0.99 -0.63 0.23 0.00 0.00 176.35 176.90 2gir s ILE 11 N -2.50 4.68 0.07 -0.59 1.01 -1.26 -4.79 121.20 117.82 2gir s ILE 11 Ca 0.52 1.84 0.04 0.00 0.00 0.00 0.00 60.65 63.04 2gir s ILE 11 Cb -0.10 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.04 2gir s ILE 11 CO 0.35 -0.22 -0.01 0.42 0.00 0.00 0.00 174.94 175.47 2gir s THR 12 N 3.20 3.98 0.72 2.92 -4.23 -1.26 -4.87 115.64 116.10 2gir s THR 12 Ca 0.42 -0.91 -0.11 0.00 -1.18 0.00 0.00 61.69 59.91 2gir s THR 12 Cb -0.14 -2.86 0.03 0.00 1.34 0.00 0.00 72.50 70.87 2gir s THR 12 CO 0.08 0.19 1.08 -2.16 -0.54 0.00 0.00 174.62 173.27 2gir s PRO 13 N -2.08 2.63 -0.07 3.99 0.04 -1.26 -4.32 135.00 133.93 2gir s PRO 13 Ca 0.24 1.09 0.02 0.00 0.04 0.00 0.00 61.00 62.39 2gir s PRO 13 Cb -0.12 -1.95 -0.25 0.00 0.04 0.00 0.00 34.50 32.23 2gir s PRO 13 CO 0.16 -1.35 0.57 0.00 0.04 0.00 0.00 177.00 176.41 2gir n ALA 15 N -2.76 0.06 -1.85 0.00 0.00 -1.26 -5.13 120.51 109.58 2gir n ALA 15 Ca -0.23 -0.51 -0.41 0.00 0.00 0.00 0.00 53.44 52.28 2gir n ALA 15 Cb 1.05 0.41 -0.02 0.00 0.00 0.00 0.00 19.45 20.89 2gir n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gir s ALA 16 N -2.17 3.66 -0.07 0.00 0.00 -1.26 -5.00 121.76 116.93 2gir s ALA 16 Ca 0.10 1.40 0.02 0.00 0.00 0.00 0.00 51.96 53.47 2gir s ALA 16 Cb 0.00 -3.58 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 2gir s ALA 16 CO 0.07 -0.81 -0.10 -1.21 0.00 0.00 0.00 175.76 173.71 2gir s GLU 17 N -0.38 2.71 -0.12 0.00 2.02 -1.26 -5.11 118.70 116.56 2gir s GLU 17 Ca 0.61 -0.61 -0.03 0.00 0.02 0.00 0.00 54.97 54.96 2gir s GLU 17 Cb -0.44 -2.52 -0.03 0.00 0.10 0.00 0.00 34.13 31.24 2gir s GLU 17 CO 0.44 0.62 -0.01 -1.21 0.02 0.00 0.00 175.26 175.12 2gir s GLU 18 N -0.70 3.34 -0.14 1.61 2.02 -1.26 -5.00 118.70 118.57 2gir s GLU 18 Ca 0.11 -0.44 0.10 0.00 0.02 0.00 0.00 54.97 54.75 2gir s GLU 18 Cb -0.11 -2.88 -0.15 0.00 0.10 0.00 0.00 34.13 31.09 2gir s GLU 18 CO 0.01 0.49 0.01 -1.13 0.02 0.00 0.00 175.26 174.66 2gir n SER 19 N 2.80 1.95 -4.82 -0.19 3.41 -1.26 -4.56 113.62 110.94 2gir n SER 19 Ca -0.18 -0.02 -0.36 0.00 -0.26 0.00 0.00 58.87 58.05 2gir n SER 19 Cb 0.53 0.61 -0.06 0.00 -0.26 0.00 0.00 64.21 65.03 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 -2.32 4.17 -0.16 4.33 1.02 -1.26 -1.27 119.74 124.25 2gir s LYS 20 Ca -0.10 0.76 -0.32 0.00 0.02 0.00 0.00 55.97 56.33 2gir s LYS 20 Cb 0.04 -2.89 -0.09 0.00 -0.52 0.00 0.00 37.83 34.37 2gir s LYS 20 CO 0.51 0.42 2.07 -0.11 -0.92 0.00 0.00 175.35 177.32 2gir n LEU 21 N 0.74 3.27 -4.77 3.17 7.94 -1.25 -4.90 117.00 121.20 2gir n LEU 21 Ca -0.03 0.60 -0.39 0.00 -1.11 0.00 0.00 56.01 55.08 2gir n LEU 21 Cb 0.51 -1.44 -0.00 0.00 0.53 0.00 0.00 43.42 43.02 2gir n LEU 21 CO 0.43 -0.35 0.93 -2.84 -1.11 0.00 0.00 177.39 174.45 2gir s PRO 22 N 5.32 3.85 -0.07 1.96 0.02 -1.26 -5.02 135.00 139.81 2gir s PRO 22 Ca 0.98 2.07 0.06 0.00 0.02 0.00 0.00 61.00 64.13 2gir s PRO 22 Cb -0.56 -2.64 -0.01 0.00 0.02 0.00 0.00 34.50 31.32 2gir s PRO 22 CO 0.44 -0.56 -0.24 0.42 -0.33 0.00 0.00 177.00 176.72 2gir s ILE 23 N -1.33 2.03 0.00 2.83 -1.09 -1.26 -4.72 121.20 117.66 2gir s ILE 23 Ca 0.60 -1.04 0.00 0.00 -2.23 0.00 0.00 60.65 57.97 2gir s ILE 23 Cb -0.36 -1.72 0.00 0.00 -1.58 0.00 0.00 42.46 38.80 2gir s ILE 23 CO 0.45 0.56 0.00 -0.46 -1.23 0.00 0.00 174.94 174.26 2gir n ASN 24 N 3.08 0.94 0.21 3.58 6.94 -1.26 -5.02 115.26 123.74 2gir n ASN 24 Ca -0.18 -0.81 0.15 0.00 -0.02 0.00 0.00 54.58 53.72 2gir n ASN 24 Cb 0.52 0.00 0.70 0.00 -2.36 0.00 0.00 39.78 38.64 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 -2.92 119.26 113.81 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 -1.63 1.28 0.00 0.00 0.00 179.25 178.90 2gir n LEU 26 N -2.60 0.30 -0.05 0.00 4.77 -1.26 -4.62 117.00 113.54 2gir n LEU 26 Ca -0.00 -0.01 -0.08 0.00 -0.03 0.00 0.00 56.01 55.89 2gir n LEU 26 Cb 0.17 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 2gir n LEU 26 CO 0.19 0.01 0.88 0.28 -1.33 0.00 0.00 177.39 177.41 2gir h SER 27 N 0.00 -0.03 0.50 -1.43 0.02 -1.86 -2.24 113.55 108.51 2gir h SER 27 Ca 0.00 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2gir h SER 27 Cb 0.91 0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.52 2gir h SER 27 CO 0.00 0.01 -0.06 0.78 -1.14 0.00 0.00 176.83 176.42 2gir h ASN 28 N 0.11 0.00 0.39 3.07 2.35 -1.79 -0.38 115.58 119.33 2gir h ASN 28 Ca 0.10 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.80 2gir h ASN 28 Cb 0.12 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 2gir h ASN 28 CO -0.15 0.06 -0.24 0.77 -1.65 0.00 0.00 177.43 176.22 2gir h SER 29 N 0.00 0.00 0.03 5.81 4.64 -1.69 -3.27 113.55 119.06 2gir h SER 29 Ca -0.00 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.03 2gir h SER 29 Cb 0.33 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.38 2gir h SER 29 CO 0.01 0.24 -1.56 -0.11 -0.87 0.00 0.00 176.83 174.53 2gir n LEU 30 N -3.90 2.07 -3.68 5.97 7.94 -0.25 -4.62 117.00 120.53 2gir n LEU 30 Ca -0.02 0.36 -0.11 0.00 -1.11 0.00 0.00 56.01 55.13 2gir n LEU 30 Cb 0.32 -0.99 -0.09 0.00 0.53 0.00 0.00 43.42 43.19 2gir n LEU 30 CO 0.35 0.45 0.20 -0.22 -1.11 0.00 0.00 177.39 177.05 2gir s LEU 31 N -7.63 -0.29 -0.15 -1.96 0.20 -0.63 -4.15 118.68 104.08 2gir s LEU 31 Ca -0.28 1.13 0.13 0.00 0.69 0.00 0.00 54.13 55.79 2gir s LEU 31 Cb 0.07 1.81 -0.24 0.00 -0.43 0.00 0.00 46.19 47.40 2gir s LEU 31 CO 0.62 -0.20 0.26 0.54 -0.29 0.00 0.00 176.35 177.28 2gir n ARG 32 N 3.66 0.67 -2.07 1.98 1.74 -0.32 -4.01 116.66 118.31 2gir n ARG 32 Ca -0.18 0.13 -0.42 0.00 -0.77 0.00 0.00 57.85 56.61 2gir n ARG 32 Cb 0.57 -1.63 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 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 -2.96 3.17 0.25 -1.55 8.25 -0.68 -4.76 115.22 116.94 2gir n HIS 33 Ca -0.29 -2.87 0.08 0.00 -0.26 0.00 0.00 57.72 54.38 2gir n HIS 33 Cb 1.10 -2.20 0.60 0.00 1.12 0.00 0.00 29.99 30.61 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 5.83 0.00 0.00 4.41 3.86 -1.85 -2.25 115.15 125.15 2gir h HIS 34 Ca 0.47 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.68 2gir h HIS 34 Cb 0.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.10 2gir h HIS 34 CO 1.34 0.10 0.00 0.09 0.86 0.00 0.00 177.93 180.33 2gir n ASN 35 N -4.30 0.17 0.22 2.45 3.02 -1.26 -2.12 115.26 113.44 2gir n ASN 35 Ca -0.03 0.54 0.11 0.00 -0.03 0.00 0.00 54.58 55.17 2gir n ASN 35 Cb 0.18 -0.57 0.29 0.00 -0.61 0.00 0.00 39.78 39.07 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 -5.55 3.52 2.86 -1.81 -3.46 114.93 110.49 2gir h MET 36 Ca 0.00 0.00 -0.65 0.00 -2.06 0.00 0.00 59.70 56.99 2gir h MET 36 Cb 0.32 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 31.88 2gir h MET 36 CO 0.00 0.12 -0.51 0.08 1.06 0.00 0.00 176.91 177.66 2gir s VAL 37 N -3.32 5.28 0.14 -2.22 1.01 -0.90 -0.39 120.40 119.99 2gir s VAL 37 Ca 0.04 0.13 -0.11 0.00 0.00 0.00 0.00 61.98 62.04 2gir s VAL 37 Cb 0.07 -3.33 0.01 0.00 0.00 0.00 0.00 36.38 33.13 2gir s VAL 37 CO 0.65 0.56 0.31 -0.72 0.00 0.00 0.00 175.10 175.91 2gir s TYR 38 N -0.55 0.14 -0.01 5.22 1.13 -0.72 -3.85 117.35 118.71 2gir s TYR 38 Ca 0.12 -0.51 0.06 0.00 -1.41 0.00 0.00 57.07 55.32 2gir s TYR 38 Cb -0.12 0.07 -0.03 0.00 -1.10 0.00 0.00 41.96 40.78 2gir s TYR 38 CO 0.02 -0.70 -0.17 0.00 -2.51 0.00 0.00 175.55 172.19 2gir s ALA 39 N -3.89 2.56 0.49 9.51 0.00 -0.40 -1.18 121.76 128.86 2gir s ALA 39 Ca 0.10 -1.08 -0.21 0.00 0.00 0.00 0.00 51.96 50.77 2gir s ALA 39 Cb 0.03 -0.82 -0.07 0.00 0.00 0.00 0.00 23.12 22.26 2gir s ALA 39 CO -0.06 0.56 1.13 0.95 0.00 0.00 0.00 175.76 178.35 2gir s THR 40 N -0.78 3.22 0.30 0.00 -4.23 0.03 -4.53 115.64 109.64 2gir s THR 40 Ca 0.12 0.83 0.03 0.00 -1.18 0.00 0.00 61.69 61.49 2gir s THR 40 Cb -0.10 -3.38 -0.04 0.00 1.34 0.00 0.00 72.50 70.31 2gir s THR 40 CO 0.02 -0.09 0.13 0.42 -0.54 0.00 0.00 174.62 174.56 2gir s THR 41 N -1.68 0.49 0.46 3.99 -4.23 -1.26 -4.01 115.64 109.39 2gir s THR 41 Ca 0.68 -2.00 0.41 0.00 -1.18 0.00 0.00 61.69 59.59 2gir s THR 41 Cb -0.25 -2.56 0.42 0.00 1.34 0.00 0.00 72.50 71.45 2gir s THR 41 CO 0.30 0.00 2.23 0.77 -0.54 0.00 0.00 174.62 177.38 2gir h SER 42 N 2.23 0.00 -0.43 3.99 4.64 -1.87 -2.49 113.55 119.63 2gir h SER 42 Ca -0.36 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.09 2gir h SER 42 Cb 1.25 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 2gir h SER 42 CO 0.57 0.00 0.34 0.03 -0.87 0.00 0.00 176.83 176.90 2gir h ARG 43 N 0.00 0.00 -0.12 4.77 3.08 -1.96 -1.02 114.38 119.13 2gir h ARG 43 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2gir h ARG 43 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 2gir h ARG 43 CO 0.00 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.77 2gir n SER 44 N -4.19 2.61 -0.02 7.04 3.41 -0.94 -4.55 113.62 116.98 2gir n SER 44 Ca 0.07 -1.85 0.02 0.00 -0.26 0.00 0.00 58.87 56.85 2gir n SER 44 Cb 0.53 -0.07 0.36 0.00 -0.26 0.00 0.00 64.21 64.78 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 4.51 1.56 -0.49 7.33 0.00 -1.32 -1.49 119.26 129.37 2gir h ALA 45 Ca 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2gir h ALA 45 Cb 0.82 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2gir h ALA 45 CO 0.00 0.35 0.25 0.78 0.00 0.00 0.00 179.25 180.64 2gir h GLY 46 N 0.70 0.71 0.90 0.00 0.00 -1.80 0.69 103.07 104.27 2gir h GLY 46 Ca 0.15 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 2gir h GLY 46 CO -0.02 0.30 0.03 1.41 0.00 0.00 0.00 176.54 178.25 2gir h LEU 47 N 0.67 0.53 -0.44 3.11 3.38 -1.61 -2.65 115.31 118.31 2gir h LEU 47 Ca 0.17 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.88 2gir h LEU 47 Cb 0.04 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 2gir h LEU 47 CO -0.03 0.68 0.24 -0.09 0.09 0.00 0.00 178.44 179.34 2gir h ARG 48 N 0.36 0.47 -0.84 1.13 9.65 -1.22 -2.30 114.38 121.62 2gir h ARG 48 Ca 0.09 -0.03 0.16 0.00 -1.10 0.00 0.00 59.98 59.11 2gir h ARG 48 Cb 0.40 -0.11 -0.10 0.00 -1.39 0.00 0.00 29.97 28.77 2gir h ARG 48 CO 0.01 0.31 0.39 1.96 2.80 0.00 0.00 179.97 185.44 2gir h GLN 49 N 0.48 0.51 -0.04 0.20 4.20 -0.78 -0.39 115.11 119.29 2gir h GLN 49 Ca 0.18 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 2gir h GLN 49 Cb 0.05 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.71 2gir h GLN 49 CO -0.10 0.34 0.02 0.87 -0.67 0.00 0.00 178.83 179.28 2gir h LYS 50 N 0.52 0.06 -0.77 1.46 1.57 -1.10 -2.64 116.57 115.67 2gir h LYS 50 Ca 0.48 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 59.28 2gir h LYS 50 Cb 0.75 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.01 2gir h LYS 50 CO -0.41 0.12 0.51 -0.22 -0.57 0.00 0.00 179.45 178.88 2gir h LYS 51 N -0.03 0.94 -0.01 3.15 1.63 -0.63 -2.81 116.57 118.81 2gir h LYS 51 Ca 0.01 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2gir h LYS 51 Cb 0.08 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.50 2gir h LYS 51 CO -0.00 0.62 -0.27 1.33 -3.45 0.00 0.00 179.45 177.68 2gir n VAL 52 N -4.44 0.00 -3.56 2.00 0.24 -0.30 -4.79 118.33 107.48 2gir n VAL 52 Ca 0.09 -0.12 -0.41 0.00 -2.04 0.00 0.00 64.34 61.87 2gir n VAL 52 Cb 0.09 0.38 -0.11 0.00 -1.47 0.00 0.00 33.84 32.73 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 -2.54 4.75 0.25 3.34 2.01 -1.01 -4.68 115.64 117.77 2gir s THR 53 Ca 0.23 -0.83 -0.21 0.00 0.31 0.00 0.00 61.69 61.19 2gir s THR 53 Cb 0.19 -3.66 0.03 0.00 0.01 0.00 0.00 72.50 69.07 2gir s THR 53 CO 0.53 -0.27 0.68 0.72 -0.69 0.00 0.00 174.62 175.59 2gir s PHE 54 N 1.58 -0.27 0.09 4.92 -0.12 -1.26 -4.95 117.98 117.96 2gir s PHE 54 Ca 0.03 -0.12 -0.24 0.00 -0.05 0.00 0.00 56.93 56.55 2gir s PHE 54 Cb -0.19 0.66 -0.06 0.00 -0.63 0.00 0.00 43.02 42.79 2gir s PHE 54 CO 0.07 -1.13 0.73 0.34 -0.05 0.00 0.00 175.22 175.19 2gir s ASP 55 N -2.88 7.24 -0.16 1.98 2.15 -1.26 -1.14 116.67 122.60 2gir s ASP 55 Ca 0.08 1.47 -0.05 0.00 0.43 0.00 0.00 52.55 54.49 2gir s ASP 55 Cb -0.05 -2.46 -0.03 0.00 -0.30 0.00 0.00 42.92 40.09 2gir s ASP 55 CO 0.02 0.12 -0.00 -0.13 -0.17 0.00 0.00 175.17 175.00 2gir s ARG 56 N -0.57 3.77 0.02 4.34 3.00 -0.57 -4.97 118.95 123.98 2gir s ARG 56 Ca 0.36 -0.46 0.04 0.00 0.00 0.00 0.00 55.73 55.67 2gir s ARG 56 Cb -0.21 -3.02 -0.03 0.00 0.00 0.00 0.00 34.95 31.69 2gir s ARG 56 CO 0.23 0.25 -0.09 -0.51 0.00 0.00 0.00 175.30 175.18 2gir s LEU 57 N 0.37 3.06 -0.07 2.53 1.02 -1.26 -4.70 118.68 119.63 2gir s LEU 57 Ca -0.02 -0.22 -0.03 0.00 0.02 0.00 0.00 54.13 53.88 2gir s LEU 57 Cb -0.14 -1.77 0.04 0.00 0.02 0.00 0.00 46.19 44.34 2gir s LEU 57 CO 0.02 0.27 0.13 -1.58 0.02 0.00 0.00 176.35 175.21 2gir s GLN 58 N -1.51 0.03 -0.24 1.70 0.74 -1.26 -3.88 119.66 115.24 2gir s GLN 58 Ca 0.17 0.45 0.02 0.00 0.05 0.00 0.00 55.36 56.06 2gir s GLN 58 Cb -0.11 -0.27 0.05 0.00 1.10 0.00 0.00 33.01 33.78 2gir s GLN 58 CO 0.08 -0.26 -0.11 0.08 -0.55 0.00 0.00 175.29 174.54 2gir s VAL 59 N 1.85 1.95 -0.23 1.34 1.01 -0.13 -5.03 120.40 121.17 2gir s VAL 59 Ca -0.01 -1.40 -0.08 0.00 0.00 0.00 0.00 61.98 60.49 2gir s VAL 59 Cb -0.12 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 2gir s VAL 59 CO -0.05 0.03 0.08 -0.76 0.00 0.00 0.00 175.10 174.40 2gir s LEU 60 N 1.22 3.64 0.00 3.92 1.43 -1.26 -4.40 118.68 123.22 2gir s LEU 60 Ca -0.06 -0.08 0.01 0.00 -1.03 0.00 0.00 54.13 52.98 2gir s LEU 60 Cb -0.19 -1.96 0.01 0.00 0.03 0.00 0.00 46.19 44.09 2gir s LEU 60 CO -0.06 0.05 0.12 -0.90 0.23 0.00 0.00 176.35 175.78 2gir n ASP 61 N 4.39 1.71 0.07 2.29 5.75 -1.26 -4.99 116.55 124.52 2gir n ASP 61 Ca -0.16 -1.66 -0.04 0.00 -0.01 0.00 0.00 54.79 52.91 2gir n ASP 61 Cb 0.52 0.00 0.16 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 0.25 0.32 -0.89 -1.12 3.32 -1.99 -1.94 116.42 114.38 2gir h ASP 62 Ca -0.12 -0.15 0.05 0.00 0.02 0.00 0.00 57.03 56.82 2gir h ASP 62 Cb 0.44 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 39.84 2gir h ASP 62 CO 0.19 0.76 0.56 0.45 -1.72 0.00 0.00 179.24 179.49 2gir h HIS 63 N 0.24 1.05 -0.07 4.55 3.86 -1.96 0.21 115.15 123.02 2gir h HIS 63 Ca 0.01 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 2gir h HIS 63 Cb 0.95 -0.34 -0.00 0.00 1.06 0.00 0.00 27.41 29.07 2gir h HIS 63 CO 0.02 0.56 0.03 -0.92 0.86 0.00 0.00 177.93 178.48 2gir h TYR 64 N 1.05 0.10 -0.16 2.45 3.20 -1.69 -2.02 116.97 119.90 2gir h TYR 64 Ca 0.37 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 62.13 2gir h TYR 64 Cb 0.11 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 2gir h TYR 64 CO -0.02 0.18 -0.40 0.00 -1.64 0.00 0.00 178.16 176.28 2gir h ARG 65 N -0.00 0.35 0.03 1.82 3.08 -1.09 -1.65 114.38 116.92 2gir h ARG 65 Ca 0.02 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 2gir h ARG 65 Cb 0.11 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2gir h ARG 65 CO -0.00 0.70 -0.02 -0.44 -1.07 0.00 0.00 179.97 179.14 2gir h ASP 66 N 0.29 -0.04 -0.66 7.04 3.32 -0.52 -0.58 116.42 125.28 2gir h ASP 66 Ca 0.03 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 2gir h ASP 66 Cb 0.84 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.37 2gir h ASP 66 CO 0.07 0.04 0.29 0.58 -1.72 0.00 0.00 179.24 178.50 2gir h VAL 67 N -0.11 1.23 -0.60 -1.35 2.07 -1.27 -2.55 116.25 113.67 2gir h VAL 67 Ca -0.00 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 66.84 2gir h VAL 67 Cb 0.10 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 2gir h VAL 67 CO 0.01 0.28 0.40 0.25 0.02 0.00 0.00 177.57 178.52 2gir h LEU 68 N 0.92 0.68 -0.81 2.57 5.85 -1.12 -0.73 115.31 122.67 2gir h LEU 68 Ca 0.22 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 59.00 2gir h LEU 68 Cb 0.16 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.95 2gir h LEU 68 CO -0.02 0.49 0.48 0.50 -0.34 0.00 0.00 178.44 179.55 2gir h LYS 69 N 0.81 0.84 -0.43 1.25 3.64 -0.82 -0.59 116.57 121.25 2gir h LYS 69 Ca 0.22 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 2gir h LYS 69 Cb -0.08 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.53 2gir h LYS 69 CO -0.05 0.55 -0.18 0.93 -2.27 0.00 0.00 179.45 178.43 2gir h GLU 70 N 0.86 0.84 -0.45 1.90 5.08 -0.98 -1.71 114.58 120.11 2gir h GLU 70 Ca 0.37 -0.32 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 2gir h GLU 70 Cb 0.23 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 2gir h GLU 70 CO -0.20 0.95 0.01 0.52 -1.00 0.00 0.00 179.01 179.29 2gir h MET 71 N 0.74 0.79 -0.53 2.33 2.86 -0.48 -2.64 114.93 118.00 2gir h MET 71 Ca 0.11 -0.25 -0.06 0.00 -2.06 0.00 0.00 59.70 57.44 2gir h MET 71 Cb 0.70 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.26 2gir h MET 71 CO 0.05 0.85 0.08 0.87 1.06 0.00 0.00 176.91 179.82 2gir h LYS 72 N 0.64 0.85 -0.53 1.72 1.57 -0.98 -0.19 116.57 119.65 2gir h LYS 72 Ca 0.13 -0.20 0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2gir h LYS 72 Cb 0.48 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 2gir h LYS 72 CO 0.02 0.80 0.33 0.00 -0.57 0.00 0.00 179.45 180.03 2gir h ALA 73 N 1.28 0.67 -0.37 3.86 0.00 -1.15 -0.31 119.26 123.25 2gir h ALA 73 Ca 0.17 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2gir h ALA 73 Cb 0.37 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2gir h ALA 73 CO 0.01 0.06 -0.01 0.87 0.00 0.00 0.00 179.25 180.18 2gir h LYS 74 N 0.67 0.66 -0.63 0.00 1.57 -1.25 -3.09 116.57 114.51 2gir h LYS 74 Ca 0.20 -0.22 0.08 0.00 -1.87 0.00 0.00 60.65 58.84 2gir h LYS 74 Cb -0.03 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 2gir h LYS 74 CO -0.07 0.77 0.42 0.00 -0.57 0.00 0.00 179.45 180.00 2gir h ALA 75 N 0.86 1.88 0.00 3.86 0.00 -0.62 -1.74 119.26 123.49 2gir h ALA 75 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2gir h ALA 75 Cb 0.48 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2gir h ALA 75 CO 0.02 0.00 0.04 0.66 0.00 0.00 0.00 179.25 179.98 2gir h SER 76 N 0.54 0.00 1.02 0.00 4.64 -0.97 -1.13 113.55 117.66 2gir h SER 76 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2gir h SER 76 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2gir h SER 76 CO -0.09 0.00 -0.25 0.35 -0.87 0.00 0.00 176.83 175.97 2gir n THR 77 N -3.03 0.28 -2.87 2.95 -2.24 -0.65 -4.62 114.28 104.09 2gir n THR 77 Ca -0.03 -0.16 -0.40 0.00 -2.27 0.00 0.00 64.05 61.19 2gir n THR 77 Cb 0.11 -0.30 -0.05 0.00 -2.10 0.00 0.00 70.33 67.99 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 -3.07 4.39 -0.12 2.28 1.01 -0.43 -4.96 120.40 119.50 2gir s VAL 78 Ca 0.10 1.87 0.02 0.00 0.00 0.00 0.00 61.98 63.97 2gir s VAL 78 Cb 0.15 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 32.30 2gir s VAL 78 CO 0.63 0.44 -0.19 -0.75 0.00 0.00 0.00 175.10 175.24 2gir s LYS 79 N -0.69 3.20 0.03 2.72 2.20 -1.26 -0.79 119.74 125.14 2gir s LYS 79 Ca 0.40 -0.79 0.06 0.00 -0.36 0.00 0.00 55.97 55.28 2gir s LYS 79 Cb -0.23 -2.48 -0.02 0.00 -1.51 0.00 0.00 37.83 33.59 2gir s LYS 79 CO 0.28 0.16 -0.16 0.00 -0.36 0.00 0.00 175.35 175.27 2gir s ALA 80 N 0.43 1.38 0.14 3.13 0.00 -0.74 -4.95 121.76 121.15 2gir s ALA 80 Ca -0.14 -0.85 0.04 0.00 0.00 0.00 0.00 51.96 51.02 2gir s ALA 80 Cb -0.17 -0.27 -0.04 0.00 0.00 0.00 0.00 23.12 22.64 2gir s ALA 80 CO 0.06 0.30 0.14 -1.59 0.00 0.00 0.00 175.76 174.67 2gir s LYS 81 N -0.92 2.96 0.13 0.00 -2.85 -1.26 -4.48 119.74 113.31 2gir s LYS 81 Ca 0.05 -0.80 -0.30 0.00 -1.00 0.00 0.00 55.97 53.92 2gir s LYS 81 Cb -0.08 -2.70 -0.06 0.00 -2.06 0.00 0.00 37.83 32.93 2gir s LYS 81 CO 0.01 0.51 0.95 -1.17 0.10 0.00 0.00 175.35 175.74 2gir s LEU 82 N -2.97 4.52 0.32 2.77 2.96 -1.26 -4.48 118.68 120.54 2gir s LEU 82 Ca 0.31 1.80 -0.25 0.00 -0.22 0.00 0.00 54.13 55.77 2gir s LEU 82 Cb -0.11 -3.58 -0.10 0.00 0.50 0.00 0.00 46.19 42.91 2gir s LEU 82 CO 0.24 -0.03 0.92 -0.76 -1.32 0.00 0.00 176.35 175.40 2gir s LEU 83 N -0.19 4.32 0.93 -0.68 1.02 -0.60 -5.06 118.68 118.43 2gir s LEU 83 Ca 0.46 1.79 -0.12 0.00 0.02 0.00 0.00 54.13 56.28 2gir s LEU 83 Cb -0.24 -4.00 0.15 0.00 0.02 0.00 0.00 46.19 42.12 2gir s LEU 83 CO 0.30 -0.07 1.09 -0.94 0.02 0.00 0.00 176.35 176.75 2gir s SER 84 N -1.64 3.15 0.18 2.29 1.04 -1.26 -4.68 113.70 112.78 2gir s SER 84 Ca 0.50 1.47 -0.13 0.00 0.48 0.00 0.00 55.95 58.28 2gir s SER 84 Cb -0.18 -2.15 0.15 0.00 0.10 0.00 0.00 66.02 63.95 2gir s SER 84 CO 0.23 -2.84 1.77 0.58 0.98 0.00 0.00 173.24 173.96 2gir h VAL 85 N -1.69 0.91 -0.60 5.02 2.07 -1.97 -1.61 116.25 118.38 2gir h VAL 85 Ca -0.51 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 2gir h VAL 85 Cb 1.29 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 2gir h VAL 85 CO 0.54 0.08 0.25 1.05 0.02 0.00 0.00 177.57 179.51 2gir h GLU 86 N 0.45 0.90 -0.20 1.57 9.09 -1.98 0.14 114.58 124.54 2gir h GLU 86 Ca 0.23 -0.16 0.02 0.00 0.05 0.00 0.00 59.36 59.51 2gir h GLU 86 Cb 0.18 -0.15 -0.02 0.00 -1.65 0.00 0.00 28.75 27.11 2gir h GLU 86 CO -0.19 0.76 0.05 0.93 0.05 0.00 0.00 179.01 180.61 2gir h GLU 87 N 0.83 0.13 -0.80 1.06 5.08 -1.87 -0.92 114.58 118.09 2gir h GLU 87 Ca 0.20 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.51 2gir h GLU 87 Cb 0.19 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 2gir h GLU 87 CO -0.02 0.09 0.31 0.00 -1.00 0.00 0.00 179.01 178.39 2gir h ALA 88 N 1.14 1.04 -0.83 3.43 0.00 -1.01 -2.72 119.26 120.31 2gir h ALA 88 Ca 0.09 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2gir h ALA 88 Cb 0.08 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 2gir h ALA 88 CO -0.11 0.67 0.50 0.00 0.00 0.00 0.00 179.25 180.31 2gir h LYS 90 N 1.14 0.00 -0.00 0.00 1.57 -0.87 -2.13 116.57 116.28 2gir h LYS 90 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2gir h LYS 90 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 2gir h LYS 90 CO -0.06 0.00 -0.03 1.28 -0.57 0.00 0.00 179.45 180.07 2gir n LEU 91 N -2.31 0.25 -4.68 2.94 4.77 -1.03 -4.86 117.00 112.08 2gir n LEU 91 Ca 0.03 0.05 -0.40 0.00 -0.03 0.00 0.00 56.01 55.65 2gir n LEU 91 Cb 0.28 -0.14 -0.05 0.00 -2.33 0.00 0.00 43.42 41.19 2gir n LEU 91 CO 0.23 0.04 0.45 -0.89 -1.33 0.00 0.00 177.39 175.90 2gir s THR 92 N -2.30 4.99 0.31 -5.08 2.01 -0.80 -0.24 115.64 114.53 2gir s THR 92 Ca 0.36 1.41 -0.29 0.00 0.31 0.00 0.00 61.69 63.48 2gir s THR 92 Cb 0.21 -4.04 -0.12 0.00 0.01 0.00 0.00 72.50 68.56 2gir s THR 92 CO 0.42 0.13 1.47 -2.65 -0.69 0.00 0.00 174.62 173.30 2gir n PRO 93 N 4.66 2.43 -0.31 4.92 -0.02 -1.26 -4.80 135.00 140.61 2gir n PRO 93 Ca 0.00 0.86 0.27 0.00 -2.02 0.00 0.00 63.50 62.61 2gir n PRO 93 Cb 0.50 -2.56 0.60 0.00 -0.02 0.00 0.00 33.50 32.02 2gir n PRO 93 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2gir h PRO 94 N 3.80 0.23 -0.50 0.52 0.11 -1.95 -1.96 132.00 132.25 2gir h PRO 94 Ca -0.47 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2gir h PRO 94 Cb 1.25 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 2gir h PRO 94 CO 0.72 0.15 0.05 0.72 -0.21 0.00 0.00 178.00 179.43 2gir n HIS 95 N -4.46 1.77 -1.97 0.65 8.25 -1.26 -4.29 115.22 113.90 2gir n HIS 95 Ca 0.25 -0.89 -0.38 0.00 -0.26 0.00 0.00 57.72 56.44 2gir n HIS 95 Cb 0.99 -0.48 0.02 0.00 1.12 0.00 0.00 29.99 31.64 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 -1.26 5.62 -0.05 0.41 0.15 -0.74 -4.89 113.70 112.96 2gir s SER 96 Ca 0.51 2.59 -0.37 0.00 0.70 0.00 0.00 55.95 59.38 2gir s SER 96 Cb 0.40 -2.62 -0.15 0.00 -1.71 0.00 0.00 66.02 61.94 2gir s SER 96 CO 0.13 -1.31 1.64 0.00 1.20 0.00 0.00 173.24 174.89 2gir n ALA 97 N -0.81 0.17 -1.35 5.45 0.00 -1.26 -4.23 120.51 118.47 2gir n ALA 97 Ca 0.09 0.41 -0.35 0.00 0.00 0.00 0.00 53.44 53.59 2gir n ALA 97 Cb 0.46 -2.28 0.10 0.00 0.00 0.00 0.00 19.45 17.73 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 4.52 0.53 -2.18 0.00 2.85 -1.26 -4.51 118.16 118.11 2gir n LYS 98 Ca 0.21 0.24 -0.37 0.00 -1.05 0.00 0.00 58.31 57.35 2gir n LYS 98 Cb 0.22 -2.35 0.00 0.00 -0.65 0.00 0.00 35.03 32.24 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 -1.73 5.95 0.21 -5.58 0.15 0.17 -4.64 113.70 108.23 2gir s SER 99 Ca 0.75 2.36 0.20 0.00 0.70 0.00 0.00 55.95 59.95 2gir s SER 99 Cb -0.34 -2.60 0.89 0.00 -1.71 0.00 0.00 66.02 62.26 2gir s SER 99 CO 0.48 -1.07 1.60 0.29 1.20 0.00 0.00 173.24 175.74 2gir n LYS 100 N -0.71 0.13 -1.19 5.44 5.02 -1.26 -3.37 118.16 122.22 2gir n LYS 100 Ca 0.08 0.46 -0.22 0.00 -2.02 0.00 0.00 58.31 56.62 2gir n LYS 100 Cb 0.48 -1.81 0.16 0.00 -0.02 0.00 0.00 35.03 33.84 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 -2.07 2.66 -2.50 2.13 3.72 -1.26 -4.93 117.46 115.22 2gir n PHE 101 Ca 0.01 -2.03 -0.02 0.00 -0.05 0.00 0.00 57.45 55.36 2gir n PHE 101 Cb 0.15 -0.92 0.01 0.00 -0.94 0.00 0.00 39.48 37.77 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 -1.09 0.73 3.46 1.37 0.00 -1.22 -5.06 105.19 103.39 2gir n GLY 102 Ca 0.54 -0.63 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.86 -0.38 0.28 1.61 -0.85 -1.26 -4.98 117.35 108.91 2gir s TYR 103 Ca 0.04 0.10 0.01 0.00 -0.52 0.00 0.00 57.07 56.70 2gir s TYR 103 Cb -0.02 0.50 -0.00 0.00 0.38 0.00 0.00 41.96 42.81 2gir s TYR 103 CO 0.05 -0.87 0.02 0.41 -1.52 0.00 0.00 175.55 173.64 2gir n GLY 104 N -0.35 3.77 0.28 5.49 0.00 -1.26 -0.65 105.19 112.46 2gir n GLY 104 Ca -0.14 -2.23 0.04 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 1.22 1.70 0.01 4.61 0.00 -1.83 -1.44 119.26 123.53 2gir h ALA 105 Ca -0.23 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.41 2gir h ALA 105 Cb 0.73 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2gir h ALA 105 CO 0.38 0.24 -0.89 0.87 0.00 0.00 0.00 179.25 179.85 2gir h LYS 106 N 0.34 0.14 -0.80 0.00 1.57 -1.88 0.17 116.57 116.11 2gir h LYS 106 Ca 0.09 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2gir h LYS 106 Cb 0.09 0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 2gir h LYS 106 CO -0.01 0.93 0.45 -0.44 -0.57 0.00 0.00 179.45 179.81 2gir h ASP 107 N 0.07 0.99 0.15 0.86 3.32 -1.78 -1.21 116.42 118.83 2gir h ASP 107 Ca -0.04 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 2gir h ASP 107 Cb 1.53 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.83 2gir h ASP 107 CO 0.13 0.80 -0.07 0.58 -1.72 0.00 0.00 179.24 178.95 2gir h VAL 108 N 1.11 0.97 -0.31 -1.35 2.07 -1.05 -1.69 116.25 116.00 2gir h VAL 108 Ca 0.28 -0.60 0.06 0.00 0.82 0.00 0.00 66.70 67.26 2gir h VAL 108 Cb 0.02 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 2gir h VAL 108 CO -0.05 0.14 0.21 0.03 0.02 0.00 0.00 177.57 177.92 2gir h ARG 109 N -0.50 0.15 -0.04 1.57 3.08 -0.57 -1.44 114.38 116.63 2gir h ARG 109 Ca -0.02 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2gir h ARG 109 Cb 0.39 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.40 2gir h ARG 109 CO 0.03 0.10 0.00 0.09 -1.07 0.00 0.00 179.97 179.12 2gir n ASN 110 N -4.48 1.21 -3.60 7.04 3.02 -0.47 -4.80 115.26 113.19 2gir n ASN 110 Ca 0.04 -1.45 -0.25 0.00 -0.03 0.00 0.00 54.58 52.88 2gir n ASN 110 Cb 0.27 -0.02 0.06 0.00 -0.61 0.00 0.00 39.78 39.48 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 -0.04 -3.04 -4.77 3.41 4.77 -0.54 -4.96 117.00 111.84 2gir n LEU 111 Ca 0.19 -0.56 -0.38 0.00 -0.03 0.00 0.00 56.01 55.23 2gir n LEU 111 Cb 0.30 -2.88 -0.00 0.00 -2.33 0.00 0.00 43.42 38.51 2gir n LEU 111 CO 0.16 0.54 0.88 -0.94 -1.33 0.00 0.00 177.39 176.70 2gir s SER 112 N -3.22 6.07 0.22 -1.43 1.04 -0.66 -4.80 113.70 110.93 2gir s SER 112 Ca 0.57 2.44 -0.08 0.00 0.48 0.00 0.00 55.95 59.36 2gir s SER 112 Cb -0.26 -2.62 0.22 0.00 0.10 0.00 0.00 66.02 63.46 2gir s SER 112 CO 0.70 -1.00 1.88 0.77 0.98 0.00 0.00 173.24 176.58 2gir h SER 113 N 2.10 0.92 -0.12 7.02 4.64 -1.93 -0.08 113.55 126.10 2gir h SER 113 Ca -0.50 -0.02 0.03 0.00 -0.47 0.00 0.00 61.79 60.84 2gir h SER 113 Cb 1.26 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 63.10 2gir h SER 113 CO 0.60 0.65 -0.05 0.50 -0.87 0.00 0.00 176.83 177.66 2gir h LYS 114 N 1.08 -0.03 0.34 4.77 3.64 -1.96 0.78 116.57 125.20 2gir h LYS 114 Ca 0.32 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.68 2gir h LYS 114 Cb -0.06 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2gir h LYS 114 CO -0.09 -0.02 -0.16 0.00 -2.27 0.00 0.00 179.45 176.91 2gir h ALA 115 N 1.09 -0.46 -0.83 5.00 0.00 -1.75 -0.36 119.26 121.95 2gir h ALA 115 Ca 0.07 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2gir h ALA 115 Cb 0.13 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2gir h ALA 115 CO -0.14 -0.74 0.39 0.28 0.00 0.00 0.00 179.25 179.04 2gir h VAL 116 N -0.49 1.26 -0.60 0.00 2.07 -0.74 0.25 116.25 117.99 2gir h VAL 116 Ca -0.05 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 2gir h VAL 116 Cb 0.37 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 2gir h VAL 116 CO 0.08 0.31 0.33 0.78 0.02 0.00 0.00 177.57 179.09 2gir h ASN 117 N 1.19 0.76 -0.52 0.57 2.35 0.69 -1.12 115.58 119.51 2gir h ASN 117 Ca 0.29 -0.10 -0.07 0.00 -0.55 0.00 0.00 56.30 55.87 2gir h ASN 117 Cb 0.13 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 2gir h ASN 117 CO -0.03 0.64 0.05 -0.74 -1.65 0.00 0.00 177.43 175.70 2gir h HIS 118 N 0.82 0.94 -0.75 1.19 2.76 -0.36 -2.38 115.15 117.37 2gir h HIS 118 Ca 0.21 -0.14 0.01 0.00 -2.20 0.00 0.00 60.37 58.24 2gir h HIS 118 Cb 0.05 -0.25 -0.04 0.00 1.55 0.00 0.00 27.41 28.72 2gir h HIS 118 CO -0.01 0.86 0.49 0.82 -1.30 0.00 0.00 177.93 178.79 2gir h ILE 119 N 0.75 1.19 -0.84 6.26 2.04 -0.80 -0.33 117.51 125.78 2gir h ILE 119 Ca 0.15 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 2gir h ILE 119 Cb 0.45 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.59 2gir h ILE 119 CO 0.02 0.19 0.50 0.45 0.00 0.00 0.00 178.15 179.31 2gir h HIS 120 N 1.01 1.11 -0.18 1.37 3.86 -1.06 -1.06 115.15 120.21 2gir h HIS 120 Ca 0.27 -0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.32 2gir h HIS 120 Cb -0.11 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 27.99 2gir h HIS 120 CO -0.02 0.74 -0.53 0.66 0.86 0.00 0.00 177.93 179.64 2gir h SER 121 N 1.16 0.59 -0.24 2.45 4.64 -0.85 -0.82 113.55 120.49 2gir h SER 121 Ca 0.30 -0.31 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 2gir h SER 121 Cb -0.04 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 2gir h SER 121 CO -0.06 1.01 0.10 0.58 -0.87 0.00 0.00 176.83 177.59 2gir h VAL 122 N 0.41 1.17 -0.21 0.95 2.07 -0.82 -1.15 116.25 118.66 2gir h VAL 122 Ca 0.01 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 67.06 2gir h VAL 122 Cb 1.07 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 2gir h VAL 122 CO 0.10 0.17 0.04 -0.25 0.02 0.00 0.00 177.57 177.65 2gir h TRP 123 N 0.24 0.07 -0.67 1.57 2.91 -1.08 -0.19 115.95 118.80 2gir h TRP 123 Ca 0.08 0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.13 2gir h TRP 123 Cb 0.17 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 28.79 2gir h TRP 123 CO -0.01 0.02 0.44 -0.22 -1.03 0.00 0.00 178.44 177.64 2gir h LYS 124 N 0.13 0.86 -0.23 2.65 3.64 -1.09 -2.02 116.57 120.50 2gir h LYS 124 Ca 0.10 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.30 2gir h LYS 124 Cb 0.09 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2gir h LYS 124 CO -0.13 0.57 -0.38 0.22 -2.27 0.00 0.00 179.45 177.46 2gir h ASP 125 N 0.88 0.55 -0.72 4.20 3.58 -0.43 -1.85 116.42 122.63 2gir h ASP 125 Ca 0.25 -0.23 -0.05 0.00 0.42 0.00 0.00 57.03 57.42 2gir h ASP 125 Cb -0.06 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 40.81 2gir h ASP 125 CO -0.06 0.88 0.27 -0.07 -2.88 0.00 0.00 179.24 177.37 2gir h LEU 126 N 0.44 1.03 -0.66 2.28 3.38 -0.38 -1.10 115.31 120.30 2gir h LEU 126 Ca 0.04 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.72 2gir h LEU 126 Cb 0.86 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2gir h LEU 126 CO 0.07 0.93 -0.30 -0.07 0.09 0.00 0.00 178.44 179.17 2gir h LEU 127 N 1.08 0.75 0.00 1.67 3.38 -1.18 -3.33 115.31 117.68 2gir h LEU 127 Ca 0.24 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2gir h LEU 127 Cb 0.25 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2gir h LEU 127 CO -0.02 1.00 -1.10 -0.33 0.09 0.00 0.00 178.44 178.08 2gir h GLU 128 N 0.61 0.00 -4.07 1.13 5.08 -1.17 -3.45 114.58 112.72 2gir h GLU 128 Ca 0.07 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.93 2gir h GLU 128 Cb 0.81 0.00 -0.37 0.00 0.50 0.00 0.00 28.75 29.69 2gir h GLU 128 CO 0.07 0.09 -0.79 0.34 -1.00 0.00 0.00 179.01 177.71 2gir s ASP 129 N -5.50 2.05 -0.16 1.42 -1.08 -0.43 -5.01 116.67 107.96 2gir s ASP 129 Ca -0.01 -0.26 0.17 0.00 -0.52 0.00 0.00 52.55 51.92 2gir s ASP 129 Cb 0.09 -0.73 0.38 0.00 -1.46 0.00 0.00 42.92 41.20 2gir s ASP 129 CO 0.79 -0.14 1.25 0.35 0.52 0.00 0.00 175.17 177.94 2gir n THR 130 N 5.00 2.08 0.00 1.71 -2.24 -1.26 -4.51 114.28 115.05 2gir n THR 130 Ca -0.11 -2.34 0.00 0.00 -2.27 0.00 0.00 64.05 59.33 2gir n THR 130 Cb 0.50 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 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 -1.16 0.00 -2.38 2.28 0.31 -1.26 -4.60 118.33 111.52 2gir n VAL 131 Ca 0.19 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 64.09 2gir n VAL 131 Cb 0.74 -0.35 -0.02 0.00 -0.91 0.00 0.00 33.84 33.29 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 -1.47 4.10 0.31 2.52 2.01 -1.26 -4.77 115.64 117.07 2gir s THR 132 Ca 0.00 1.26 -0.28 0.00 0.31 0.00 0.00 61.69 62.97 2gir s THR 132 Cb 0.00 -4.08 -0.13 0.00 0.01 0.00 0.00 72.50 68.30 2gir s THR 132 CO 0.00 -0.41 1.15 -2.65 -0.69 0.00 0.00 174.62 172.02 2gir n PRO 133 N 7.26 1.70 -3.40 4.92 -0.02 -1.26 -4.72 135.00 139.48 2gir n PRO 133 Ca 0.15 0.60 -0.38 0.00 -2.02 0.00 0.00 63.50 61.85 2gir n PRO 133 Cb 0.46 -2.07 -0.06 0.00 -0.02 0.00 0.00 33.50 31.81 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 -1.02 5.08 0.42 4.25 1.01 0.97 -4.93 121.20 126.98 2gir s ILE 134 Ca 0.58 0.91 -0.25 0.00 0.00 0.00 0.00 60.65 61.89 2gir s ILE 134 Cb -0.65 -3.77 -0.08 0.00 0.01 0.00 0.00 42.46 37.97 2gir s ILE 134 CO 0.60 0.46 1.28 -0.62 0.00 0.00 0.00 174.94 176.67 2gir s ASP 135 N -0.31 6.22 0.16 3.58 2.15 -1.26 -4.38 116.67 122.82 2gir s ASP 135 Ca 0.25 2.61 0.06 0.00 0.43 0.00 0.00 52.55 55.90 2gir s ASP 135 Cb -0.16 -2.63 -0.04 0.00 -0.30 0.00 0.00 42.92 39.78 2gir s ASP 135 CO 0.12 -0.91 -0.13 0.42 -0.17 0.00 0.00 175.17 174.50 2gir s THR 136 N -1.31 1.43 -0.13 1.71 -4.23 -1.06 -4.40 115.64 107.66 2gir s THR 136 Ca 0.59 -2.01 -0.06 0.00 -1.18 0.00 0.00 61.69 59.03 2gir s THR 136 Cb -0.37 -1.82 -0.04 0.00 1.34 0.00 0.00 72.50 71.61 2gir s THR 136 CO 0.47 -0.59 0.10 -0.89 -0.54 0.00 0.00 174.62 173.17 2gir s THR 137 N -2.82 5.12 -0.16 3.99 2.01 0.14 -1.12 115.64 122.80 2gir s THR 137 Ca 0.16 0.07 -0.02 0.00 0.31 0.00 0.00 61.69 62.21 2gir s THR 137 Cb -0.01 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.24 2gir s THR 137 CO 0.04 0.57 -0.09 -0.51 -0.69 0.00 0.00 174.62 173.94 2gir s ILE 138 N -0.62 3.32 0.07 1.82 2.07 -0.26 -1.45 121.20 126.14 2gir s ILE 138 Ca 0.12 -0.55 0.05 0.00 -1.41 0.00 0.00 60.65 58.86 2gir s ILE 138 Cb -0.12 -2.44 -0.03 0.00 0.13 0.00 0.00 42.46 40.00 2gir s ILE 138 CO 0.02 0.49 -0.13 -0.04 -1.91 0.00 0.00 174.94 173.37 2gir s MET 139 N 0.67 0.78 -0.01 3.50 -1.94 -0.24 -4.36 119.30 117.70 2gir s MET 139 Ca -0.05 -0.91 -0.29 0.00 -1.71 0.00 0.00 55.69 52.73 2gir s MET 139 Cb -0.15 -0.75 -0.03 0.00 2.01 0.00 0.00 34.83 35.91 2gir s MET 139 CO 0.02 0.17 0.92 0.00 -0.01 0.00 0.00 175.02 176.12 2gir s ALA 140 N -1.27 3.20 0.35 3.03 0.00 -1.26 -0.38 121.76 125.43 2gir s ALA 140 Ca -0.03 0.45 -0.26 0.00 0.00 0.00 0.00 51.96 52.12 2gir s ALA 140 Cb -0.10 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.67 2gir s ALA 140 CO 0.02 -0.20 1.05 0.15 0.00 0.00 0.00 175.76 176.78 2gir s LYS 141 N 0.95 4.37 -0.51 0.00 1.02 0.15 -4.77 119.74 120.95 2gir s LYS 141 Ca 0.49 1.58 -0.14 0.00 0.02 0.00 0.00 55.97 57.91 2gir s LYS 141 Cb -0.20 -2.78 0.12 0.00 -0.52 0.00 0.00 37.83 34.45 2gir s LYS 141 CO 0.26 0.02 0.43 -0.80 -0.92 0.00 0.00 175.35 174.35 2gir s ASN 142 N -1.36 6.04 0.09 2.83 0.02 -1.26 -4.41 114.94 116.89 2gir s ASN 142 Ca 0.53 -1.73 0.08 0.00 -1.02 0.00 0.00 52.86 50.71 2gir s ASN 142 Cb -0.25 -2.15 -0.03 0.00 0.02 0.00 0.00 41.25 38.84 2gir s ASN 142 CO 0.31 -0.77 -0.20 -1.61 0.02 0.00 0.00 177.10 174.85 2gir s GLU 143 N 1.54 1.09 -0.15 -0.60 2.02 -1.26 -4.88 118.70 116.47 2gir s GLU 143 Ca 0.04 -1.12 -0.08 0.00 0.02 0.00 0.00 54.97 53.83 2gir s GLU 143 Cb -0.28 -1.31 -0.04 0.00 0.10 0.00 0.00 34.13 32.60 2gir s GLU 143 CO 0.03 0.31 0.14 0.08 0.02 0.00 0.00 175.26 175.83 2gir s VAL 144 N -1.15 5.47 0.24 2.63 1.01 -1.26 -0.79 120.40 126.55 2gir s VAL 144 Ca 0.05 0.20 0.01 0.00 0.00 0.00 0.00 61.98 62.24 2gir s VAL 144 Cb -0.10 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 2gir s VAL 144 CO 0.04 0.56 0.15 -0.36 0.00 0.00 0.00 175.10 175.48 2gir s PHE 145 N -0.53 1.37 -0.01 5.22 0.08 -0.33 -4.71 117.98 119.07 2gir s PHE 145 Ca 0.12 -1.37 -0.09 0.00 0.12 0.00 0.00 56.93 55.71 2gir s PHE 145 Cb -0.12 -0.69 -0.05 0.00 -0.57 0.00 0.00 43.02 41.59 2gir s PHE 145 CO 0.02 -0.59 0.29 0.00 -0.10 0.00 0.00 175.22 174.84 2gir s VAL 147 N -1.21 2.41 -0.85 0.00 -7.23 0.47 -4.98 120.40 109.01 2gir s VAL 147 Ca 0.25 0.27 -0.05 0.00 -1.81 0.00 0.00 61.98 60.64 2gir s VAL 147 Cb -0.14 -3.12 -0.06 0.00 0.56 0.00 0.00 36.38 33.63 2gir s VAL 147 CO 0.13 -0.04 0.74 1.67 -0.31 0.00 0.00 175.10 177.30 2gir n GLN 148 N -1.42 -1.89 -3.87 4.82 -0.06 -1.26 -5.06 117.38 108.64 2gir n GLN 148 Ca 0.13 0.70 -0.36 0.00 -2.00 0.00 0.00 57.00 55.47 2gir n GLN 148 Cb 0.48 -5.01 -0.06 0.00 -4.06 0.00 0.00 30.24 21.59 2gir n GLN 148 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 2gir s ARG 154 N -4.14 3.46 0.30 3.69 0.52 -1.26 -5.25 118.95 116.27 2gir s ARG 154 Ca 0.36 -0.17 -0.27 0.00 -0.52 0.00 0.00 55.73 55.13 2gir s ARG 154 Cb -0.05 -3.15 -0.09 0.00 0.52 0.00 0.00 34.95 32.17 2gir s ARG 154 CO 0.60 0.74 0.97 0.15 0.02 0.00 0.00 175.30 177.77 2gir s LYS 155 N -1.36 4.64 0.60 3.54 1.02 -1.26 -5.05 119.74 121.86 2gir s LYS 155 Ca 0.20 1.44 -0.17 0.00 0.02 0.00 0.00 55.97 57.47 2gir s LYS 155 Cb -0.12 -2.97 -0.03 0.00 -0.52 0.00 0.00 37.83 34.19 2gir s LYS 155 CO 0.10 0.31 1.10 -2.14 -0.92 0.00 0.00 175.35 173.80 2gir s PRO 156 N -1.75 3.14 0.41 -1.68 0.02 -1.26 -4.83 135.00 129.04 2gir s PRO 156 Ca 0.47 1.41 -0.27 0.00 0.02 0.00 0.00 61.00 62.64 2gir s PRO 156 Cb -0.23 -1.99 -0.10 0.00 0.02 0.00 0.00 34.50 32.20 2gir s PRO 156 CO 0.28 -0.98 1.48 0.00 -0.33 0.00 0.00 177.00 177.45 2gir s ALA 157 N -2.17 3.45 0.65 -1.55 0.00 -1.26 -4.94 121.76 115.94 2gir s ALA 157 Ca 0.68 1.56 -0.12 0.00 0.00 0.00 0.00 51.96 54.08 2gir s ALA 157 Cb -0.20 -3.61 -0.02 0.00 0.00 0.00 0.00 23.12 19.29 2gir s ALA 157 CO 0.35 -1.14 1.05 1.03 0.00 0.00 0.00 175.76 177.04 2gir s ARG 158 N -2.25 3.24 0.02 0.00 0.52 -1.26 -4.66 118.95 114.56 2gir s ARG 158 Ca 0.56 0.93 0.02 0.00 -0.52 0.00 0.00 55.73 56.72 2gir s ARG 158 Cb -0.46 -2.03 -0.04 0.00 0.52 0.00 0.00 34.95 32.94 2gir s ARG 158 CO 0.61 -0.86 0.00 -0.51 0.02 0.00 0.00 175.30 174.57 2gir s LEU 159 N -5.21 3.50 -0.03 2.53 1.02 -1.26 0.32 118.68 119.55 2gir s LEU 159 Ca 0.58 -0.05 0.06 0.00 0.02 0.00 0.00 54.13 54.74 2gir s LEU 159 Cb -0.13 -2.07 -0.01 0.00 0.02 0.00 0.00 46.19 44.00 2gir s LEU 159 CO 0.51 0.25 -0.22 -0.51 0.02 0.00 0.00 176.35 176.40 2gir s ILE 160 N -1.15 1.75 -0.13 -0.59 1.10 0.49 -4.87 121.20 117.80 2gir s ILE 160 Ca 0.21 -0.93 -0.00 0.00 -0.51 0.00 0.00 60.65 59.42 2gir s ILE 160 Cb -0.12 -1.47 0.03 0.00 0.15 0.00 0.00 42.46 41.05 2gir s ILE 160 CO 0.13 0.50 -0.08 -0.69 -2.11 0.00 0.00 174.94 172.68 2gir s VAL 161 N -0.35 1.15 -0.02 4.00 1.01 -1.26 -1.08 120.40 123.85 2gir s VAL 161 Ca 0.04 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.51 2gir s VAL 161 Cb -0.10 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 35.10 2gir s VAL 161 CO 0.01 0.32 0.15 0.72 0.00 0.00 0.00 175.10 176.30 2gir s PHE 162 N 1.65 -0.05 0.88 5.22 -0.71 -0.53 -0.93 117.98 123.51 2gir s PHE 162 Ca 0.04 0.10 -0.12 0.00 -1.04 0.00 0.00 56.93 55.91 2gir s PHE 162 Cb -0.13 -0.00 0.16 0.00 -1.21 0.00 0.00 43.02 41.83 2gir s PHE 162 CO -0.08 -0.21 1.22 -1.25 -1.34 0.00 0.00 175.22 173.55 2gir s PRO 163 N -0.82 1.16 0.68 1.99 0.04 -1.26 -0.68 135.00 136.10 2gir s PRO 163 Ca -0.09 -0.42 -0.16 0.00 0.04 0.00 0.00 61.00 60.37 2gir s PRO 163 Cb -0.05 -1.97 0.01 0.00 0.04 0.00 0.00 34.50 32.53 2gir s PRO 163 CO 0.01 -2.03 1.20 0.34 0.04 0.00 0.00 177.00 176.56 2gir s ASP 164 N -4.78 4.60 0.28 6.66 2.15 -1.26 -4.74 116.67 119.58 2gir s ASP 164 Ca 0.70 2.33 0.01 0.00 0.43 0.00 0.00 52.55 56.02 2gir s ASP 164 Cb -0.06 -2.59 0.67 0.00 -0.30 0.00 0.00 42.92 40.64 2gir s ASP 164 CO 0.50 -1.99 1.64 0.25 -0.17 0.00 0.00 175.17 175.41 2gir h LEU 165 N 0.11 -0.06 -0.72 -1.34 5.85 -1.82 -0.47 115.31 116.87 2gir h LEU 165 Ca -0.48 0.20 0.08 0.00 0.84 0.00 0.00 57.88 58.51 2gir h LEU 165 Cb 1.29 0.28 -0.06 0.00 0.37 0.00 0.00 40.66 42.54 2gir h LEU 165 CO 0.52 -0.16 0.39 1.23 -0.34 0.00 0.00 178.44 180.08 2gir h GLY 166 N 0.19 1.07 1.10 3.75 0.00 -1.95 -1.35 103.07 105.89 2gir h GLY 166 Ca 0.53 -0.26 -0.14 0.00 0.00 0.00 0.00 47.33 47.46 2gir h GLY 166 CO -0.66 0.12 -0.28 -2.08 0.00 0.00 0.00 176.54 173.64 2gir h VAL 167 N 0.68 1.27 -0.92 4.60 2.07 -1.48 -2.33 116.25 120.14 2gir h VAL 167 Ca 0.34 -1.45 -0.00 0.00 0.82 0.00 0.00 66.70 66.41 2gir h VAL 167 Cb 0.28 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 2gir h VAL 167 CO -0.22 0.49 0.57 0.03 0.02 0.00 0.00 177.57 178.46 2gir h ARG 168 N 0.78 1.24 -0.65 1.57 3.08 -0.61 0.28 114.38 120.07 2gir h ARG 168 Ca 0.08 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 2gir h ARG 168 Cb 0.87 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 2gir h ARG 168 CO 0.08 0.85 0.09 0.28 -1.07 0.00 0.00 179.97 180.20 2gir h VAL 169 N 1.26 1.26 -0.51 2.04 2.07 -1.14 -2.52 116.25 118.73 2gir h VAL 169 Ca 0.33 -1.05 -0.05 0.00 0.82 0.00 0.00 66.70 66.74 2gir h VAL 169 Cb -0.08 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 2gir h VAL 169 CO -0.07 0.39 0.10 0.00 0.02 0.00 0.00 177.57 178.01 2gir h GLU 171 N 0.76 0.98 -0.25 0.00 5.08 -0.21 -2.27 114.58 118.67 2gir h GLU 171 Ca 0.16 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2gir h GLU 171 Cb 0.32 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2gir h GLU 171 CO 0.00 0.65 0.09 0.87 -1.00 0.00 0.00 179.01 179.63 2gir h LYS 172 N 1.01 0.38 -0.69 2.33 1.57 -0.99 0.51 116.57 120.70 2gir h LYS 172 Ca 0.36 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 59.11 2gir h LYS 172 Cb 0.10 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 2gir h LYS 172 CO -0.15 0.44 0.41 0.52 -0.57 0.00 0.00 179.45 180.09 2gir h MET 173 N 0.25 0.74 0.11 3.15 2.86 -1.11 -0.90 114.93 120.03 2gir h MET 173 Ca 0.08 -0.04 -0.27 0.00 -2.06 0.00 0.00 59.70 57.41 2gir h MET 173 Cb 0.20 -0.17 0.01 0.00 0.06 0.00 0.00 31.60 31.70 2gir h MET 173 CO -0.01 0.49 -1.19 0.00 1.06 0.00 0.00 176.91 177.26 2gir h ALA 174 N 1.33 0.13 0.00 6.32 0.00 -1.28 -1.59 119.26 124.18 2gir h ALA 174 Ca 0.30 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2gir h ALA 174 Cb 0.13 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2gir h ALA 174 CO -0.16 0.89 -0.00 1.28 0.00 0.00 0.00 179.25 181.26 2gir n LEU 175 N -3.62 0.00 -0.09 0.00 4.77 0.16 -4.75 117.00 113.47 2gir n LEU 175 Ca -0.09 -0.29 -0.06 0.00 -0.03 0.00 0.00 56.01 55.54 2gir n LEU 175 Cb 0.98 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.07 2gir n LEU 175 CO 0.54 0.00 0.83 0.22 -1.33 0.00 0.00 177.39 177.65 2gir h TYR 176 N 0.00 -0.08 -0.66 -1.77 3.20 -1.23 0.15 116.97 116.58 2gir h TYR 176 Ca 0.00 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 2gir h TYR 176 Cb 0.00 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.32 2gir h TYR 176 CO 0.00 -0.09 0.38 0.22 -1.64 0.00 0.00 178.16 177.03 2gir h ASP 177 N 0.05 0.80 0.36 -2.11 3.58 -1.79 -1.48 116.42 115.83 2gir h ASP 177 Ca 0.15 -0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.52 2gir h ASP 177 Cb 0.22 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 2gir h ASP 177 CO -0.29 0.64 -0.37 0.58 -2.88 0.00 0.00 179.24 176.93 2gir h VAL 178 N 0.89 0.24 0.00 2.25 2.07 -1.63 -1.75 116.25 118.32 2gir h VAL 178 Ca 0.23 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.75 2gir h VAL 178 Cb 0.00 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.01 2gir h VAL 178 CO -0.04 0.00 0.00 -0.37 0.02 0.00 0.00 177.57 177.18 2gir h VAL 179 N -0.76 0.00 0.00 2.57 -1.51 -0.58 0.06 116.25 116.04 2gir h VAL 179 Ca -0.03 -0.37 -0.03 0.00 -1.23 0.00 0.00 66.70 65.04 2gir h VAL 179 Cb 0.69 1.26 -0.01 0.00 -2.13 0.00 0.00 31.29 31.10 2gir h VAL 179 CO -0.07 0.00 -0.82 0.28 -1.23 0.00 0.00 177.57 175.73 2gir h SER 180 N 0.00 0.00 0.00 4.19 0.02 -1.07 -3.42 113.55 113.27 2gir h SER 180 Ca 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2gir h SER 180 Cb 0.42 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 2gir h SER 180 CO 0.00 0.12 -1.21 0.41 -1.14 0.00 0.00 176.83 175.01 2gir n THR 181 N -2.83 0.21 -0.07 -2.27 -1.04 -0.68 -4.73 114.28 102.86 2gir n THR 181 Ca -0.00 -0.09 -0.12 0.00 -2.04 0.00 0.00 64.05 61.79 2gir n THR 181 Cb 0.60 -0.72 -0.06 0.00 -1.82 0.00 0.00 70.33 68.33 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 0.40 -0.77 -4.42 6.46 -1.21 -3.18 115.31 112.59 2gir h LEU 182 Ca -0.08 -0.40 0.07 0.00 -0.12 0.00 0.00 57.88 57.35 2gir h LEU 182 Cb 1.14 -0.11 -0.06 0.00 -0.73 0.00 0.00 40.66 40.90 2gir h LEU 182 CO -0.01 0.71 0.44 -0.65 -0.62 0.00 0.00 178.44 178.31 2gir h PRO 183 N 0.08 0.75 -0.25 5.25 0.11 -1.82 0.22 132.00 136.35 2gir h PRO 183 Ca 0.04 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 66.02 2gir h PRO 183 Cb 0.56 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 2gir h PRO 183 CO 0.03 0.50 -0.23 0.37 -0.21 0.00 0.00 178.00 178.45 2gir h GLN 184 N 0.78 0.46 -0.34 1.05 -0.00 -1.88 0.07 115.11 115.25 2gir h GLN 184 Ca 0.35 -0.16 -0.09 0.00 -0.00 0.00 0.00 58.65 58.75 2gir h GLN 184 Cb 0.26 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.70 2gir h GLN 184 CO -0.21 0.67 -0.15 0.28 0.00 0.00 0.00 178.83 179.41 2gir h VAL 185 N 0.41 1.29 -0.11 2.39 2.07 -1.19 0.40 116.25 121.51 2gir h VAL 185 Ca 0.06 -1.26 -0.22 0.00 0.82 0.00 0.00 66.70 66.10 2gir h VAL 185 Cb 0.63 1.39 0.01 0.00 -1.52 0.00 0.00 31.29 31.80 2gir h VAL 185 CO 0.05 0.41 -0.82 0.58 0.02 0.00 0.00 177.57 177.81 2gir h VAL 186 N 0.47 1.30 -0.00 2.57 2.07 -0.77 -3.35 116.25 118.53 2gir h VAL 186 Ca 0.08 -2.06 0.00 0.00 0.82 0.00 0.00 66.70 65.53 2gir h VAL 186 Cb 0.68 2.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.53 2gir h VAL 186 CO 0.05 0.64 -0.46 0.23 0.02 0.00 0.00 177.57 178.05 2gir n MET 187 N -3.90 2.32 0.00 1.57 2.81 -0.01 -4.92 117.12 115.00 2gir n MET 187 Ca -0.07 -0.33 0.00 0.00 -1.81 0.00 0.00 57.70 55.48 2gir n MET 187 Cb 0.76 -1.15 0.00 0.00 -0.71 0.00 0.00 33.22 32.12 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 1.19 2.71 0.17 3.03 0.00 0.14 -1.76 105.19 110.67 2gir n GLY 188 Ca 0.04 -0.18 0.12 0.00 0.00 0.00 0.00 46.02 46.00 2gir n GLY 188 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2gir h SER 189 N 2.58 0.00 0.94 1.61 4.64 -1.96 -1.60 113.55 119.76 2gir h SER 189 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2gir h SER 189 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2gir h SER 189 CO 0.00 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.76 2gir n SER 190 N -2.33 0.67 -4.61 4.97 7.64 -0.72 -4.71 113.62 114.52 2gir n SER 190 Ca -0.01 0.63 -0.43 0.00 1.01 0.00 0.00 58.87 60.07 2gir n SER 190 Cb 0.09 -0.78 -0.02 0.00 -1.01 0.00 0.00 64.21 62.49 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 2.89 0.26 1.43 5.04 -0.61 -0.75 117.35 122.37 2gir s TYR 191 Ca 0.06 0.86 0.09 0.00 -2.44 0.00 0.00 57.07 55.64 2gir s TYR 191 Cb 0.10 -4.20 0.31 0.00 0.35 0.00 0.00 41.96 38.52 2gir s TYR 191 CO 0.45 -1.17 1.58 0.78 -1.34 0.00 0.00 175.55 175.85 2gir h GLY 192 N 10.93 0.04 1.75 8.97 0.00 -1.19 -3.22 103.07 120.36 2gir h GLY 192 Ca -0.23 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2gir h GLY 192 CO 1.10 0.05 0.00 0.69 0.00 0.00 0.00 176.54 178.37 2gir n PHE 193 N -3.79 0.00 1.11 5.60 3.72 -1.26 -2.45 117.46 120.39 2gir n PHE 193 Ca -0.01 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.51 2gir n PHE 193 Cb 0.64 -0.38 0.62 0.00 -0.94 0.00 0.00 39.48 39.42 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 -1.38 0.23 -4.31 -1.08 10.64 -1.22 -3.32 117.38 116.96 2gir n GLN 194 Ca 0.08 0.05 -0.34 0.00 -1.83 0.00 0.00 57.00 54.95 2gir n GLN 194 Cb 0.21 -1.50 -0.11 0.00 -0.86 0.00 0.00 30.24 27.98 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 -2.74 3.12 1.07 2.61 2.02 -1.02 -4.67 117.35 117.74 2gir s TYR 195 Ca 0.20 -0.04 -0.12 0.00 -0.37 0.00 0.00 57.07 56.73 2gir s TYR 195 Cb 0.17 -1.92 0.23 0.00 -0.40 0.00 0.00 41.96 40.04 2gir s TYR 195 CO 0.43 0.18 1.06 -1.54 -1.57 0.00 0.00 175.55 174.11 2gir s SER 196 N -0.07 1.82 0.26 2.29 1.04 -1.26 -4.72 113.70 113.06 2gir s SER 196 Ca 0.03 1.49 -0.03 0.00 0.48 0.00 0.00 55.95 57.93 2gir s SER 196 Cb -0.13 -2.20 0.40 0.00 0.10 0.00 0.00 66.02 64.19 2gir s SER 196 CO 0.02 -3.67 1.87 -0.65 0.98 0.00 0.00 173.24 171.79 2gir h PRO 197 N -2.26 1.07 -0.60 4.02 0.11 -1.88 0.72 132.00 133.19 2gir h PRO 197 Ca -0.57 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.46 2gir h PRO 197 Cb 1.32 -0.24 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 2gir h PRO 197 CO 0.52 0.71 0.30 0.78 -0.21 0.00 0.00 178.00 180.10 2gir h GLY 198 N 1.10 0.91 1.00 -0.55 0.00 -1.93 -0.44 103.07 103.17 2gir h GLY 198 Ca 0.42 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 47.27 2gir h GLY 198 CO -0.18 0.42 0.20 1.46 0.00 0.00 0.00 176.54 178.43 2gir h GLN 199 N 0.81 0.92 -0.24 4.80 4.20 -1.74 -1.24 115.11 122.61 2gir h GLN 199 Ca 0.21 -0.19 0.02 0.00 0.06 0.00 0.00 58.65 58.75 2gir h GLN 199 Cb 0.10 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 2gir h GLN 199 CO -0.03 0.81 0.10 -0.09 -0.67 0.00 0.00 178.83 178.95 2gir h ARG 200 N 0.84 0.21 -0.62 1.46 2.43 -0.55 0.01 114.38 118.16 2gir h ARG 200 Ca 0.19 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.37 2gir h ARG 200 Cb 0.27 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 2gir h ARG 200 CO -0.01 0.14 0.39 0.28 -1.51 0.00 0.00 179.97 179.26 2gir h VAL 201 N 0.22 1.10 -0.65 0.20 2.07 -0.88 -1.21 116.25 117.10 2gir h VAL 201 Ca 0.10 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.32 2gir h VAL 201 Cb 0.06 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.06 2gir h VAL 201 CO -0.10 0.14 0.26 -0.08 0.02 0.00 0.00 177.57 177.82 2gir h GLU 202 N 0.78 0.98 -0.62 1.57 4.81 -0.88 0.45 114.58 121.67 2gir h GLU 202 Ca 0.24 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2gir h GLU 202 Cb -0.02 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 2gir h GLU 202 CO -0.08 0.82 0.33 0.35 -0.73 0.00 0.00 179.01 179.70 2gir h PHE 203 N 0.92 0.86 -0.34 0.92 3.57 -0.67 0.31 116.94 122.52 2gir h PHE 203 Ca 0.22 -0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.60 2gir h PHE 203 Cb 0.21 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 2gir h PHE 203 CO 0.01 0.63 -0.14 -0.07 -2.23 0.00 0.00 178.31 176.51 2gir h LEU 204 N 0.85 0.70 -0.19 0.59 3.38 -0.74 -0.81 115.31 119.10 2gir h LEU 204 Ca 0.22 -0.39 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2gir h LEU 204 Cb 0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2gir h LEU 204 CO -0.03 0.94 -0.05 0.58 0.09 0.00 0.00 178.44 179.97 2gir h VAL 205 N 0.47 1.29 -0.69 1.22 2.07 -0.82 -0.14 116.25 119.65 2gir h VAL 205 Ca 0.08 -1.03 -0.04 0.00 0.82 0.00 0.00 66.70 66.53 2gir h VAL 205 Cb 0.66 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.99 2gir h VAL 205 CO 0.04 0.31 0.27 0.78 0.02 0.00 0.00 177.57 178.99 2gir h ASN 206 N 0.07 0.93 -0.08 0.57 2.35 -0.93 -1.70 115.58 116.79 2gir h ASN 206 Ca 0.05 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 2gir h ASN 206 Cb 0.50 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.62 2gir h ASN 206 CO 0.02 0.83 0.03 0.74 -1.65 0.00 0.00 177.43 177.40 2gir h THR 207 N 0.99 1.16 -0.58 2.81 2.02 -1.02 -2.06 112.91 116.23 2gir h THR 207 Ca 0.23 -0.50 0.08 0.00 0.77 0.00 0.00 66.41 67.00 2gir h THR 207 Cb 0.20 1.35 -0.07 0.00 -1.74 0.00 0.00 68.15 67.89 2gir h THR 207 CO -0.02 0.14 0.23 -0.25 0.37 0.00 0.00 175.52 175.99 2gir h TRP 208 N -0.05 0.41 0.00 3.16 2.91 -0.79 -0.86 115.95 120.73 2gir h TRP 208 Ca 0.03 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.05 2gir h TRP 208 Cb 0.20 -0.09 -0.00 0.00 -0.51 0.00 0.00 29.16 28.75 2gir h TRP 208 CO -0.01 0.12 -0.13 0.87 -1.03 0.00 0.00 178.44 178.27 2gir h LYS 209 N 0.42 0.00 0.00 2.65 1.57 -1.29 -2.94 116.57 116.99 2gir h LYS 209 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 2gir h LYS 209 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 2gir h LYS 209 CO -0.28 0.13 0.00 0.66 -0.57 0.00 0.00 179.45 179.39 2gir h SER 210 N 0.00 0.00 -3.02 0.86 4.64 -0.40 -3.43 113.55 112.20 2gir h SER 210 Ca -0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.71 2gir h SER 210 Cb 0.58 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.63 2gir h SER 210 CO 0.02 0.00 -0.37 -0.54 -0.87 0.00 0.00 176.83 175.07 2gir s LYS 211 N -3.31 3.59 0.05 4.77 -0.14 -1.11 -5.02 119.74 118.56 2gir s LYS 211 Ca 0.05 -0.12 -0.26 0.00 -1.36 0.00 0.00 55.97 54.29 2gir s LYS 211 Cb 0.10 -2.98 -0.17 0.00 -1.68 0.00 0.00 37.83 33.09 2gir s LYS 211 CO 0.45 0.57 1.51 0.87 -0.76 0.00 0.00 175.35 177.99 2gir h LYS 212 N 3.40 -0.22 -2.82 1.68 1.57 -1.87 -3.38 116.57 114.93 2gir h LYS 212 Ca -0.48 0.02 -0.60 0.00 -1.87 0.00 0.00 60.65 57.71 2gir h LYS 212 Cb 1.18 0.05 -0.40 0.00 0.08 0.00 0.00 32.23 33.14 2gir h LYS 212 CO 0.70 -0.01 -0.77 -0.80 -0.57 0.00 0.00 179.45 178.00 2gir s ASN 213 N -5.15 3.26 0.54 0.86 0.01 -1.26 -5.08 114.94 108.13 2gir s ASN 213 Ca -0.15 -2.95 -0.21 0.00 -0.71 0.00 0.00 52.86 48.85 2gir s ASN 213 Cb 0.04 -0.95 -0.05 0.00 0.41 0.00 0.00 41.25 40.70 2gir s ASN 213 CO 0.63 -0.21 1.23 -2.16 -1.51 0.00 0.00 177.10 175.08 2gir s PRO 214 N -0.03 3.25 0.02 -0.60 0.04 -1.26 -0.16 135.00 136.26 2gir s PRO 214 Ca 0.23 1.90 0.01 0.00 0.04 0.00 0.00 61.00 63.19 2gir s PRO 214 Cb -0.13 -2.14 -0.01 0.00 0.04 0.00 0.00 34.50 32.25 2gir s PRO 214 CO -0.08 -1.01 -0.05 1.41 0.04 0.00 0.00 177.00 177.31 2gir s MET 215 N -3.05 0.39 0.06 4.56 1.75 -0.05 -4.65 119.30 118.31 2gir s MET 215 Ca 0.72 -0.47 -0.05 0.00 -1.25 0.00 0.00 55.69 54.64 2gir s MET 215 Cb -0.32 -0.22 -0.02 0.00 2.84 0.00 0.00 34.83 37.11 2gir s MET 215 CO 0.37 0.05 0.10 0.20 -0.65 0.00 0.00 175.02 175.08 2gir s GLY 216 N -0.93 0.22 0.10 2.11 0.00 -0.38 -0.13 107.32 108.31 2gir s GLY 216 Ca -0.06 -0.76 -0.18 0.00 0.00 0.00 0.00 44.72 43.72 2gir s GLY 216 CO -0.00 -0.91 0.43 -0.11 0.00 0.00 0.00 173.10 172.50 2gir s PHE 217 N -3.48 -0.26 0.14 1.90 -0.71 -0.03 0.36 117.98 115.90 2gir s PHE 217 Ca 0.02 0.05 0.04 0.00 -1.04 0.00 0.00 56.93 56.00 2gir s PHE 217 Cb 0.04 0.27 -0.04 0.00 -1.21 0.00 0.00 43.02 42.08 2gir s PHE 217 CO -0.09 -0.67 0.13 -1.54 -1.34 0.00 0.00 175.22 171.71 2gir s SER 218 N -2.53 5.60 -0.13 1.98 1.04 -1.26 -0.86 113.70 117.54 2gir s SER 218 Ca 0.00 -0.06 0.02 0.00 0.48 0.00 0.00 55.95 56.38 2gir s SER 218 Cb 0.01 -1.50 0.01 0.00 0.10 0.00 0.00 66.02 64.64 2gir s SER 218 CO -0.09 0.10 -0.18 -0.47 0.98 0.00 0.00 173.24 173.58 2gir s TYR 219 N -1.64 2.29 -0.45 5.02 5.04 -0.84 -4.53 117.35 122.24 2gir s TYR 219 Ca 0.31 -1.14 -0.10 0.00 -2.44 0.00 0.00 57.07 53.70 2gir s TYR 219 Cb -0.11 -1.61 0.10 0.00 0.35 0.00 0.00 41.96 40.70 2gir s TYR 219 CO 0.23 -0.56 0.32 0.34 -1.34 0.00 0.00 175.55 174.55 2gir s ASP 220 N 0.98 5.72 0.19 4.32 2.15 -1.26 -4.08 116.67 124.69 2gir s ASP 220 Ca -0.05 -1.73 -0.30 0.00 0.43 0.00 0.00 52.55 50.90 2gir s ASP 220 Cb -0.15 -2.02 -0.08 0.00 -0.30 0.00 0.00 42.92 40.37 2gir s ASP 220 CO -0.03 -0.64 1.09 -0.89 -0.17 0.00 0.00 175.17 174.53 2gir s THR 221 N 1.41 3.83 -0.13 1.71 2.01 -1.26 0.15 115.64 123.36 2gir s THR 221 Ca 0.04 1.62 -0.29 0.00 0.31 0.00 0.00 61.69 63.37 2gir s THR 221 Cb -0.25 -4.03 -0.02 0.00 0.01 0.00 0.00 72.50 68.21 2gir s THR 221 CO 0.01 0.29 1.24 -0.60 -0.69 0.00 0.00 174.62 174.87 2gir s ARG 222 N -0.52 4.27 -1.14 4.92 3.52 -0.03 -4.03 118.95 125.94 2gir s ARG 222 Ca 0.48 1.66 -0.22 0.00 -0.13 0.00 0.00 55.73 57.52 2gir s ARG 222 Cb -0.30 -3.69 -0.00 0.00 -1.56 0.00 0.00 34.95 29.40 2gir s ARG 222 CO 0.35 -0.62 0.78 0.00 -0.81 0.00 0.00 175.30 175.01 2gir h PHE 224 N -1.94 -0.46 -0.99 0.00 3.04 -1.96 -0.08 116.94 114.54 2gir h PHE 224 Ca -0.67 0.05 0.18 0.00 3.98 0.00 0.00 57.97 61.51 2gir h PHE 224 Cb 1.36 0.28 -0.10 0.00 2.56 0.00 0.00 35.95 40.05 2gir h PHE 224 CO 0.34 -0.28 0.60 -0.44 -2.02 0.00 0.00 178.31 176.51 2gir h ASP 225 N -0.08 0.78 1.40 0.41 3.32 -1.91 0.15 116.42 120.49 2gir h ASP 225 Ca 0.23 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.37 2gir h ASP 225 Cb 0.44 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 2gir h ASP 225 CO -0.55 0.30 -0.03 0.28 -1.72 0.00 0.00 179.24 177.52 2gir h SER 226 N 0.79 0.00 1.38 6.45 0.02 -1.32 -2.41 113.55 118.45 2gir h SER 226 Ca 0.56 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.51 2gir h SER 226 Cb 0.82 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.36 2gir h SER 226 CO -0.36 0.03 -0.05 0.35 -1.14 0.00 0.00 176.83 175.66 2gir n THR 227 N -3.12 0.51 -2.44 -2.27 -2.24 0.50 -4.75 114.28 100.47 2gir n THR 227 Ca 0.02 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.12 2gir n THR 227 Cb 0.41 -0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 68.08 2gir n THR 227 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2gir s VAL 228 N -3.09 4.20 0.34 2.28 1.01 -1.06 -4.80 120.40 119.28 2gir s VAL 228 Ca 0.11 1.53 0.07 0.00 0.00 0.00 0.00 61.98 63.68 2gir s VAL 228 Cb 0.13 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 2gir s VAL 228 CO 0.60 -0.01 0.47 0.42 0.00 0.00 0.00 175.10 176.58 2gir s THR 229 N 2.29 4.06 0.24 3.92 -4.23 -1.26 -3.93 115.64 116.73 2gir s THR 229 Ca 0.57 -0.99 -0.05 0.00 -1.18 0.00 0.00 61.69 60.04 2gir s THR 229 Cb -0.25 -3.40 0.21 0.00 1.34 0.00 0.00 72.50 70.39 2gir s THR 229 CO 0.22 -0.16 1.75 -0.08 -0.54 0.00 0.00 174.62 175.81 2gir h GLU 230 N 0.89 0.48 -0.56 3.99 4.81 -1.87 -0.75 114.58 121.57 2gir h GLU 230 Ca -0.46 -0.03 0.11 0.00 -0.13 0.00 0.00 59.36 58.86 2gir h GLU 230 Cb 1.26 -0.11 -0.10 0.00 0.63 0.00 0.00 28.75 30.43 2gir h GLU 230 CO 0.53 0.32 -0.09 -0.97 -0.73 0.00 0.00 179.01 178.07 2gir h ASN 231 N 0.50 -0.41 -0.75 1.04 -1.24 -1.96 -0.89 115.58 111.86 2gir h ASN 231 Ca 0.40 0.16 -0.02 0.00 0.71 0.00 0.00 56.30 57.55 2gir h ASN 231 Cb 0.55 0.31 -0.04 0.00 0.73 0.00 0.00 38.32 39.88 2gir h ASN 231 CO -0.36 -0.15 0.41 0.44 -1.29 0.00 0.00 177.43 176.47 2gir h ASP 232 N 0.04 0.95 0.10 1.15 3.32 -1.54 -0.47 116.42 119.97 2gir h ASP 232 Ca 0.28 -0.10 -0.15 0.00 0.02 0.00 0.00 57.03 57.07 2gir h ASP 232 Cb 0.43 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 2gir h ASP 232 CO -0.54 0.78 -0.55 0.40 -1.72 0.00 0.00 179.24 177.62 2gir h ILE 233 N 1.04 1.33 -0.41 0.35 2.04 -0.85 -1.38 117.51 119.63 2gir h ILE 233 Ca 0.26 -1.81 -0.13 0.00 1.00 0.00 0.00 64.86 64.18 2gir h ILE 233 Cb 0.05 1.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 2gir h ILE 233 CO -0.04 0.56 -0.26 0.03 0.00 0.00 0.00 178.15 178.44 2gir h ARG 234 N 0.37 0.86 -0.56 2.37 3.08 -0.77 -1.98 114.38 117.74 2gir h ARG 234 Ca 0.01 -0.38 -0.01 0.00 0.07 0.00 0.00 59.98 59.67 2gir h ARG 234 Cb 1.07 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.07 2gir h ARG 234 CO 0.10 1.02 0.30 0.28 -1.07 0.00 0.00 179.97 180.60 2gir h VAL 235 N 0.74 1.19 -0.23 2.04 2.07 -0.89 -0.33 116.25 120.84 2gir h VAL 235 Ca 0.09 -0.49 0.05 0.00 0.82 0.00 0.00 66.70 67.17 2gir h VAL 235 Cb 0.80 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 2gir h VAL 235 CO 0.07 0.21 -0.05 -0.33 0.02 0.00 0.00 177.57 177.48 2gir h GLU 236 N 0.75 0.00 -1.00 1.57 5.08 -1.12 -1.18 114.58 118.69 2gir h GLU 236 Ca 0.20 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.62 2gir h GLU 236 Cb 0.06 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 2gir h GLU 236 CO -0.03 0.00 0.65 1.49 -1.00 0.00 0.00 179.01 180.12 2gir h GLU 237 N 0.00 1.13 -0.29 2.33 4.81 -0.94 -0.65 114.58 120.97 2gir h GLU 237 Ca 0.11 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 2gir h GLU 237 Cb 0.17 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 2gir h GLU 237 CO -0.24 0.75 -0.03 0.66 -0.73 0.00 0.00 179.01 179.42 2gir h SER 238 N 1.16 0.43 -0.16 1.04 4.64 -0.43 0.14 113.55 120.37 2gir h SER 238 Ca 0.44 -0.08 -0.04 0.00 -0.47 0.00 0.00 61.79 61.63 2gir h SER 238 Cb 0.19 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2gir h SER 238 CO -0.18 0.52 -0.07 0.40 -0.87 0.00 0.00 176.83 176.63 2gir h ILE 239 N 0.44 1.31 -0.78 0.95 2.04 -0.01 -2.76 117.51 118.69 2gir h ILE 239 Ca 0.09 -1.11 0.10 0.00 1.00 0.00 0.00 64.86 64.95 2gir h ILE 239 Cb 0.34 1.70 -0.08 0.00 -0.74 0.00 0.00 36.82 38.05 2gir h ILE 239 CO 0.01 0.33 0.42 1.88 0.00 0.00 0.00 178.15 180.79 2gir h TYR 240 N 0.01 0.76 0.00 1.37 0.05 -0.64 -1.39 116.97 117.12 2gir h TYR 240 Ca 0.04 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.85 2gir h TYR 240 Cb 0.54 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 38.06 2gir h TYR 240 CO 0.06 0.28 0.00 1.04 -1.05 0.00 0.00 178.16 178.49 2gir n GLN 241 N -4.81 0.09 0.22 4.88 1.13 -0.01 -1.66 117.38 117.23 2gir n GLN 241 Ca 0.13 0.32 0.08 0.00 -1.94 0.00 0.00 57.00 55.60 2gir n GLN 241 Cb 0.30 -1.67 0.53 0.00 0.11 0.00 0.00 30.24 29.50 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 -2.34 6.29 0.12 0.00 2.15 0.03 -4.99 116.67 117.92 2gir s ASP 244 Ca 0.71 0.28 0.07 0.00 0.43 0.00 0.00 52.55 54.03 2gir s ASP 244 Cb -0.26 -2.55 -0.04 0.00 -0.30 0.00 0.00 42.92 39.78 2gir s ASP 244 CO 0.49 -1.58 -0.16 -0.76 -0.17 0.00 0.00 175.17 172.99 2gir s LEU 245 N 5.51 2.36 0.39 -1.34 1.43 -1.26 -1.79 118.68 123.99 2gir s LEU 245 Ca 0.49 -0.75 -0.27 0.00 -1.03 0.00 0.00 54.13 52.57 2gir s LEU 245 Cb -0.10 -0.67 -0.10 0.00 0.03 0.00 0.00 46.19 45.36 2gir s LEU 245 CO 0.26 -0.07 1.45 0.00 0.23 0.00 0.00 176.35 178.22 2gir s ALA 246 N -1.74 3.47 0.33 4.21 0.00 -1.26 -4.83 121.76 121.94 2gir s ALA 246 Ca 0.07 1.51 0.09 0.00 0.00 0.00 0.00 51.96 53.64 2gir s ALA 246 Cb -0.07 -3.59 0.85 0.00 0.00 0.00 0.00 23.12 20.31 2gir s ALA 246 CO 0.04 -1.05 1.76 -1.35 0.00 0.00 0.00 175.76 175.16 2gir h PRO 247 N 2.84 0.62 -0.70 0.00 0.11 -2.00 0.35 132.00 133.22 2gir h PRO 247 Ca -0.51 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.57 2gir h PRO 247 Cb 1.25 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 2gir h PRO 247 CO 0.63 0.41 0.46 1.49 -0.21 0.00 0.00 178.00 180.79 2gir h GLU 248 N 0.64 0.93 -0.50 1.05 4.81 -2.00 -1.30 114.58 118.20 2gir h GLU 248 Ca 0.60 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.73 2gir h GLU 248 Cb 1.09 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.24 2gir h GLU 248 CO -0.39 0.62 0.15 0.00 -0.73 0.00 0.00 179.01 178.65 2gir h ALA 249 N 1.25 0.66 -0.72 2.92 0.00 -1.38 -1.18 119.26 120.82 2gir h ALA 249 Ca 0.26 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.02 2gir h ALA 249 Cb -0.11 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 2gir h ALA 249 CO -0.06 0.33 0.43 0.00 0.00 0.00 0.00 179.25 179.96 2gir h ARG 250 N 0.69 0.79 -0.29 0.00 3.08 -0.49 -1.03 114.38 117.13 2gir h ARG 250 Ca 0.16 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.13 2gir h ARG 250 Cb 0.29 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2gir h ARG 250 CO -0.00 0.52 0.06 0.37 -1.07 0.00 0.00 179.97 179.85 2gir h GLN 251 N 0.82 0.47 -0.86 0.04 5.75 -1.02 -0.87 115.11 119.43 2gir h GLN 251 Ca 0.30 -0.12 -0.02 0.00 -0.15 0.00 0.00 58.65 58.67 2gir h GLN 251 Cb 0.11 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 28.56 2gir h GLN 251 CO -0.15 0.56 0.48 0.00 -2.65 0.00 0.00 178.83 177.07 2gir h ALA 252 N 0.88 1.22 -0.29 3.38 0.00 -0.90 -0.69 119.26 122.86 2gir h ALA 252 Ca 0.09 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2gir h ALA 252 Cb 0.31 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2gir h ALA 252 CO 0.00 0.63 -0.19 0.82 0.00 0.00 0.00 179.25 180.51 2gir h ILE 253 N 1.20 1.30 -0.27 0.00 2.04 -1.07 0.35 117.51 121.06 2gir h ILE 253 Ca 0.30 -1.32 0.03 0.00 1.00 0.00 0.00 64.86 64.87 2gir h ILE 253 Cb 0.02 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 2gir h ILE 253 CO -0.05 0.42 0.09 0.50 0.00 0.00 0.00 178.15 179.12 2gir h LYS 254 N 0.39 0.21 0.15 2.37 3.64 -0.91 -1.06 116.57 121.37 2gir h LYS 254 Ca 0.06 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2gir h LYS 254 Cb 0.73 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.50 2gir h LYS 254 CO 0.05 0.14 -0.09 1.03 -2.27 0.00 0.00 179.45 178.31 2gir h SER 255 N 0.22 -0.23 -0.87 4.20 0.87 -1.01 -0.99 113.55 115.72 2gir h SER 255 Ca 0.12 0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.73 2gir h SER 255 Cb 0.09 0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 62.07 2gir h SER 255 CO -0.13 -0.15 0.57 -0.07 -0.53 0.00 0.00 176.83 176.53 2gir h LEU 256 N -0.24 0.95 -0.12 2.23 3.38 -0.87 0.11 115.31 120.74 2gir h LEU 256 Ca -0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2gir h LEU 256 Cb 0.20 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2gir h LEU 256 CO 0.01 0.66 0.04 0.74 0.09 0.00 0.00 178.44 179.99 2gir h THR 257 N 1.10 1.16 -0.14 0.22 2.02 -0.89 0.12 112.91 116.51 2gir h THR 257 Ca 0.34 -0.49 -0.15 0.00 0.77 0.00 0.00 66.41 66.88 2gir h THR 257 Cb -0.00 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 2gir h THR 257 CO -0.10 0.15 -0.54 -0.33 0.37 0.00 0.00 175.52 175.07 2gir h GLU 258 N 0.03 0.40 0.00 6.66 4.39 -0.67 -0.67 114.58 124.72 2gir h GLU 258 Ca 0.04 -0.25 -0.22 0.00 0.34 0.00 0.00 59.36 59.27 2gir h GLU 258 Cb 0.19 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.83 2gir h GLU 258 CO -0.00 0.84 -2.17 0.54 -1.16 0.00 0.00 179.01 177.06 2gir n ARG 259 N -3.94 0.67 0.05 2.33 1.74 0.33 -4.69 116.66 113.15 2gir n ARG 259 Ca -0.03 -0.06 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 2gir n ARG 259 Cb 0.59 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.48 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 -2.58 0.39 -0.05 0.55 7.94 0.05 -0.02 117.00 123.27 2gir n LEU 260 Ca -0.20 0.15 -0.09 0.00 -1.11 0.00 0.00 56.01 54.76 2gir n LEU 260 Cb 0.92 -0.05 0.07 0.00 0.53 0.00 0.00 43.42 44.89 2gir n LEU 260 CO 0.44 -0.51 0.62 1.88 -1.11 0.00 0.00 177.39 178.70 2gir h TYR 261 N 0.00 0.83 -0.12 1.96 0.05 -0.74 -2.94 116.97 116.01 2gir h TYR 261 Ca 0.00 -0.23 -0.09 0.00 0.05 0.00 0.00 58.73 58.47 2gir h TYR 261 Cb 0.29 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.83 2gir h TYR 261 CO 0.00 0.95 -0.32 0.82 -1.05 0.00 0.00 178.16 178.57 2gir h ILE 262 N 0.59 1.27 0.00 -2.88 2.04 -1.37 -3.42 117.51 113.75 2gir h ILE 262 Ca 0.06 -1.28 0.00 0.00 1.00 0.00 0.00 64.86 64.64 2gir h ILE 262 Cb 0.87 1.53 0.00 0.00 -0.74 0.00 0.00 36.82 38.48 2gir h ILE 262 CO 0.08 0.39 0.00 0.61 0.00 0.00 0.00 178.15 179.22 2gir n GLY 263 N -0.41 -2.06 0.00 5.37 0.00 -1.11 -3.93 105.19 103.04 2gir n GLY 263 Ca -0.01 -1.25 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 -0.44 1.11 3.79 -0.02 0.00 -0.42 -4.20 105.19 105.02 2gir n GLY 264 Ca 0.00 -1.26 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.95 3.50 -0.14 1.61 0.04 -1.26 -0.58 135.00 136.21 2gir s PRO 265 Ca 0.00 1.39 -0.00 0.00 0.04 0.00 0.00 61.00 62.43 2gir s PRO 265 Cb 0.00 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 2gir s PRO 265 CO 0.00 -0.69 -0.14 -0.51 0.04 0.00 0.00 177.00 175.70 2gir s LEU 266 N -3.91 2.64 -0.06 -3.56 1.43 0.27 -2.56 118.68 112.93 2gir s LEU 266 Ca 0.68 -0.37 0.06 0.00 -1.03 0.00 0.00 54.13 53.46 2gir s LEU 266 Cb -0.18 -1.60 -0.01 0.00 0.03 0.00 0.00 46.19 44.43 2gir s LEU 266 CO 0.27 0.14 -0.25 -0.89 0.23 0.00 0.00 176.35 175.85 2gir s THR 267 N 0.52 2.03 0.93 5.49 2.01 -0.27 0.67 115.64 127.02 2gir s THR 267 Ca -0.09 -1.05 -0.15 0.00 0.31 0.00 0.00 61.69 60.72 2gir s THR 267 Cb -0.16 -1.72 0.17 0.00 0.01 0.00 0.00 72.50 70.80 2gir s THR 267 CO 0.04 0.56 1.24 0.54 -0.69 0.00 0.00 174.62 176.31 2gir s ASN 268 N -0.09 3.36 0.45 3.53 2.20 -0.10 -1.11 114.94 123.18 2gir s ASN 268 Ca -0.06 0.54 0.30 0.00 -0.94 0.00 0.00 52.86 52.70 2gir s ASN 268 Cb -0.14 -0.80 1.62 0.00 -2.00 0.00 0.00 41.25 39.93 2gir s ASN 268 CO 0.04 -2.60 1.91 0.77 -2.94 0.00 0.00 177.10 174.28 2gir h SER 269 N -1.54 0.00 0.26 3.54 4.64 -1.76 -0.56 113.55 118.13 2gir h SER 269 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2gir h SER 269 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2gir h SER 269 CO 0.49 0.00 -0.41 0.29 -0.87 0.00 0.00 176.83 176.33 2gir n LYS 270 N -2.55 0.58 -0.48 4.77 5.02 -1.26 -4.95 118.16 119.28 2gir n LYS 270 Ca -0.02 -0.37 0.00 0.00 -2.02 0.00 0.00 58.31 55.90 2gir n LYS 270 Cb 0.06 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.57 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 1.41 0.75 3.78 0.72 0.00 -0.22 -5.06 105.19 106.56 2gir n GLY 271 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.52 4.62 -0.09 1.61 -0.21 -1.26 -4.82 119.66 119.00 2gir s GLN 272 Ca 0.00 1.35 -0.30 0.00 0.02 0.00 0.00 55.36 56.44 2gir s GLN 272 Cb 0.00 -2.87 -0.04 0.00 1.00 0.00 0.00 33.01 31.09 2gir s GLN 272 CO 0.00 0.32 1.56 1.21 -2.12 0.00 0.00 175.29 176.25 2gir s ASN 273 N -1.55 6.72 -0.01 5.90 3.04 -1.26 -0.93 114.94 126.85 2gir s ASN 273 Ca 0.49 2.07 0.19 0.00 0.04 0.00 0.00 52.86 55.65 2gir s ASN 273 Cb -0.20 -2.53 -0.20 0.00 -1.54 0.00 0.00 41.25 36.77 2gir s ASN 273 CO 0.25 -0.90 0.58 0.00 -3.04 0.00 0.00 177.10 173.98 2gir n GLY 275 N 1.42 -0.27 3.10 0.00 0.00 -1.18 -0.73 105.19 107.53 2gir n GLY 275 Ca -0.13 -1.09 -0.13 0.00 0.00 0.00 0.00 46.02 44.67 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 -3.46 -0.30 -0.12 1.61 5.04 -0.06 -0.56 117.35 119.49 2gir s TYR 276 Ca 0.00 0.72 -0.06 0.00 -2.44 0.00 0.00 57.07 55.30 2gir s TYR 276 Cb 0.00 0.07 -0.04 0.00 0.35 0.00 0.00 41.96 42.35 2gir s TYR 276 CO 0.00 -0.18 0.09 0.50 -1.34 0.00 0.00 175.55 174.62 2gir s ARG 277 N 0.66 3.42 -0.12 4.97 3.52 0.26 -1.42 118.95 130.24 2gir s ARG 277 Ca -0.04 -0.24 0.17 0.00 -0.13 0.00 0.00 55.73 55.48 2gir s ARG 277 Cb -0.06 -3.09 0.40 0.00 -1.56 0.00 0.00 34.95 30.64 2gir s ARG 277 CO -0.04 0.67 1.19 0.54 -0.81 0.00 0.00 175.30 176.85 2gir n ARG 278 N 2.31 0.91 -2.28 5.12 1.74 -0.24 -1.30 116.66 122.92 2gir n ARG 278 Ca -0.19 -2.68 -0.02 0.00 -0.77 0.00 0.00 57.85 54.18 2gir n ARG 278 Cb 0.54 -0.96 -0.01 0.00 -1.02 0.00 0.00 32.46 31.02 2gir n ARG 278 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gir s ARG 280 N -2.17 4.17 0.06 0.00 6.06 -0.93 -4.60 118.95 121.53 2gir s ARG 280 Ca 0.05 2.50 -0.30 0.00 -2.50 0.00 0.00 55.73 55.48 2gir s ARG 280 Cb 0.00 -3.10 -0.05 0.00 0.06 0.00 0.00 34.95 31.86 2gir s ARG 280 CO 0.04 -0.66 1.10 0.00 -2.50 0.00 0.00 175.30 173.27 2gir s ALA 281 N 0.94 3.30 -0.63 6.12 0.00 -1.26 -4.76 121.76 125.47 2gir s ALA 281 Ca 0.71 0.73 0.25 0.00 0.00 0.00 0.00 51.96 53.65 2gir s ALA 281 Cb -0.47 -3.39 0.85 0.00 0.00 0.00 0.00 23.12 20.11 2gir s ALA 281 CO 0.34 -0.32 1.76 0.66 0.00 0.00 0.00 175.76 178.20 2gir h SER 282 N 6.55 0.00 -1.13 0.00 4.64 -1.91 -3.35 113.55 118.35 2gir h SER 282 Ca -0.42 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.39 2gir h SER 282 Cb 1.22 0.00 -0.42 0.00 -0.31 0.00 0.00 62.40 62.89 2gir h SER 282 CO 0.78 0.00 -0.85 0.61 -0.87 0.00 0.00 176.83 176.49 2gir n GLY 283 N 0.91 5.15 3.53 -0.77 0.00 -0.11 -4.32 105.19 109.58 2gir n GLY 283 Ca 0.04 -2.39 -0.25 0.00 0.00 0.00 0.00 46.02 43.42 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 -4.78 2.01 0.35 1.61 -7.23 -1.12 -4.38 120.40 106.84 2gir s VAL 284 Ca 0.44 -2.14 0.02 0.00 -1.81 0.00 0.00 61.98 58.50 2gir s VAL 284 Cb 0.40 -2.68 0.24 0.00 0.56 0.00 0.00 36.38 34.90 2gir s VAL 284 CO -0.08 -0.17 1.98 0.25 -0.31 0.00 0.00 175.10 176.77 2gir h LEU 285 N 2.03 0.68 -0.94 1.32 5.85 -1.80 -2.65 115.31 119.80 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 1.24 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.10 2gir h LEU 285 CO 0.72 0.54 0.00 0.35 -0.34 0.00 0.00 178.44 179.71 2gir n THR 286 N -4.41 0.16 -0.03 1.05 -2.24 -1.26 -4.32 114.28 103.23 2gir n THR 286 Ca 0.05 -0.29 -0.09 0.00 -2.27 0.00 0.00 64.05 61.46 2gir n THR 286 Cb 0.09 0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.58 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 1.92 0.78 0.28 4.28 2.02 -1.73 0.38 112.91 120.84 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 0.42 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 2gir h THR 287 CO 0.00 0.00 -0.14 -1.28 0.37 0.00 0.00 175.52 174.47 2gir h SER 288 N -0.02 -0.32 -0.29 4.18 0.87 -1.75 -1.50 113.55 114.71 2gir h SER 288 Ca 0.10 -0.20 0.01 0.00 -1.23 0.00 0.00 61.79 60.47 2gir h SER 288 Cb 0.17 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2gir h SER 288 CO -0.21 0.06 0.16 0.00 -0.53 0.00 0.00 176.83 176.31 2gir h GLY 290 N 0.33 -0.02 1.04 0.00 0.00 -0.31 0.10 103.07 104.20 2gir h GLY 290 Ca 0.12 0.13 -0.04 0.00 0.00 0.00 0.00 47.33 47.54 2gir h GLY 290 CO -0.07 -0.12 0.35 3.43 0.00 0.00 0.00 176.54 180.14 2gir h ASN 291 N -0.13 1.06 -0.15 0.19 2.35 -1.08 -1.07 115.58 116.75 2gir h ASN 291 Ca 0.08 -0.15 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 2gir h ASN 291 Cb 0.24 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 2gir h ASN 291 CO -0.19 0.92 0.02 0.74 -1.65 0.00 0.00 177.43 177.27 2gir h THR 292 N 1.13 1.22 -0.29 2.81 2.02 -0.63 -0.18 112.91 119.00 2gir h THR 292 Ca 0.27 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.72 2gir h THR 292 Cb 0.16 1.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2gir h THR 292 CO -0.03 0.22 0.17 -0.07 0.37 0.00 0.00 175.52 176.18 2gir h LEU 293 N 0.03 0.35 -0.45 2.58 3.38 -0.66 -0.71 115.31 119.84 2gir h LEU 293 Ca 0.05 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2gir h LEU 293 Cb 0.31 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 2gir h LEU 293 CO 0.00 0.30 0.11 0.74 0.09 0.00 0.00 178.44 179.69 2gir h THR 294 N 0.36 1.23 -0.47 0.22 2.02 -1.15 0.11 112.91 115.24 2gir h THR 294 Ca 0.10 -0.82 -0.03 0.00 0.77 0.00 0.00 66.41 66.44 2gir h THR 294 Cb 0.02 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 2gir h THR 294 CO -0.02 0.29 0.17 0.00 0.37 0.00 0.00 175.52 176.33 2gir h TYR 296 N 0.61 0.69 0.46 0.00 5.03 -0.92 0.88 116.97 123.73 2gir h TYR 296 Ca 0.15 -0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.42 2gir h TYR 296 Cb 0.23 -0.22 0.00 0.00 1.55 0.00 0.00 36.73 38.29 2gir h TYR 296 CO 0.01 0.52 -0.22 1.25 -1.32 0.00 0.00 178.16 178.39 2gir h LEU 297 N 0.67 -0.53 -0.27 2.82 5.85 -0.59 0.55 115.31 123.81 2gir h LEU 297 Ca 0.18 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.90 2gir h LEU 297 Cb 0.05 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 2gir h LEU 297 CO -0.03 -0.32 0.10 0.11 -0.34 0.00 0.00 178.44 177.96 2gir h LYS 298 N -0.70 0.22 -0.51 1.25 1.57 -1.05 -1.67 116.57 115.68 2gir h LYS 298 Ca -0.06 -0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 58.59 2gir h LYS 298 Cb 0.52 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 2gir h LYS 298 CO 0.10 0.15 -0.14 0.00 -0.57 0.00 0.00 179.45 178.99 2gir h ALA 299 N 1.16 0.70 -0.48 3.86 0.00 -0.79 0.03 119.26 123.75 2gir h ALA 299 Ca 0.12 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2gir h ALA 299 Cb 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2gir h ALA 299 CO -0.11 0.64 0.24 0.77 0.00 0.00 0.00 179.25 180.79 2gir h SER 300 N 0.86 0.62 -0.65 0.00 0.02 -0.76 0.96 113.55 114.60 2gir h SER 300 Ca 0.13 -0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2gir h SER 300 Cb 0.70 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 2gir h SER 300 CO 0.05 0.56 0.39 0.00 -1.14 0.00 0.00 176.83 176.69 2gir h ALA 301 N 1.09 0.82 -0.30 3.77 0.00 -1.11 -2.75 119.26 120.78 2gir h ALA 301 Ca 0.17 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2gir h ALA 301 Cb 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2gir h ALA 301 CO -0.02 0.30 -0.17 0.00 0.00 0.00 0.00 179.25 179.36 2gir h ALA 302 N 1.20 1.15 -0.92 0.00 0.00 -0.54 -1.60 119.26 118.55 2gir h ALA 302 Ca 0.23 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 54.88 2gir h ALA 302 Cb -0.02 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.58 2gir h ALA 302 CO -0.04 0.53 0.60 0.00 0.00 0.00 0.00 179.25 180.34 2gir h ARG 304 N 1.12 0.71 -0.64 0.00 3.08 -1.11 -1.62 114.38 115.92 2gir h ARG 304 Ca 0.38 -0.47 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 2gir h ARG 304 Cb 0.08 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 2gir h ARG 304 CO -0.13 1.09 0.38 0.00 -1.07 0.00 0.00 179.97 180.25 2gir h ALA 305 N 0.62 1.46 -0.00 0.04 0.00 -0.99 -2.15 119.26 118.24 2gir h ALA 305 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2gir h ALA 305 Cb 1.08 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2gir h ALA 305 CO 0.10 0.46 -0.20 0.00 0.00 0.00 0.00 179.25 179.62 2gir n ALA 306 N -2.44 2.85 -3.43 0.00 0.00 -0.29 -4.93 120.51 112.26 2gir n ALA 306 Ca 0.06 -0.23 -0.24 0.00 0.00 0.00 0.00 53.44 53.04 2gir n ALA 306 Cb 0.07 -1.32 0.07 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.36 -7.02 -2.16 0.00 5.02 -0.66 -4.82 118.16 107.17 2gir n LYS 307 Ca 0.08 0.85 -0.41 0.00 -2.02 0.00 0.00 58.31 56.82 2gir n LYS 307 Cb 0.32 -5.85 -0.02 0.00 -0.02 0.00 0.00 35.03 29.46 2gir n LYS 307 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2gir s LEU 308 N -7.13 4.44 -0.16 -0.35 1.02 -0.92 -4.99 118.68 110.59 2gir s LEU 308 Ca 0.51 2.63 -0.15 0.00 0.02 0.00 0.00 54.13 57.13 2gir s LEU 308 Cb -0.22 -3.64 -0.04 0.00 0.02 0.00 0.00 46.19 42.30 2gir s LEU 308 CO 0.63 -0.49 0.36 -1.10 0.02 0.00 0.00 176.35 175.76 2gir s GLN 309 N -1.61 4.27 -1.29 1.70 -1.52 -1.26 -4.46 119.66 115.48 2gir s GLN 309 Ca 0.49 0.21 -0.03 0.00 -1.95 0.00 0.00 55.36 54.08 2gir s GLN 309 Cb -0.39 -3.45 0.01 0.00 -0.22 0.00 0.00 33.01 28.96 2gir s GLN 309 CO 0.50 0.16 0.96 -3.47 -0.25 0.00 0.00 175.29 173.20 2gir n ASP 310 N 3.77 -2.99 -4.70 5.90 -0.08 -1.26 -0.86 116.55 116.33 2gir n ASP 310 Ca -0.10 -0.67 -0.42 0.00 -1.51 0.00 0.00 54.79 52.09 2gir n ASP 310 Cb 0.52 -4.73 -0.03 0.00 2.34 0.00 0.00 41.12 39.22 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 1.76 2.32 0.12 0.00 2.01 -0.06 -5.01 115.64 116.78 2gir s THR 312 Ca 0.65 -0.91 0.06 0.00 0.31 0.00 0.00 61.69 61.80 2gir s THR 312 Cb -0.35 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.19 2gir s THR 312 CO 0.29 0.54 0.02 -0.04 -0.69 0.00 0.00 174.62 174.74 2gir s MET 313 N 0.58 2.55 -0.11 4.92 -1.94 -1.26 -1.42 119.30 122.61 2gir s MET 313 Ca -0.12 -0.92 -0.01 0.00 -1.71 0.00 0.00 55.69 52.93 2gir s MET 313 Cb -0.16 -2.50 0.03 0.00 2.01 0.00 0.00 34.83 34.21 2gir s MET 313 CO 0.04 0.51 -0.03 -1.17 -0.01 0.00 0.00 175.02 174.35 2gir s LEU 314 N -2.59 0.96 -0.10 -0.03 2.96 0.89 -4.21 118.68 116.57 2gir s LEU 314 Ca 0.27 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 53.92 2gir s LEU 314 Cb -0.11 -0.65 0.01 0.00 0.50 0.00 0.00 46.19 45.94 2gir s LEU 314 CO 0.19 -0.17 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.20 2gir s VAL 315 N 1.83 1.49 -0.30 1.68 1.01 0.07 -0.79 120.40 125.38 2gir s VAL 315 Ca 0.04 -0.66 -0.00 0.00 0.00 0.00 0.00 61.98 61.36 2gir s VAL 315 Cb -0.13 -1.35 0.10 0.00 0.00 0.00 0.00 36.38 35.00 2gir s VAL 315 CO -0.07 0.44 0.08 0.20 0.00 0.00 0.00 175.10 175.75 2gir s ASN 316 N 0.83 4.03 1.32 3.32 -0.87 -0.21 -0.69 114.94 122.67 2gir s ASN 316 Ca -0.10 -1.62 0.00 0.00 -1.57 0.00 0.00 52.86 49.57 2gir s ASN 316 Cb -0.15 -0.93 0.00 0.00 -0.02 0.00 0.00 41.25 40.14 2gir s ASN 316 CO 0.01 -0.40 0.00 0.61 -2.57 0.00 0.00 177.10 174.75 2gir n GLY 317 N 4.80 3.52 0.23 0.66 0.00 -1.26 -0.70 105.19 112.43 2gir n GLY 317 Ca -0.02 0.14 0.15 0.00 0.00 0.00 0.00 46.02 46.28 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 5.77 0.72 -4.68 1.61 5.75 -1.26 -3.79 116.55 120.66 2gir n ASP 318 Ca 0.00 -1.19 -0.38 0.00 -0.01 0.00 0.00 54.79 53.20 2gir n ASP 318 Cb 0.00 -0.01 -0.07 0.00 -1.03 0.00 0.00 41.12 40.02 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 -2.04 6.55 -0.08 -1.12 -1.08 0.12 -4.67 116.67 114.36 2gir s ASP 319 Ca 0.42 0.66 0.02 0.00 -0.52 0.00 0.00 52.55 53.13 2gir s ASP 319 Cb 0.21 -2.27 0.01 0.00 -1.46 0.00 0.00 42.92 39.42 2gir s ASP 319 CO 0.36 -0.10 -0.14 -0.22 0.52 0.00 0.00 175.17 175.59 2gir s LEU 320 N 1.28 1.69 -0.08 -1.34 2.96 -1.26 -1.05 118.68 120.88 2gir s LEU 320 Ca 0.23 -0.35 0.04 0.00 -0.22 0.00 0.00 54.13 53.83 2gir s LEU 320 Cb -0.15 -0.95 -0.01 0.00 0.50 0.00 0.00 46.19 45.58 2gir s LEU 320 CO 0.09 0.04 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.25 2gir s VAL 321 N 0.73 2.31 -0.06 1.68 1.01 0.03 -1.98 120.40 124.12 2gir s VAL 321 Ca -0.13 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 60.93 2gir s VAL 321 Cb -0.16 -1.88 -0.00 0.00 0.00 0.00 0.00 36.38 34.34 2gir s VAL 321 CO 0.03 0.56 -0.19 -0.69 0.00 0.00 0.00 175.10 174.81 2gir s VAL 322 N -0.01 1.62 -0.10 2.92 1.01 -0.04 -0.08 120.40 125.73 2gir s VAL 322 Ca -0.07 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.14 2gir s VAL 322 Cb -0.15 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 34.83 2gir s VAL 322 CO 0.05 0.46 -0.18 -0.63 0.00 0.00 0.00 175.10 174.80 2gir s ILE 323 N 0.20 1.68 0.34 2.22 1.01 -0.51 -0.85 121.20 125.29 2gir s ILE 323 Ca -0.10 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 59.82 2gir s ILE 323 Cb -0.14 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.82 2gir s ILE 323 CO 0.04 0.48 0.36 0.00 0.00 0.00 0.00 174.94 175.82 2gir s GLU 325 N -3.16 4.41 0.21 0.00 0.41 -0.04 -0.87 118.70 119.67 2gir s GLU 325 Ca 0.36 1.32 -0.30 0.00 -0.41 0.00 0.00 54.97 55.94 2gir s GLU 325 Cb 0.01 -3.54 -0.09 0.00 -1.78 0.00 0.00 34.13 28.73 2gir s GLU 325 CO 0.26 -0.28 1.34 0.45 -0.49 0.00 0.00 175.26 176.53 2gir s SER 326 N 1.09 6.84 -0.34 -0.19 0.15 0.78 -4.40 113.70 117.63 2gir s SER 326 Ca 0.47 2.47 0.09 0.00 0.70 0.00 0.00 55.95 59.67 2gir s SER 326 Cb -0.18 -2.61 0.66 0.00 -1.71 0.00 0.00 66.02 62.17 2gir s SER 326 CO 0.18 -0.56 1.74 0.00 1.20 0.00 0.00 173.24 175.79 2gir n ALA 327 N 2.50 4.67 0.00 5.45 0.00 -1.26 -4.86 120.51 127.01 2gir n ALA 327 Ca 0.06 -2.66 0.00 0.00 0.00 0.00 0.00 53.44 50.84 2gir n ALA 327 Cb 0.42 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 -0.67 0.88 0.22 0.00 0.00 -1.26 -4.54 105.19 99.82 2gir n GLY 328 Ca 0.43 -1.77 -0.14 0.00 0.00 0.00 0.00 46.02 44.54 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 1.30 -0.33 2.61 1.35 -1.99 -0.70 112.91 115.15 2gir h THR 329 Ca 0.00 -1.88 -0.16 0.00 -0.55 0.00 0.00 66.41 63.82 2gir h THR 329 Cb 0.00 1.83 -0.01 0.00 -1.73 0.00 0.00 68.15 68.25 2gir h THR 329 CO 0.00 0.60 -0.44 -0.61 -0.25 0.00 0.00 175.52 174.82 2gir h GLN 330 N 0.54 0.85 -0.11 4.72 5.75 -2.00 -2.07 115.11 122.79 2gir h GLN 330 Ca -0.02 -0.47 -0.18 0.00 -0.15 0.00 0.00 58.65 57.83 2gir h GLN 330 Cb 1.25 0.03 -0.00 0.00 1.07 0.00 0.00 27.48 29.83 2gir h GLN 330 CO 0.13 1.11 -0.70 1.49 -2.65 0.00 0.00 178.83 178.21 2gir h GLU 331 N 0.68 0.47 -0.23 1.69 4.57 -1.79 -1.95 114.58 118.02 2gir h GLU 331 Ca 0.04 -0.37 0.01 0.00 -1.18 0.00 0.00 59.36 57.87 2gir h GLU 331 Cb 1.02 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.66 2gir h GLU 331 CO 0.10 1.00 0.13 -0.44 -1.18 0.00 0.00 179.01 178.61 2gir h ASP 332 N 0.33 0.20 -0.63 1.04 3.32 -0.98 0.29 116.42 119.99 2gir h ASP 332 Ca -0.03 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.05 2gir h ASP 332 Cb 1.27 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.75 2gir h ASP 332 CO 0.12 0.15 0.41 0.00 -1.72 0.00 0.00 179.24 178.20 2gir h ALA 333 N 1.11 0.82 -0.46 3.45 0.00 -1.32 -1.10 119.26 121.75 2gir h ALA 333 Ca 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2gir h ALA 333 Cb 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2gir h ALA 333 CO -0.05 0.18 0.22 0.00 0.00 0.00 0.00 179.25 179.60 2gir h ALA 334 N 1.26 0.59 -0.86 0.00 0.00 -1.13 -2.43 119.26 116.69 2gir h ALA 334 Ca 0.25 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.09 2gir h ALA 334 Cb -0.03 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 2gir h ALA 334 CO -0.08 0.16 0.54 0.77 0.00 0.00 0.00 179.25 180.64 2gir h SER 335 N 0.60 0.87 -0.00 0.00 0.02 -0.47 -1.77 113.55 112.79 2gir h SER 335 Ca 0.16 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.04 2gir h SER 335 Cb 0.12 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 2gir h SER 335 CO -0.02 0.57 -0.19 -0.07 -1.14 0.00 0.00 176.83 175.98 2gir h LEU 336 N 1.01 0.34 -0.52 5.07 3.38 -1.05 0.28 115.31 123.83 2gir h LEU 336 Ca 0.36 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2gir h LEU 336 Cb 0.11 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2gir h LEU 336 CO -0.15 0.56 0.32 0.03 0.09 0.00 0.00 178.44 179.29 2gir h ARG 337 N 0.32 0.69 -0.31 1.13 3.08 -0.85 -0.70 114.38 117.75 2gir h ARG 337 Ca 0.06 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 2gir h ARG 337 Cb 0.53 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 2gir h ARG 337 CO 0.03 0.48 -0.21 0.28 -1.07 0.00 0.00 179.97 179.49 2gir h VAL 338 N 0.69 1.30 -0.60 2.04 2.07 -0.90 -0.64 116.25 120.21 2gir h VAL 338 Ca 0.19 -1.34 0.08 0.00 0.82 0.00 0.00 66.70 66.44 2gir h VAL 338 Cb -0.04 1.50 -0.06 0.00 -1.52 0.00 0.00 31.29 31.16 2gir h VAL 338 CO -0.04 0.43 0.26 0.15 0.02 0.00 0.00 177.57 178.39 2gir h PHE 339 N 0.43 0.46 -0.51 1.57 3.57 -0.86 0.32 116.94 121.92 2gir h PHE 339 Ca 0.06 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.47 2gir h PHE 339 Cb 0.75 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.36 2gir h PHE 339 CO 0.07 0.17 -0.15 1.15 -2.23 0.00 0.00 178.31 177.31 2gir h THR 340 N 0.48 1.27 -0.60 4.41 2.02 -0.85 -0.76 112.91 118.88 2gir h THR 340 Ca 0.29 -1.31 0.04 0.00 0.77 0.00 0.00 66.41 66.19 2gir h THR 340 Cb 0.30 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 2gir h THR 340 CO -0.25 0.46 0.34 -0.33 0.37 0.00 0.00 175.52 176.11 2gir h GLU 341 N 0.88 0.65 -0.41 6.66 5.08 -0.69 -1.04 114.58 125.70 2gir h GLU 341 Ca 0.13 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 2gir h GLU 341 Cb 0.72 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2gir h GLU 341 CO 0.06 0.43 -0.02 0.00 -1.00 0.00 0.00 179.01 178.48 2gir h ALA 342 N 1.29 0.56 -0.68 3.43 0.00 -0.72 -1.45 119.26 121.68 2gir h ALA 342 Ca 0.25 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2gir h ALA 342 Cb 0.09 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2gir h ALA 342 CO -0.13 0.36 0.42 0.52 0.00 0.00 0.00 179.25 180.42 2gir h MET 343 N 0.57 0.91 -0.43 0.00 2.86 -0.96 -1.62 114.93 116.27 2gir h MET 343 Ca 0.11 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2gir h MET 343 Cb 0.51 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 2gir h MET 343 CO 0.02 0.64 0.26 1.15 1.06 0.00 0.00 176.91 180.04 2gir h THR 344 N 0.92 1.14 -0.65 2.22 2.02 -1.06 0.12 112.91 117.62 2gir h THR 344 Ca 0.25 -0.30 0.09 0.00 0.77 0.00 0.00 66.41 67.21 2gir h THR 344 Cb -0.05 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 66.88 2gir h THR 344 CO -0.05 0.14 0.43 0.03 0.37 0.00 0.00 175.52 176.44 2gir h ARG 345 N 0.57 0.52 -0.05 6.66 3.08 -0.88 -1.16 114.38 123.12 2gir h ARG 345 Ca 0.15 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.17 2gir h ARG 345 Cb -0.01 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.93 2gir h ARG 345 CO -0.03 0.35 0.00 0.66 -1.07 0.00 0.00 179.97 179.88 2gir n TYR 346 N -4.48 0.07 -2.99 3.04 4.01 -0.60 -0.95 117.16 115.26 2gir n TYR 346 Ca 0.10 -0.04 -0.12 0.00 -0.16 0.00 0.00 57.90 57.68 2gir n TYR 346 Cb 0.32 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.41 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 -0.42 -3.69 -3.06 7.72 2.88 -0.44 -4.92 113.62 111.69 2gir n SER 347 Ca 0.09 -0.51 -0.16 0.00 -1.33 0.00 0.00 58.87 56.95 2gir n SER 347 Cb 0.09 -4.11 -0.00 0.00 -0.75 0.00 0.00 64.21 59.44 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 -3.15 1.26 -1.58 -1.46 0.00 0.31 -4.61 120.51 111.29 2gir n ALA 348 Ca -0.15 -2.86 -0.33 0.00 0.00 0.00 0.00 53.44 50.10 2gir n ALA 348 Cb 0.61 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 19.11 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 -1.49 2.97 0.53 0.00 0.04 -1.26 -3.78 135.00 132.00 2gir s PRO 349 Ca 0.35 1.39 -0.17 0.00 0.04 0.00 0.00 61.00 62.61 2gir s PRO 349 Cb 0.31 -1.97 -0.07 0.00 0.04 0.00 0.00 34.50 32.80 2gir s PRO 349 CO -0.09 -1.11 1.00 -1.25 0.04 0.00 0.00 177.00 175.59 2gir s PRO 350 N -3.98 3.85 0.00 0.56 0.04 -1.26 -0.85 135.00 133.35 2gir s PRO 350 Ca 0.67 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.72 2gir s PRO 350 Cb -0.20 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.22 2gir s PRO 350 CO 0.39 -0.36 0.00 0.41 0.04 0.00 0.00 177.00 177.48 2gir n GLY 351 N -1.42 1.44 3.73 0.56 0.00 0.40 -4.24 105.19 105.66 2gir n GLY 351 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 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 7.27 0.35 1.61 1.01 -1.26 -4.96 116.67 119.69 2gir s ASP 352 Ca 0.00 2.04 -0.27 0.00 0.71 0.00 0.00 52.55 55.03 2gir s ASP 352 Cb 0.00 -2.60 -0.09 0.00 1.01 0.00 0.00 42.92 41.24 2gir s ASP 352 CO 0.00 -0.24 1.21 -2.16 0.21 0.00 0.00 175.17 174.19 2gir s PRO 353 N -0.12 4.26 0.52 8.23 0.04 -1.26 -4.45 135.00 142.23 2gir s PRO 353 Ca 0.50 1.97 -0.21 0.00 0.04 0.00 0.00 61.00 63.30 2gir s PRO 353 Cb -0.28 -2.91 -0.05 0.00 0.04 0.00 0.00 34.50 31.29 2gir s PRO 353 CO 0.33 -0.18 1.24 -1.25 0.04 0.00 0.00 177.00 177.19 2gir s PRO 354 N -1.96 3.34 -0.08 0.56 0.04 -1.26 -5.03 135.00 130.61 2gir s PRO 354 Ca 0.52 1.95 0.03 0.00 0.04 0.00 0.00 61.00 63.53 2gir s PRO 354 Cb -0.34 -2.23 0.01 0.00 0.04 0.00 0.00 34.50 31.98 2gir s PRO 354 CO 0.44 -0.94 -0.15 -0.65 0.04 0.00 0.00 177.00 175.73 2gir s GLN 355 N -2.94 2.09 0.16 4.56 -0.21 -1.26 -4.99 119.66 117.07 2gir s GLN 355 Ca 0.70 -0.54 -0.31 0.00 0.02 0.00 0.00 55.36 55.23 2gir s GLN 355 Cb -0.33 -1.69 -0.08 0.00 1.00 0.00 0.00 33.01 31.91 2gir s GLN 355 CO 0.39 0.05 1.38 -1.25 -2.12 0.00 0.00 175.29 173.73 2gir s PRO 356 N 0.65 4.33 -0.02 2.91 0.04 -1.26 -4.55 135.00 137.11 2gir s PRO 356 Ca -0.14 2.10 0.05 0.00 0.04 0.00 0.00 61.00 63.05 2gir s PRO 356 Cb -0.16 -3.21 -0.03 0.00 0.04 0.00 0.00 34.50 31.14 2gir s PRO 356 CO 0.04 -0.38 -0.17 -1.21 0.04 0.00 0.00 177.00 175.32 2gir s GLU 357 N 0.59 2.32 -0.10 4.56 0.41 0.16 -4.96 118.70 121.68 2gir s GLU 357 Ca 0.62 -0.81 0.14 0.00 -0.41 0.00 0.00 54.97 54.50 2gir s GLU 357 Cb -0.37 -2.28 0.27 0.00 -1.78 0.00 0.00 34.13 29.97 2gir s GLU 357 CO 0.34 0.59 1.17 0.66 -0.49 0.00 0.00 175.26 177.53 2gir n TYR 358 N 2.07 0.18 -3.73 1.61 4.01 -1.26 -1.25 117.16 118.78 2gir n TYR 358 Ca -0.17 -0.85 -0.24 0.00 -0.16 0.00 0.00 57.90 56.49 2gir n TYR 358 Cb 0.52 -0.15 -0.17 0.00 -0.31 0.00 0.00 39.34 39.23 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 -2.22 1.93 0.48 7.72 -1.08 -1.26 -5.02 116.67 117.21 2gir s ASP 359 Ca 0.26 -0.30 0.18 0.00 -0.52 0.00 0.00 52.55 52.17 2gir s ASP 359 Cb 0.22 -0.42 1.18 0.00 -1.46 0.00 0.00 42.92 42.44 2gir s ASP 359 CO 0.04 -0.25 2.01 0.25 0.52 0.00 0.00 175.17 177.74 2gir h LEU 360 N 8.33 0.20 -0.85 -1.34 5.85 -1.97 -0.52 115.31 125.02 2gir h LEU 360 Ca -0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.55 2gir h LEU 360 Cb 1.13 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2gir h LEU 360 CO 0.27 0.12 0.00 -0.33 -0.34 0.00 0.00 178.44 178.16 2gir h GLU 361 N 0.23 0.00 -0.00 1.25 5.08 -1.97 -2.88 114.58 116.28 2gir h GLU 361 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2gir h GLU 361 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2gir h GLU 361 CO -0.04 0.00 -0.39 1.28 -1.00 0.00 0.00 179.01 178.86 2gir n LEU 362 N -2.36 0.88 -4.65 1.33 4.77 -0.20 -4.60 117.00 112.17 2gir n LEU 362 Ca 0.02 -0.20 -0.41 0.00 -0.03 0.00 0.00 56.01 55.39 2gir n LEU 362 Cb 0.23 -0.16 -0.05 0.00 -2.33 0.00 0.00 43.42 41.11 2gir n LEU 362 CO 0.20 0.18 0.48 -0.63 -1.33 0.00 0.00 177.39 176.29 2gir s ILE 363 N -2.70 4.95 -0.21 -0.08 1.01 -1.09 -5.04 121.20 118.04 2gir s ILE 363 Ca 0.18 1.34 -0.08 0.00 0.00 0.00 0.00 60.65 62.09 2gir s ILE 363 Cb 0.18 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 2gir s ILE 363 CO 0.60 0.04 0.08 -0.89 0.00 0.00 0.00 174.94 174.78 2gir s THR 364 N 2.26 4.74 -0.16 2.92 2.01 -1.26 -4.42 115.64 121.72 2gir s THR 364 Ca 0.31 -0.04 -0.16 0.00 0.31 0.00 0.00 61.69 62.11 2gir s THR 364 Cb -0.16 -3.17 0.04 0.00 0.01 0.00 0.00 72.50 69.23 2gir s THR 364 CO 0.10 0.40 0.46 -0.94 -0.69 0.00 0.00 174.62 173.95 2gir s SER 365 N 0.85 -0.46 -1.53 3.53 1.04 0.23 -4.70 113.70 112.66 2gir s SER 365 Ca 0.04 0.86 -0.13 0.00 0.48 0.00 0.00 55.95 57.20 2gir s SER 365 Cb -0.14 0.88 0.08 0.00 0.10 0.00 0.00 66.02 66.95 2gir s SER 365 CO 0.02 -0.20 0.97 0.00 0.98 0.00 0.00 173.24 175.02 2gir n SER 367 N -2.84 -5.21 -4.19 0.00 7.64 -1.26 -4.93 113.62 102.82 2gir n SER 367 Ca 0.03 0.40 -0.11 0.00 1.01 0.00 0.00 58.87 60.20 2gir n SER 367 Cb 0.53 -4.58 -0.10 0.00 -1.01 0.00 0.00 64.21 59.05 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 -2.54 1.13 0.06 6.43 0.01 -0.80 -4.41 113.70 113.57 2gir s SER 368 Ca 0.00 -1.06 -0.04 0.00 1.31 0.00 0.00 55.95 56.15 2gir s SER 368 Cb 0.00 0.11 -0.02 0.00 0.21 0.00 0.00 66.02 66.32 2gir s SER 368 CO 0.00 -0.51 0.06 0.54 0.41 0.00 0.00 173.24 173.74 2gir s ASN 369 N -3.08 0.32 0.21 2.44 4.22 0.15 -0.60 114.94 118.60 2gir s ASN 369 Ca 0.16 -0.80 -0.30 0.00 -2.14 0.00 0.00 52.86 49.78 2gir s ASN 369 Cb 0.06 0.25 -0.08 0.00 1.28 0.00 0.00 41.25 42.75 2gir s ASN 369 CO -0.02 -0.62 1.07 -0.69 -2.04 0.00 0.00 177.10 174.80 2gir s VAL 370 N -3.63 3.83 0.33 3.54 1.01 -1.26 -0.82 120.40 123.39 2gir s VAL 370 Ca 0.04 1.68 0.06 0.00 0.00 0.00 0.00 61.98 63.75 2gir s VAL 370 Cb 0.05 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 2gir s VAL 370 CO -0.09 0.34 0.23 -0.55 0.00 0.00 0.00 175.10 175.03 2gir s SER 371 N -0.49 1.72 -0.02 3.32 0.15 0.01 -4.34 113.70 114.05 2gir s SER 371 Ca 0.47 -1.70 0.03 0.00 0.70 0.00 0.00 55.95 55.44 2gir s SER 371 Cb -0.29 0.53 -0.00 0.00 -1.71 0.00 0.00 66.02 64.54 2gir s SER 371 CO 0.36 -1.01 -0.11 0.54 1.20 0.00 0.00 173.24 174.22 2gir s VAL 372 N -3.48 0.93 0.00 4.45 0.11 -1.26 -1.26 120.40 119.89 2gir s VAL 372 Ca 0.37 -0.46 0.00 0.00 -2.93 0.00 0.00 61.98 58.96 2gir s VAL 372 Cb 0.03 -0.80 0.00 0.00 -1.53 0.00 0.00 36.38 34.08 2gir s VAL 372 CO 0.23 0.28 0.00 0.00 -3.33 0.00 0.00 175.10 172.28 2gir n ALA 373 N 3.09 0.00 -2.48 1.54 0.00 -0.33 -3.25 120.51 119.08 2gir n ALA 373 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.02 2gir n ALA 373 Cb 0.55 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.85 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 -1.74 1.66 0.83 0.00 3.76 -0.11 -0.30 115.29 119.40 2gir s HIS 374 Ca 0.00 -0.33 -0.06 0.00 -0.15 0.00 0.00 55.06 54.52 2gir s HIS 374 Cb 0.00 -1.05 0.18 0.00 1.11 0.00 0.00 32.58 32.81 2gir s HIS 374 CO 0.00 -0.00 1.14 0.16 -0.85 0.00 0.00 174.74 175.19 2gir s ASP 375 N -0.62 3.70 0.40 1.40 1.47 -0.53 -0.97 116.67 121.52 2gir s ASP 375 Ca 0.07 -0.29 0.17 0.00 1.18 0.00 0.00 52.55 53.68 2gir s ASP 375 Cb -0.07 0.14 1.06 0.00 -0.34 0.00 0.00 42.92 43.71 2gir s ASP 375 CO -0.00 -2.32 1.81 0.00 0.68 0.00 0.00 175.17 175.34 2gir h ALA 376 N -1.01 2.18 0.00 2.11 0.00 -1.91 0.84 119.26 121.48 2gir h ALA 376 Ca -0.37 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2gir h ALA 376 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2gir h ALA 376 CO 0.35 -0.52 0.00 0.77 0.00 0.00 0.00 179.25 179.84 2gir h SER 377 N 0.43 0.00 0.00 0.00 0.02 -1.94 -3.46 113.55 108.61 2gir h SER 377 Ca 0.54 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.49 2gir h SER 377 Cb 1.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.84 2gir h SER 377 CO -0.24 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.06 2gir n GLY 378 N 0.24 0.28 3.77 -3.77 0.00 0.29 -5.06 105.19 100.93 2gir n GLY 378 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.92 3.90 0.14 1.61 2.20 -1.26 -4.65 119.74 120.75 2gir s LYS 379 Ca 0.00 2.22 -0.31 0.00 -0.36 0.00 0.00 55.97 57.53 2gir s LYS 379 Cb 0.00 -2.73 -0.08 0.00 -1.51 0.00 0.00 37.83 33.51 2gir s LYS 379 CO 0.00 -0.57 1.33 1.03 -0.36 0.00 0.00 175.35 176.78 2gir s ARG 380 N -2.29 4.37 -0.05 4.03 0.52 -1.26 -1.46 118.95 122.80 2gir s ARG 380 Ca 0.58 2.02 0.02 0.00 -0.52 0.00 0.00 55.73 57.82 2gir s ARG 380 Cb -0.39 -3.24 0.02 0.00 0.52 0.00 0.00 34.95 31.85 2gir s ARG 380 CO 0.51 -0.34 -0.08 0.54 0.02 0.00 0.00 175.30 175.95 2gir s VAL 381 N 0.72 0.79 0.20 3.52 0.11 0.59 -4.92 120.40 121.41 2gir s VAL 381 Ca 0.61 -0.28 -0.20 0.00 -2.93 0.00 0.00 61.98 59.18 2gir s VAL 381 Cb -0.35 -0.76 -0.08 0.00 -1.53 0.00 0.00 36.38 33.65 2gir s VAL 381 CO 0.33 0.28 0.72 -0.31 -3.33 0.00 0.00 175.10 172.79 2gir s TYR 382 N 0.79 3.69 0.19 1.54 2.02 -1.26 -1.19 117.35 123.14 2gir s TYR 382 Ca -0.13 1.40 -0.17 0.00 -0.37 0.00 0.00 57.07 57.81 2gir s TYR 382 Cb -0.15 -2.62 0.02 0.00 -0.40 0.00 0.00 41.96 38.81 2gir s TYR 382 CO 0.02 0.38 0.50 1.52 -1.57 0.00 0.00 175.55 176.39 2gir s TYR 383 N -1.45 -0.08 -0.09 2.71 1.13 -0.39 -4.98 117.35 114.21 2gir s TYR 383 Ca 0.41 -0.27 -0.14 0.00 -1.41 0.00 0.00 57.07 55.66 2gir s TYR 383 Cb -0.18 0.35 -0.05 0.00 -1.10 0.00 0.00 41.96 40.98 2gir s TYR 383 CO 0.21 -0.89 0.34 -1.17 -2.51 0.00 0.00 175.55 171.53 2gir s LEU 384 N -2.88 4.35 0.32 -3.49 2.96 -1.26 -0.81 118.68 117.87 2gir s LEU 384 Ca 0.10 0.71 0.05 0.00 -0.22 0.00 0.00 54.13 54.77 2gir s LEU 384 Cb -0.01 -2.45 -0.03 0.00 0.50 0.00 0.00 46.19 44.21 2gir s LEU 384 CO -0.03 0.22 0.22 0.28 -1.32 0.00 0.00 176.35 175.72 2gir s THR 385 N -0.30 0.12 0.27 3.68 -1.32 -0.00 -4.75 115.64 113.34 2gir s THR 385 Ca 0.20 -2.00 -0.12 0.00 -1.21 0.00 0.00 61.69 58.56 2gir s THR 385 Cb -0.14 -2.48 -0.00 0.00 -1.51 0.00 0.00 72.50 68.37 2gir s THR 385 CO 0.08 0.00 0.50 0.00 -2.21 0.00 0.00 174.62 172.99 2gir s ARG 386 N -3.62 1.63 0.19 7.08 1.70 -1.26 -0.67 118.95 124.00 2gir s ARG 386 Ca 0.38 -1.32 -0.31 0.00 -0.47 0.00 0.00 55.73 54.00 2gir s ARG 386 Cb 0.03 0.48 -0.11 0.00 -0.57 0.00 0.00 34.95 34.78 2gir s ARG 386 CO 0.23 -0.69 1.58 0.34 -1.08 0.00 0.00 175.30 175.68 2gir s ASP 387 N -3.05 6.54 0.00 -2.89 -1.08 -1.26 -4.90 116.67 110.03 2gir s ASP 387 Ca 0.23 2.70 0.29 0.00 -0.52 0.00 0.00 52.55 55.25 2gir s ASP 387 Cb -0.01 -2.60 1.49 0.00 -1.46 0.00 0.00 42.92 40.34 2gir s ASP 387 CO 0.11 -0.84 1.99 -0.81 0.52 0.00 0.00 175.17 176.13 2gir n PRO 388 N 3.61 1.28 0.17 4.34 -0.04 -1.26 -4.40 135.00 138.71 2gir n PRO 388 Ca 0.13 -0.41 -0.14 0.00 -0.04 0.00 0.00 63.50 63.04 2gir n PRO 388 Cb 0.38 -1.47 -0.08 0.00 -0.04 0.00 0.00 33.50 32.29 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 0.97 0.73 -0.12 0.52 2.02 -1.96 -0.43 112.91 114.65 2gir h THR 389 Ca 0.00 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 2gir h THR 389 Cb 0.21 0.79 -0.00 0.00 -1.74 0.00 0.00 68.15 67.40 2gir h THR 389 CO 0.00 0.02 0.01 0.74 0.37 0.00 0.00 175.52 176.67 2gir h THR 390 N -0.43 1.23 -0.86 3.16 2.02 -1.95 -0.42 112.91 115.65 2gir h THR 390 Ca -0.04 -0.72 0.20 0.00 0.77 0.00 0.00 66.41 66.63 2gir h THR 390 Cb 0.33 1.47 -0.12 0.00 -1.74 0.00 0.00 68.15 68.09 2gir h THR 390 CO 0.06 0.21 0.35 -0.65 0.37 0.00 0.00 175.52 175.87 2gir h PRO 391 N -0.04 0.38 -0.02 6.66 0.11 -1.79 -0.82 132.00 136.48 2gir h PRO 391 Ca 0.04 -0.02 -0.20 0.00 0.11 0.00 0.00 66.00 65.92 2gir h PRO 391 Cb 0.31 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 2gir h PRO 391 CO 0.00 0.25 -0.85 -0.07 -0.21 0.00 0.00 178.00 177.13 2gir h LEU 392 N 0.39 0.36 -0.43 2.35 3.38 -0.68 -0.68 115.31 120.00 2gir h LEU 392 Ca 0.52 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 2gir h LEU 392 Cb 0.96 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 2gir h LEU 392 CO -0.51 1.05 0.18 0.00 0.09 0.00 0.00 178.44 179.25 2gir h ALA 393 N 0.93 0.56 -0.41 1.53 0.00 -0.75 -1.69 119.26 119.43 2gir h ALA 393 Ca -0.05 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 2gir h ALA 393 Cb 1.46 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 2gir h ALA 393 CO 0.14 0.15 -0.16 0.00 0.00 0.00 0.00 179.25 179.38 2gir h ARG 394 N 0.55 0.77 -0.93 0.00 3.08 -1.06 -2.51 114.38 114.29 2gir h ARG 394 Ca 0.15 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.91 2gir h ARG 394 Cb 0.17 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.12 2gir h ARG 394 CO -0.01 0.88 0.57 0.00 -1.07 0.00 0.00 179.97 180.34 2gir h ALA 395 N 1.13 1.25 -0.73 0.04 0.00 -0.97 -0.23 119.26 119.75 2gir h ALA 395 Ca 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2gir h ALA 395 Cb 0.65 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2gir h ALA 395 CO 0.05 0.65 0.38 0.00 0.00 0.00 0.00 179.25 180.32 2gir h ALA 396 N 1.35 0.94 -0.26 0.00 0.00 -1.03 0.13 119.26 120.39 2gir h ALA 396 Ca 0.33 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 2gir h ALA 396 Cb -0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2gir h ALA 396 CO -0.06 0.48 0.06 2.35 0.00 0.00 0.00 179.25 182.08 2gir h TRP 397 N 1.02 0.44 0.00 0.00 2.91 -1.02 -2.94 115.95 116.36 2gir h TRP 397 Ca 0.26 -0.05 -0.00 0.00 1.13 0.00 0.00 58.89 60.22 2gir h TRP 397 Cb 0.07 -0.12 -0.00 0.00 -0.51 0.00 0.00 29.16 28.60 2gir h TRP 397 CO 0.00 0.50 -0.02 0.93 -1.03 0.00 0.00 178.44 178.83 2gir h GLU 398 N 0.24 0.00 -0.39 2.65 5.08 -0.71 -1.07 114.58 120.38 2gir h GLU 398 Ca 0.08 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2gir h GLU 398 Cb 0.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2gir h GLU 398 CO 0.00 0.02 0.15 1.15 -1.00 0.00 0.00 179.01 179.33 2gir h THR 399 N 0.00 1.15 0.00 1.13 2.02 -0.56 -3.29 112.91 113.36 2gir h THR 399 Ca -0.00 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.70 2gir h THR 399 Cb 0.35 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 2gir h THR 399 CO 0.00 0.19 -1.31 0.00 0.37 0.00 0.00 175.52 174.76 2gir n ALA 400 N -2.47 3.00 -3.41 6.16 0.00 -0.68 -4.90 120.51 118.21 2gir n ALA 400 Ca 0.03 -0.36 -0.14 0.00 0.00 0.00 0.00 53.44 52.96 2gir n ALA 400 Cb 0.15 -0.50 -0.15 0.00 0.00 0.00 0.00 19.45 18.94 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 -2.77 0.06 0.23 0.00 1.81 -0.49 -4.93 118.95 112.86 2gir s ARG 401 Ca -0.02 0.08 -0.30 0.00 -1.72 0.00 0.00 55.73 53.78 2gir s ARG 401 Cb 0.10 -0.22 -0.09 0.00 -0.45 0.00 0.00 34.95 34.29 2gir s ARG 401 CO 0.60 -0.09 1.05 -1.01 -0.68 0.00 0.00 175.30 175.17 2gir s HIS 402 N 0.65 3.70 0.12 -0.53 3.76 -1.26 -4.29 115.29 117.44 2gir s HIS 402 Ca -0.06 1.73 0.04 0.00 -0.15 0.00 0.00 55.06 56.62 2gir s HIS 402 Cb -0.08 -3.19 -0.04 0.00 1.11 0.00 0.00 32.58 30.37 2gir s HIS 402 CO -0.02 -0.27 -0.09 0.95 -0.85 0.00 0.00 174.74 174.46 2gir s THR 403 N -0.83 0.97 0.44 1.30 -4.23 -1.26 -5.06 115.64 106.98 2gir s THR 403 Ca 0.45 -1.89 0.12 0.00 -1.18 0.00 0.00 61.69 59.19 2gir s THR 403 Cb -0.29 -1.64 0.21 0.00 1.34 0.00 0.00 72.50 72.12 2gir s THR 403 CO 0.36 -0.72 2.02 1.55 -0.54 0.00 0.00 174.62 177.30 2gir h PRO 404 N 3.09 0.17 -5.07 3.99 0.13 -1.96 -3.40 132.00 128.95 2gir h PRO 404 Ca -0.36 -0.02 -0.65 0.00 -0.87 0.00 0.00 66.00 64.10 2gir h PRO 404 Cb 1.18 -0.03 -0.34 0.00 0.13 0.00 0.00 31.00 31.94 2gir h PRO 404 CO 0.60 0.22 -0.86 0.08 -0.23 0.00 0.00 178.00 177.82 2gir s VAL 405 N -4.93 1.88 -0.86 1.56 1.01 -1.26 -4.65 120.40 113.16 2gir s VAL 405 Ca -0.05 -0.88 -0.20 0.00 0.00 0.00 0.00 61.98 60.85 2gir s VAL 405 Cb 0.16 -1.67 0.11 0.00 0.00 0.00 0.00 36.38 34.98 2gir s VAL 405 CO 0.71 0.52 1.08 0.20 0.00 0.00 0.00 175.10 177.61 2gir s ASN 406 N 0.82 6.50 0.40 3.32 0.01 -0.10 -4.87 114.94 121.02 2gir s ASN 406 Ca -0.08 -1.76 0.08 0.00 -0.71 0.00 0.00 52.86 50.39 2gir s ASN 406 Cb -0.16 -2.41 0.85 0.00 0.41 0.00 0.00 41.25 39.95 2gir s ASN 406 CO -0.01 -1.17 2.01 0.77 -1.51 0.00 0.00 177.10 177.19 2gir h SER 407 N 9.05 0.52 -0.90 -1.22 4.64 -1.93 -1.74 113.55 121.97 2gir h SER 407 Ca 0.04 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2gir h SER 407 Cb 1.04 -0.12 -0.04 0.00 -0.31 0.00 0.00 62.40 62.97 2gir h SER 407 CO 1.14 0.35 0.57 4.11 -0.87 0.00 0.00 176.83 182.12 2gir h TRP 408 N 0.60 1.16 -0.20 4.77 5.08 -1.90 -0.21 115.95 125.25 2gir h TRP 408 Ca 0.24 0.01 -0.10 0.00 1.08 0.00 0.00 58.89 60.12 2gir h TRP 408 Cb 0.19 -0.39 -0.00 0.00 -3.00 0.00 0.00 29.16 25.96 2gir h TRP 408 CO -0.00 0.75 -0.28 1.25 -1.28 0.00 0.00 178.44 178.88 2gir h LEU 409 N 1.23 0.59 -0.82 0.11 5.85 -1.70 -1.17 115.31 119.40 2gir h LEU 409 Ca 0.33 -0.51 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 2gir h LEU 409 Cb -0.10 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.73 2gir h LEU 409 CO -0.07 0.99 0.45 1.23 -0.34 0.00 0.00 178.44 180.70 2gir h GLY 410 N 0.21 1.23 1.28 3.75 0.00 -1.19 -1.97 103.07 106.37 2gir h GLY 410 Ca 0.02 -0.56 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 2gir h GLY 410 CO 0.07 0.53 -0.20 3.43 0.00 0.00 0.00 176.54 180.37 2gir h ASN 411 N 1.14 0.84 -0.64 0.19 2.35 -0.94 0.16 115.58 118.69 2gir h ASN 411 Ca 0.29 -0.30 -0.03 0.00 -0.55 0.00 0.00 56.30 55.71 2gir h ASN 411 Cb 0.03 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 2gir h ASN 411 CO -0.05 1.02 0.30 0.40 -1.65 0.00 0.00 177.43 177.45 2gir h ILE 412 N 0.73 1.22 0.13 2.81 2.04 -1.00 0.25 117.51 123.69 2gir h ILE 412 Ca 0.10 -0.64 -0.01 0.00 1.00 0.00 0.00 64.86 65.31 2gir h ILE 412 Cb 0.73 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 2gir h ILE 412 CO 0.06 0.26 -0.06 0.40 0.00 0.00 0.00 178.15 178.81 2gir h ILE 413 N 0.88 0.99 0.00 -0.67 2.04 -1.06 -0.93 117.51 118.76 2gir h ILE 413 Ca 0.22 -0.51 -0.14 0.00 1.00 0.00 0.00 64.86 65.42 2gir h ILE 413 Cb 0.14 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 2gir h ILE 413 CO -0.03 0.12 -0.67 0.24 0.00 0.00 0.00 178.15 177.82 2gir h MET 414 N -0.42 0.00 -0.13 2.37 2.86 -0.92 -3.30 114.93 115.39 2gir h MET 414 Ca -0.02 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.52 2gir h MET 414 Cb 0.34 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 31.90 2gir h MET 414 CO 0.03 0.67 -0.59 0.66 1.06 0.00 0.00 176.91 178.75 2gir n TYR 415 N -3.59 0.48 -0.34 -0.22 4.01 0.87 -4.85 117.16 113.52 2gir n TYR 415 Ca -0.00 -1.58 0.11 0.00 -0.16 0.00 0.00 57.90 56.26 2gir n TYR 415 Cb 0.69 -0.26 0.30 0.00 -0.31 0.00 0.00 39.34 39.77 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 1.22 1.65 0.00 -0.72 0.00 -1.25 -1.41 119.26 118.74 2gir h ALA 416 Ca 0.05 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2gir h ALA 416 Cb 1.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2gir h ALA 416 CO 0.14 0.05 0.00 -2.30 0.00 0.00 0.00 179.25 177.13 2gir n PRO 417 N -4.67 0.03 -2.43 0.00 -0.02 -1.26 -4.53 135.00 122.12 2gir n PRO 417 Ca 0.21 0.26 -0.33 0.00 -2.02 0.00 0.00 63.50 61.61 2gir n PRO 417 Cb 0.47 -1.56 -0.03 0.00 -0.02 0.00 0.00 33.50 32.37 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 -3.05 3.93 0.18 3.45 -4.23 -0.53 -4.86 115.64 110.53 2gir s THR 418 Ca 0.07 1.10 -0.14 0.00 -1.18 0.00 0.00 61.69 61.54 2gir s THR 418 Cb 0.10 -3.48 0.10 0.00 1.34 0.00 0.00 72.50 70.57 2gir s THR 418 CO 0.31 -0.36 1.71 0.25 -0.54 0.00 0.00 174.62 175.98 2gir h LEU 419 N 1.24 -0.08 -0.05 4.79 5.85 -1.90 -2.54 115.31 122.62 2gir h LEU 419 Ca -0.48 0.09 -0.25 0.00 0.84 0.00 0.00 57.88 58.08 2gir h LEU 419 Cb 1.21 0.15 0.01 0.00 0.37 0.00 0.00 40.66 42.40 2gir h LEU 419 CO 0.59 -0.01 -1.05 4.11 -0.34 0.00 0.00 178.44 181.74 2gir h TRP 420 N 0.18 0.80 -0.28 1.25 5.08 -1.92 -0.53 115.95 120.52 2gir h TRP 420 Ca 0.23 -0.46 -0.11 0.00 1.08 0.00 0.00 58.89 59.63 2gir h TRP 420 Cb 0.33 -0.08 -0.01 0.00 -3.00 0.00 0.00 29.16 26.39 2gir h TRP 420 CO -0.25 1.29 -0.30 0.00 -1.28 0.00 0.00 178.44 177.90 2gir h ALA 421 N 0.55 0.95 0.00 0.11 0.00 -1.78 -2.46 119.26 116.63 2gir h ALA 421 Ca -0.12 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2gir h ALA 421 Cb 1.70 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2gir h ALA 421 CO 0.19 0.61 -0.00 0.00 0.00 0.00 0.00 179.25 180.05 2gir h ARG 422 N 0.51 0.00 -0.39 0.00 3.08 -1.42 -0.77 114.38 115.39 2gir h ARG 422 Ca 0.06 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.07 2gir h ARG 422 Cb 0.78 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.81 2gir h ARG 422 CO 0.06 0.91 0.07 1.98 -1.07 0.00 0.00 179.97 181.92 2gir h MET 423 N -0.90 0.64 0.00 0.04 4.05 -1.17 -3.33 114.93 114.25 2gir h MET 423 Ca -0.00 -0.17 -0.02 0.00 -0.28 0.00 0.00 59.70 59.23 2gir h MET 423 Cb 0.91 -0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 31.63 2gir h MET 423 CO 0.00 0.69 -0.87 -0.89 0.23 0.00 0.00 176.91 176.07 2gir n ILE 424 N -4.54 1.42 -0.07 1.77 5.41 -0.93 -4.24 119.36 118.18 2gir n ILE 424 Ca -0.01 0.17 -0.12 0.00 1.00 0.00 0.00 62.75 63.79 2gir n ILE 424 Cb 0.23 -2.15 -0.05 0.00 -0.71 0.00 0.00 39.64 36.95 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 -0.78 0.39 -0.42 1.39 3.38 -1.47 0.78 115.31 118.59 2gir h LEU 425 Ca -0.04 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 2gir h LEU 425 Cb 0.82 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 2gir h LEU 425 CO -0.02 0.62 0.16 0.24 0.09 0.00 0.00 178.44 179.53 2gir h MET 426 N 0.14 0.63 0.01 1.13 2.86 -1.28 -1.55 114.93 116.87 2gir h MET 426 Ca 0.06 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2gir h MET 426 Cb 0.43 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.99 2gir h MET 426 CO 0.01 0.59 -0.00 1.15 1.06 0.00 0.00 176.91 179.72 2gir h THR 427 N 0.53 1.16 0.32 2.22 2.02 -1.63 -2.16 112.91 115.37 2gir h THR 427 Ca 0.14 -0.50 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 2gir h THR 427 Cb 0.20 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.12 2gir h THR 427 CO -0.01 0.13 -0.15 -0.74 0.37 0.00 0.00 175.52 175.12 2gir h HIS 428 N -0.22 -0.39 -0.05 3.16 6.17 -0.79 -2.40 115.15 120.63 2gir h HIS 428 Ca -0.00 -0.01 -0.19 0.00 0.71 0.00 0.00 60.37 60.88 2gir h HIS 428 Cb 0.22 0.13 -0.01 0.00 2.52 0.00 0.00 27.41 30.27 2gir h HIS 428 CO -0.00 -0.20 -0.78 0.74 0.71 0.00 0.00 177.93 178.40 2gir h PHE 429 N -0.49 0.49 -0.37 5.26 0.04 -1.32 -2.32 116.94 118.23 2gir h PHE 429 Ca -0.04 -0.23 -0.09 0.00 2.80 0.00 0.00 57.97 60.41 2gir h PHE 429 Cb 0.37 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 2gir h PHE 429 CO -0.04 1.00 -0.13 0.74 -0.60 0.00 0.00 178.31 179.28 2gir h PHE 430 N 0.23 0.72 -0.22 -0.55 -1.00 -1.44 -0.20 116.94 114.48 2gir h PHE 430 Ca -0.04 -0.13 0.05 0.00 2.81 0.00 0.00 57.97 60.66 2gir h PHE 430 Cb 1.36 -0.19 -0.05 0.00 3.61 0.00 0.00 35.95 40.69 2gir h PHE 430 CO 0.04 0.76 -0.08 1.03 -1.61 0.00 0.00 178.31 178.45 2gir h SER 431 N 0.60 -0.29 -0.09 2.17 0.87 -1.24 0.27 113.55 115.84 2gir h SER 431 Ca 0.10 0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2gir h SER 431 Cb 0.57 0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.70 2gir h SER 431 CO 0.04 -0.11 0.05 0.40 -0.53 0.00 0.00 176.83 176.68 2gir h ILE 432 N -0.05 1.07 -0.83 2.23 2.04 -1.05 -2.03 117.51 118.89 2gir h ILE 432 Ca 0.11 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 2gir h ILE 432 Cb 0.22 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.31 2gir h ILE 432 CO -0.25 0.07 0.37 -0.07 0.00 0.00 0.00 178.15 178.27 2gir h LEU 433 N 0.07 1.10 -0.03 1.44 3.38 -0.70 -1.40 115.31 119.17 2gir h LEU 433 Ca 0.03 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.88 2gir h LEU 433 Cb 0.06 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 2gir h LEU 433 CO -0.01 0.95 -0.21 -0.07 0.09 0.00 0.00 178.44 179.19 2gir h LEU 434 N 1.19 -0.64 -1.42 1.67 3.38 -0.40 0.13 115.31 119.22 2gir h LEU 434 Ca 0.28 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.31 2gir h LEU 434 Cb 0.16 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2gir h LEU 434 CO -0.03 -0.28 0.05 0.00 0.09 0.00 0.00 178.44 178.27 2gir h ALA 435 N 0.57 1.53 -0.10 1.53 0.00 -0.88 -1.82 119.26 120.10 2gir h ALA 435 Ca 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2gir h ALA 435 Cb 0.42 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2gir h ALA 435 CO -0.22 0.35 0.00 1.04 0.00 0.00 0.00 179.25 180.42 2gir n GLN 436 N -4.35 2.16 -3.66 0.00 1.13 -0.57 -4.96 117.38 107.12 2gir n GLN 436 Ca 0.01 -1.70 -0.21 0.00 -1.94 0.00 0.00 57.00 53.16 2gir n GLN 436 Cb 0.19 -1.47 0.04 0.00 0.11 0.00 0.00 30.24 29.11 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 1.02 -5.38 -0.07 -1.09 1.02 -0.25 -4.93 120.64 110.96 2gir n GLU 437 Ca 0.16 0.67 0.09 0.00 -0.02 0.00 0.00 57.16 58.06 2gir n GLU 437 Cb 0.52 -5.36 0.13 0.00 -0.02 0.00 0.00 31.44 26.72 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 -4.30 1.42 -0.20 3.49 6.02 0.31 -4.75 117.38 119.36 2gir n GLN 438 Ca -0.26 -2.49 0.11 0.00 -0.01 0.00 0.00 57.00 54.35 2gir n GLN 438 Cb 0.66 -1.46 0.41 0.00 1.02 0.00 0.00 30.24 30.87 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 0.00 0.57 -0.35 1.08 -0.00 -1.92 -1.98 115.31 112.71 2gir h LEU 439 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.90 2gir h LEU 439 Cb 0.96 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 41.52 2gir h LEU 439 CO 0.00 0.33 -0.15 -1.84 -0.00 0.00 0.00 178.44 176.78 2gir n GLU 440 N -4.51 0.78 -2.83 1.13 0.00 -1.26 -3.66 120.64 110.30 2gir n GLU 440 Ca 0.14 -0.35 -0.42 0.00 0.00 0.00 0.00 57.16 56.53 2gir n GLU 440 Cb 0.39 -1.49 -0.04 0.00 0.00 0.00 0.00 31.44 30.30 2gir n GLU 440 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 2gir s LYS 441 N -2.46 4.24 0.28 3.44 2.20 -0.75 -4.95 119.74 121.75 2gir s LYS 441 Ca 0.28 1.07 -0.29 0.00 -0.36 0.00 0.00 55.97 56.67 2gir s LYS 441 Cb 0.20 -3.62 -0.10 0.00 -1.51 0.00 0.00 37.83 32.80 2gir s LYS 441 CO 0.48 -0.47 1.35 0.00 -0.36 0.00 0.00 175.35 176.35 2gir s ALA 442 N 2.67 3.55 0.11 3.13 0.00 -1.26 -4.41 121.76 125.54 2gir s ALA 442 Ca 0.38 1.25 0.07 0.00 0.00 0.00 0.00 51.96 53.67 2gir s ALA 442 Cb -0.16 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 2gir s ALA 442 CO 0.09 -0.65 -0.18 -0.51 0.00 0.00 0.00 175.76 174.51 2gir s LEU 443 N -0.98 2.34 0.15 0.00 1.43 0.12 -4.82 118.68 116.90 2gir s LEU 443 Ca 0.54 -0.72 -0.24 0.00 -1.03 0.00 0.00 54.13 52.67 2gir s LEU 443 Cb -0.40 -0.76 -0.08 0.00 0.03 0.00 0.00 46.19 44.98 2gir s LEU 443 CO 0.47 -0.01 0.74 -1.81 0.23 0.00 0.00 176.35 175.97 2gir s ASP 444 N -2.09 7.33 0.18 2.29 1.01 -1.26 0.38 116.67 124.51 2gir s ASP 444 Ca 0.07 1.57 -0.08 0.00 0.71 0.00 0.00 52.55 54.82 2gir s ASP 444 Cb -0.09 -2.47 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 2gir s ASP 444 CO 0.04 0.21 0.29 0.00 0.21 0.00 0.00 175.17 175.93 2gir s GLN 446 N -4.00 2.96 -0.15 0.00 -0.21 -1.26 -0.58 119.66 116.42 2gir s GLN 446 Ca 0.21 -0.73 -0.00 0.00 0.02 0.00 0.00 55.36 54.86 2gir s GLN 446 Cb 0.03 -2.46 0.03 0.00 1.00 0.00 0.00 33.01 31.61 2gir s GLN 446 CO 0.03 0.37 -0.08 0.42 -2.12 0.00 0.00 175.29 173.91 2gir s ILE 447 N -0.08 1.21 -1.51 1.08 1.01 0.06 -4.77 121.20 118.20 2gir s ILE 447 Ca -0.03 -0.53 -0.09 0.00 0.00 0.00 0.00 60.65 59.99 2gir s ILE 447 Cb -0.14 -1.27 0.07 0.00 0.01 0.00 0.00 42.46 41.13 2gir s ILE 447 CO 0.04 0.29 0.75 -1.22 0.00 0.00 0.00 174.94 174.79 2gir n TYR 448 N 4.86 -1.93 0.00 3.97 4.01 -1.26 -2.36 117.16 124.46 2gir n TYR 448 Ca -0.13 0.83 0.00 0.00 -0.16 0.00 0.00 57.90 58.44 2gir n TYR 448 Cb 0.49 -3.72 0.00 0.00 -0.31 0.00 0.00 39.34 35.80 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 3.13 3.86 2.72 0.00 -1.26 -0.88 105.19 111.08 2gir n GLY 449 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.54 3.45 -0.16 4.61 0.00 -0.99 -4.41 121.76 122.72 2gir s ALA 450 Ca 0.00 -0.14 -0.13 0.00 0.00 0.00 0.00 51.96 51.70 2gir s ALA 450 Cb 0.00 -2.59 -0.05 0.00 0.00 0.00 0.00 23.12 20.48 2gir s ALA 450 CO 0.00 0.41 0.26 0.00 0.00 0.00 0.00 175.76 176.43 2gir s TYR 452 N 0.27 1.72 -0.25 0.00 1.51 0.25 0.80 117.35 121.65 2gir s TYR 452 Ca 0.15 -0.35 -0.16 0.00 -1.01 0.00 0.00 57.07 55.70 2gir s TYR 452 Cb -0.13 -1.05 -0.04 0.00 -0.11 0.00 0.00 41.96 40.64 2gir s TYR 452 CO 0.03 0.05 0.40 0.45 -1.11 0.00 0.00 175.55 175.37 2gir s SER 453 N -0.94 6.34 -0.04 2.29 0.15 -1.26 -1.35 113.70 118.90 2gir s SER 453 Ca 0.07 0.39 0.02 0.00 0.70 0.00 0.00 55.95 57.13 2gir s SER 453 Cb -0.08 -2.23 0.01 0.00 -1.71 0.00 0.00 66.02 62.01 2gir s SER 453 CO 0.01 -0.16 -0.08 -0.63 1.20 0.00 0.00 173.24 173.58 2gir s ILE 454 N 1.83 0.77 -0.24 6.45 1.01 0.16 -4.86 121.20 126.31 2gir s ILE 454 Ca 0.17 -0.31 -0.23 0.00 0.00 0.00 0.00 60.65 60.27 2gir s ILE 454 Cb -0.15 -0.72 -0.01 0.00 0.01 0.00 0.00 42.46 41.59 2gir s ILE 454 CO 0.09 0.26 0.77 -1.61 0.00 0.00 0.00 174.94 174.45 2gir s GLU 455 N 0.48 4.17 0.48 2.79 2.02 -1.26 0.12 118.70 127.50 2gir s GLU 455 Ca -0.08 0.83 0.27 0.00 0.02 0.00 0.00 54.97 56.01 2gir s GLU 455 Cb -0.12 -3.64 1.33 0.00 0.10 0.00 0.00 34.13 31.80 2gir s GLU 455 CO 0.01 -0.48 1.84 -1.35 0.02 0.00 0.00 175.26 175.30 2gir h PRO 456 N 7.73 0.17 0.00 0.39 0.11 -1.77 -0.15 132.00 138.47 2gir h PRO 456 Ca -0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2gir h PRO 456 Cb 1.10 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2gir h PRO 456 CO 0.84 0.11 0.00 -0.07 -0.21 0.00 0.00 178.00 178.67 2gir h LEU 457 N 0.17 0.00 -0.58 2.35 3.38 -1.93 -1.41 115.31 117.28 2gir h LEU 457 Ca 0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.47 2gir h LEU 457 Cb 1.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.41 2gir h LEU 457 CO -0.11 0.00 -0.05 0.47 0.09 0.00 0.00 178.44 178.85 2gir n ASP 458 N -2.86 0.96 -0.29 -0.43 8.00 -0.07 -4.47 116.55 117.39 2gir n ASP 458 Ca -0.01 -1.17 0.01 0.00 0.71 0.00 0.00 54.79 54.33 2gir n ASP 458 Cb 0.15 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 41.39 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 1.42 0.73 -0.91 0.64 3.38 -1.38 -1.25 115.31 117.95 2gir h LEU 459 Ca 0.00 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.02 2gir h LEU 459 Cb 0.37 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 2gir h LEU 459 CO 0.00 0.45 0.60 -0.65 0.09 0.00 0.00 178.44 178.93 2gir h PRO 460 N 0.86 1.16 -0.13 1.13 0.11 -1.82 0.15 132.00 133.44 2gir h PRO 460 Ca 0.37 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.40 2gir h PRO 460 Cb 0.24 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 2gir h PRO 460 CO -0.20 0.77 0.04 1.96 -0.21 0.00 0.00 178.00 180.36 2gir h GLN 461 N 1.19 0.21 -0.41 1.05 7.50 -1.74 0.09 115.11 122.99 2gir h GLN 461 Ca 0.34 -0.04 0.02 0.00 0.50 0.00 0.00 58.65 59.47 2gir h GLN 461 Cb -0.08 -0.03 -0.03 0.00 0.05 0.00 0.00 27.48 27.39 2gir h GLN 461 CO -0.09 0.33 0.25 0.82 -1.50 0.00 0.00 178.83 178.64 2gir h ILE 462 N 0.04 1.05 -0.37 2.54 2.04 -0.97 -1.58 117.51 120.26 2gir h ILE 462 Ca 0.04 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 2gir h ILE 462 Cb 0.21 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2gir h ILE 462 CO -0.00 0.09 0.06 0.40 0.00 0.00 0.00 178.15 178.70 2gir h ILE 463 N 0.50 1.24 -0.62 -0.67 2.04 -0.60 -0.99 117.51 118.41 2gir h ILE 463 Ca 0.16 -0.84 0.05 0.00 1.00 0.00 0.00 64.86 65.23 2gir h ILE 463 Cb -0.01 1.07 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 2gir h ILE 463 CO -0.07 0.29 0.35 -0.08 0.00 0.00 0.00 178.15 178.63 2gir h GLU 464 N 0.46 0.64 -0.25 2.37 4.81 -0.80 0.15 114.58 121.96 2gir h GLU 464 Ca 0.11 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.26 2gir h GLU 464 Cb 0.36 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 2gir h GLU 464 CO 0.01 0.42 -0.03 0.00 -0.73 0.00 0.00 179.01 178.67 2gir h ARG 465 N 0.65 0.46 -0.22 1.92 3.08 -1.02 0.47 114.38 119.72 2gir h ARG 465 Ca 0.27 -0.16 -0.21 0.00 0.07 0.00 0.00 59.98 59.95 2gir h ARG 465 Cb 0.14 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.16 2gir h ARG 465 CO -0.16 0.66 -0.67 -0.07 -1.07 0.00 0.00 179.97 178.67 2gir h LEU 466 N 0.21 0.97 0.00 3.04 3.38 -1.04 -3.39 115.31 118.48 2gir h LEU 466 Ca 0.07 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.46 2gir h LEU 466 Cb 0.48 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2gir h LEU 466 CO 0.02 1.38 -1.17 1.41 0.09 0.00 0.00 178.44 180.17 2gir n HIS 467 N -3.97 0.00 0.00 1.13 8.25 0.53 -4.28 115.22 116.87 2gir n HIS 467 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 2gir n HIS 467 Cb 0.69 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.71 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 2.24 -1.20 0.31 -1.41 0.00 0.17 -4.51 105.19 100.78 2gir n GLY 468 Ca -0.01 -1.61 0.18 0.00 0.00 0.00 0.00 46.02 44.58 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 -1.85 0.99 3.38 -1.88 -2.72 115.31 113.23 2gir h LEU 469 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 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 0.02 0.20 0.77 0.09 0.00 0.00 178.44 179.52 2gir h SER 470 N 0.00 0.17 -0.75 -0.43 4.64 -1.96 -1.65 113.55 113.57 2gir h SER 470 Ca -0.00 -0.00 0.19 0.00 -0.47 0.00 0.00 61.79 61.51 2gir h SER 470 Cb 0.11 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 62.13 2gir h SER 470 CO 0.00 0.11 0.52 0.00 -0.87 0.00 0.00 176.83 176.60 2gir h ALA 471 N 1.84 2.48 -0.05 5.18 0.00 -1.71 -0.33 119.26 126.68 2gir h ALA 471 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2gir h ALA 471 Cb 0.27 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2gir h ALA 471 CO -0.02 -0.70 0.00 1.19 0.00 0.00 0.00 179.25 179.72 2gir n PHE 472 N -4.39 0.05 -0.59 0.00 3.72 -0.62 -4.18 117.46 111.45 2gir n PHE 472 Ca 0.15 -0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 2gir n PHE 472 Cb 0.72 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.26 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 -0.07 0.45 -4.77 4.37 7.64 -0.18 -4.55 113.62 116.52 2gir n SER 473 Ca 0.19 -1.04 -0.40 0.00 1.01 0.00 0.00 58.87 58.62 2gir n SER 473 Cb 0.29 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 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 -0.04 4.24 0.00 -3.43 1.43 -0.91 -3.71 118.68 116.25 2gir s LEU 474 Ca 0.00 2.84 -0.12 0.00 -1.03 0.00 0.00 54.13 55.82 2gir s LEU 474 Cb 0.00 -3.82 0.05 0.00 0.03 0.00 0.00 46.19 42.45 2gir s LEU 474 CO 0.00 -0.91 0.64 0.00 0.23 0.00 0.00 176.35 176.31 2gir n HIS 475 N 0.21 -1.96 -3.83 0.29 1.44 -0.14 -4.96 115.22 106.26 2gir n HIS 475 Ca 0.03 -1.39 -0.37 0.00 -2.01 0.00 0.00 57.72 53.98 2gir n HIS 475 Cb 0.42 0.69 0.03 0.00 0.12 0.00 0.00 29.99 31.25 2gir n HIS 475 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 2gir n SER 476 N -1.38 -4.78 -4.64 4.39 7.64 -1.26 -0.94 113.62 112.65 2gir n SER 476 Ca -0.06 -1.12 -0.29 0.00 1.01 0.00 0.00 58.87 58.41 2gir n SER 476 Cb 0.46 -2.74 0.19 0.00 -1.01 0.00 0.00 64.21 61.11 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 -3.50 1.95 0.53 1.43 1.51 -1.26 -4.03 117.35 113.97 2gir s TYR 477 Ca 0.47 1.03 -0.17 0.00 -1.01 0.00 0.00 57.07 57.40 2gir s TYR 477 Cb -0.20 -3.23 -0.07 0.00 -0.11 0.00 0.00 41.96 38.35 2gir s TYR 477 CO 0.90 -3.09 1.00 -1.54 -1.11 0.00 0.00 175.55 171.71 2gir s SER 478 N -3.27 6.44 0.28 2.29 1.04 -1.20 -4.85 113.70 114.42 2gir s SER 478 Ca 0.66 1.65 -0.01 0.00 0.48 0.00 0.00 55.95 58.73 2gir s SER 478 Cb -0.20 -2.52 0.46 0.00 0.10 0.00 0.00 66.02 63.86 2gir s SER 478 CO 0.59 -0.72 1.88 -0.65 0.98 0.00 0.00 173.24 175.33 2gir h PRO 479 N 0.90 1.09 -0.64 4.02 0.11 -1.94 0.50 132.00 136.04 2gir h PRO 479 Ca -0.47 -0.07 0.02 0.00 0.11 0.00 0.00 66.00 65.59 2gir h PRO 479 Cb 1.19 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 32.02 2gir h PRO 479 CO 0.60 0.72 0.40 0.78 -0.21 0.00 0.00 178.00 180.30 2gir h GLY 480 N 1.12 0.91 0.88 -0.55 0.00 -1.99 0.32 103.07 103.77 2gir h GLY 480 Ca 0.44 -0.31 -0.13 0.00 0.00 0.00 0.00 47.33 47.33 2gir h GLY 480 CO -0.18 0.28 -0.40 -2.09 0.00 0.00 0.00 176.54 174.15 2gir h GLU 481 N 0.80 0.55 -0.14 4.80 4.57 -1.78 -2.24 114.58 121.14 2gir h GLU 481 Ca 0.25 -0.38 0.02 0.00 -1.18 0.00 0.00 59.36 58.07 2gir h GLU 481 Cb -0.02 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 2gir h GLU 481 CO -0.09 1.00 0.01 0.82 -1.18 0.00 0.00 179.01 179.57 2gir h ILE 482 N 0.19 0.92 -0.34 2.32 2.04 -0.75 -0.79 117.51 121.11 2gir h ILE 482 Ca -0.00 -0.02 0.04 0.00 1.00 0.00 0.00 64.86 65.88 2gir h ILE 482 Cb 1.01 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.90 2gir h ILE 482 CO 0.09 0.01 0.09 -1.13 0.00 0.00 0.00 178.15 177.21 2gir h ASN 483 N 0.07 0.08 -0.56 1.72 -0.73 -0.95 -0.59 115.58 114.61 2gir h ASN 483 Ca 0.06 0.04 -0.11 0.00 1.87 0.00 0.00 56.30 58.17 2gir h ASN 483 Cb 0.07 0.05 -0.02 0.00 0.27 0.00 0.00 38.32 38.68 2gir h ASN 483 CO -0.10 0.08 -0.07 -0.09 -0.37 0.00 0.00 177.43 176.88 2gir h ARG 484 N 0.23 1.05 -0.06 6.67 2.43 -1.01 0.70 114.38 124.38 2gir h ARG 484 Ca 0.16 -0.37 -0.02 0.00 -0.81 0.00 0.00 59.98 58.94 2gir h ARG 484 Cb 0.15 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2gir h ARG 484 CO -0.18 1.06 -0.02 0.28 -1.51 0.00 0.00 179.97 179.60 2gir h VAL 485 N 0.94 1.30 -0.75 0.20 2.07 -1.00 -1.46 116.25 117.55 2gir h VAL 485 Ca 0.15 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.72 2gir h VAL 485 Cb 0.63 1.82 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 2gir h VAL 485 CO 0.04 0.26 0.49 0.00 0.02 0.00 0.00 177.57 178.39 2gir h ALA 486 N 0.65 0.95 -0.35 1.67 0.00 -0.93 -0.10 119.26 121.15 2gir h ALA 486 Ca 0.02 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 2gir h ALA 486 Cb 0.43 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2gir h ALA 486 CO 0.01 0.35 -0.17 0.66 0.00 0.00 0.00 179.25 180.09 2gir h SER 487 N 1.00 0.65 -0.43 0.00 4.64 -0.88 -1.53 113.55 116.99 2gir h SER 487 Ca 0.28 -0.20 0.01 0.00 -0.47 0.00 0.00 61.79 61.40 2gir h SER 487 Cb -0.09 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 61.80 2gir h SER 487 CO -0.07 0.83 0.27 0.00 -0.87 0.00 0.00 176.83 177.00 2gir h LEU 489 N 0.56 1.01 -0.91 0.00 3.38 -0.72 -1.33 115.31 117.30 2gir h LEU 489 Ca 0.16 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 2gir h LEU 489 Cb -0.05 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 2gir h LEU 489 CO -0.05 0.93 0.19 0.03 0.09 0.00 0.00 178.44 179.63 2gir h ARG 490 N 1.03 0.99 -0.20 1.13 3.08 -1.12 0.18 114.38 119.48 2gir h ARG 490 Ca 0.23 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 2gir h ARG 490 Cb 0.25 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2gir h ARG 490 CO -0.01 0.86 0.08 -0.22 -1.07 0.00 0.00 179.97 179.61 2gir h LYS 491 N 0.95 0.30 0.00 0.04 3.64 -0.25 -3.02 116.57 118.23 2gir h LYS 491 Ca 0.21 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2gir h LYS 491 Cb 0.29 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2gir h LYS 491 CO -0.01 0.35 -0.43 1.28 -2.27 0.00 0.00 179.45 178.38 2gir n LEU 492 N -4.84 0.56 -1.91 5.20 4.32 -0.57 -4.85 117.00 114.91 2gir n LEU 492 Ca -0.04 0.24 -0.09 0.00 -0.02 0.00 0.00 56.01 56.11 2gir n LEU 492 Cb 0.12 -0.26 0.04 0.00 -1.62 0.00 0.00 43.42 41.69 2gir n LEU 492 CO 0.35 -0.01 0.08 0.61 -1.22 0.00 0.00 177.39 177.19 2gir n GLY 493 N 1.40 0.22 3.79 -0.72 0.00 0.42 -1.69 105.19 108.62 2gir n GLY 493 Ca 0.05 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.14 4.74 0.80 1.61 1.01 0.05 -1.17 120.40 124.30 2gir s VAL 494 Ca 0.13 1.31 -0.14 0.00 0.00 0.00 0.00 61.98 63.28 2gir s VAL 494 Cb -0.06 -3.95 0.08 0.00 0.00 0.00 0.00 36.38 32.45 2gir s VAL 494 CO 0.31 0.50 1.20 -2.65 0.00 0.00 0.00 175.10 174.46 2gir n PRO 495 N 2.04 0.23 -1.70 2.72 -0.02 -1.26 -4.72 135.00 132.29 2gir n PRO 495 Ca -0.08 0.15 -0.30 0.00 -2.02 0.00 0.00 63.50 61.25 2gir n PRO 495 Cb 0.50 -2.44 0.17 0.00 -0.02 0.00 0.00 33.50 31.72 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 -4.07 0.61 0.29 0.52 0.04 -1.26 -4.82 135.00 126.31 2gir s PRO 496 Ca 0.74 -0.13 0.04 0.00 0.04 0.00 0.00 61.00 61.69 2gir s PRO 496 Cb -0.30 -1.82 0.70 0.00 0.04 0.00 0.00 34.50 33.13 2gir s PRO 496 CO 0.50 -2.48 1.76 1.25 0.04 0.00 0.00 177.00 178.07 2gir h LEU 497 N -1.69 0.67 -0.67 -3.56 5.85 -1.99 -1.45 115.31 112.46 2gir h LEU 497 Ca -0.46 0.11 0.12 0.00 0.84 0.00 0.00 57.88 58.48 2gir h LEU 497 Cb 1.28 -0.01 -0.08 0.00 0.37 0.00 0.00 40.66 42.22 2gir h LEU 497 CO 0.46 0.22 0.24 -0.09 -0.34 0.00 0.00 178.44 178.94 2gir h ARG 498 N 0.68 0.40 -0.06 1.25 2.43 -1.99 0.31 114.38 117.39 2gir h ARG 498 Ca 0.56 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.68 2gir h ARG 498 Cb 0.88 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.34 2gir h ARG 498 CO -0.40 0.26 -0.03 0.28 -1.51 0.00 0.00 179.97 178.57 2gir h VAL 499 N 0.41 1.34 -0.51 0.20 2.07 -1.63 -2.77 116.25 115.36 2gir h VAL 499 Ca 0.35 -1.08 -0.04 0.00 0.82 0.00 0.00 66.70 66.76 2gir h VAL 499 Cb 0.49 1.94 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 2gir h VAL 499 CO -0.36 0.30 0.16 -0.50 0.02 0.00 0.00 177.57 177.19 2gir h TRP 500 N -0.27 0.76 -0.39 1.57 4.06 -1.08 -1.86 115.95 118.74 2gir h TRP 500 Ca 0.01 -0.05 -0.01 0.00 2.06 0.00 0.00 58.89 60.90 2gir h TRP 500 Cb 0.49 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.40 2gir h TRP 500 CO 0.07 0.62 0.19 -0.09 -3.56 0.00 0.00 178.44 175.67 2gir h ARG 501 N 0.73 0.56 -0.51 0.49 2.43 -0.43 0.65 114.38 118.31 2gir h ARG 501 Ca 0.17 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2gir h ARG 501 Cb 0.21 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 2gir h ARG 501 CO -0.01 0.49 0.30 0.45 -1.51 0.00 0.00 179.97 179.70 2gir h HIS 502 N 0.49 0.67 -0.78 2.20 3.86 -1.18 -1.28 115.15 119.12 2gir h HIS 502 Ca 0.13 -0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.29 2gir h HIS 502 Cb 0.12 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.33 2gir h HIS 502 CO -0.01 0.47 0.29 0.00 0.86 0.00 0.00 177.93 179.53 2gir h ARG 503 N 0.68 1.19 -0.52 2.45 3.08 -1.14 -2.10 114.38 118.01 2gir h ARG 503 Ca 0.18 -0.23 -0.10 0.00 0.07 0.00 0.00 59.98 59.90 2gir h ARG 503 Cb -0.01 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 2gir h ARG 503 CO -0.03 0.98 -0.08 0.00 -1.07 0.00 0.00 179.97 179.76 2gir h ALA 504 N 1.16 0.87 -0.50 0.04 0.00 -0.53 0.88 119.26 121.18 2gir h ALA 504 Ca 0.26 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2gir h ALA 504 Cb 0.25 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2gir h ALA 504 CO -0.02 0.65 0.06 0.00 0.00 0.00 0.00 179.25 179.94 2gir h ARG 505 N 0.85 0.80 0.08 0.00 3.08 -1.02 0.18 114.38 118.35 2gir h ARG 505 Ca 0.14 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2gir h ARG 505 Cb 0.61 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2gir h ARG 505 CO 0.04 0.77 -0.04 1.03 -1.07 0.00 0.00 179.97 180.70 2gir h SER 506 N 0.76 -0.09 -0.37 7.04 0.87 -0.87 -1.04 113.55 119.86 2gir h SER 506 Ca 0.16 -0.23 0.01 0.00 -1.23 0.00 0.00 61.79 60.50 2gir h SER 506 Cb 0.37 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 2gir h SER 506 CO 0.01 0.19 0.22 0.58 -0.53 0.00 0.00 176.83 177.30 2gir h VAL 507 N -0.37 1.05 -0.32 2.23 2.07 -0.72 -1.38 116.25 118.81 2gir h VAL 507 Ca -0.01 -0.15 0.04 0.00 0.82 0.00 0.00 66.70 67.40 2gir h VAL 507 Cb 0.32 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 2gir h VAL 507 CO 0.02 0.08 0.07 -0.09 0.02 0.00 0.00 177.57 177.67 2gir h ARG 508 N 0.45 0.19 -0.48 1.57 2.43 -0.59 -0.53 114.38 117.42 2gir h ARG 508 Ca 0.15 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 2gir h ARG 508 Cb -0.00 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2gir h ARG 508 CO -0.06 0.12 0.26 0.00 -1.51 0.00 0.00 179.97 178.78 2gir h ALA 509 N 1.23 0.62 -0.43 2.80 0.00 -0.88 -0.53 119.26 122.07 2gir h ALA 509 Ca 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2gir h ALA 509 Cb 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2gir h ALA 509 CO -0.19 0.15 0.27 0.00 0.00 0.00 0.00 179.25 179.48 2gir h ARG 510 N 0.64 0.58 -0.68 0.00 -0.00 -0.91 -2.75 114.38 111.25 2gir h ARG 510 Ca 0.17 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.98 59.59 2gir h ARG 510 Cb 0.06 -0.13 -0.03 0.00 0.00 0.00 0.00 29.97 29.88 2gir h ARG 510 CO -0.03 0.41 0.36 -0.07 0.00 0.00 0.00 179.97 180.64 2gir h LEU 511 N 0.58 0.87 -1.44 3.04 3.38 -0.79 -2.80 115.31 118.15 2gir h LEU 511 Ca 0.16 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2gir h LEU 511 Cb -0.04 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 2gir h LEU 511 CO -0.03 0.73 0.35 -0.07 0.09 0.00 0.00 178.44 179.51 2gir h LEU 512 N 0.94 0.63 -1.26 1.67 3.38 -0.94 -2.19 115.31 117.55 2gir h LEU 512 Ca 0.24 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 2gir h LEU 512 Cb 0.07 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2gir h LEU 512 CO -0.04 0.47 -0.30 0.28 0.09 0.00 0.00 178.44 178.95 2gir h SER 513 N 0.74 0.00 1.36 -0.43 0.02 -1.22 -2.67 113.55 111.35 2gir h SER 513 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 2gir h SER 513 Cb -0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.48 2gir h SER 513 CO -0.04 0.30 0.00 0.00 -1.14 0.00 0.00 176.83 175.95 2gir n GLN 514 N -3.65 0.24 0.00 3.45 6.02 -0.83 -5.03 117.38 117.58 2gir n GLN 514 Ca -0.01 0.24 0.00 0.00 -0.01 0.00 0.00 57.00 57.22 2gir n GLN 514 Cb 0.41 -1.81 0.00 0.00 1.02 0.00 0.00 30.24 29.87 2gir n GLN 514 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2gir n GLY 515 N 1.13 -1.29 7.00 1.08 0.00 -1.01 -4.82 105.19 107.28 2gir n GLY 515 Ca 0.05 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.91 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 0.00 2.49 0.24 -0.02 0.00 -1.26 -1.21 105.19 105.43 2gir n GLY 516 Ca 0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 46.02 45.71 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 0.39 -0.90 1.61 3.08 -1.91 -2.52 114.38 114.12 2gir h ARG 517 Ca 0.00 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 2gir h ARG 517 Cb 0.00 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 2gir h ARG 517 CO 0.00 0.56 0.49 0.00 -1.07 0.00 0.00 179.97 179.95 2gir h ALA 518 N 1.47 1.16 -0.54 0.04 0.00 -1.75 -0.81 119.26 118.82 2gir h ALA 518 Ca 0.06 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2gir h ALA 518 Cb 0.52 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2gir h ALA 518 CO 0.03 0.67 -0.00 0.00 0.00 0.00 0.00 179.25 179.95 2gir h ALA 519 N 1.27 0.97 -0.51 0.00 0.00 -0.75 -1.70 119.26 118.55 2gir h ALA 519 Ca 0.32 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2gir h ALA 519 Cb 0.03 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2gir h ALA 519 CO -0.05 0.62 0.34 1.15 0.00 0.00 0.00 179.25 181.31 2gir h THR 520 N 0.86 1.13 -0.25 0.00 2.02 -1.08 0.63 112.91 116.21 2gir h THR 520 Ca 0.16 -0.25 0.05 0.00 0.77 0.00 0.00 66.41 67.15 2gir h THR 520 Cb 0.51 0.38 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 2gir h THR 520 CO 0.02 0.13 -0.09 0.00 0.37 0.00 0.00 175.52 175.95 2gir h GLY 522 N -0.05 0.13 0.86 0.00 0.00 -0.78 0.06 103.07 103.29 2gir h GLY 522 Ca 0.13 0.06 -0.02 0.00 0.00 0.00 0.00 47.33 47.50 2gir h GLY 522 CO -0.29 -0.06 0.06 0.50 0.00 0.00 0.00 176.54 176.75 2gir h LYS 523 N 0.00 0.29 0.05 4.80 1.57 -0.54 -3.04 116.57 119.70 2gir h LYS 523 Ca 0.08 -0.06 -0.18 0.00 -1.87 0.00 0.00 60.65 58.62 2gir h LYS 523 Cb 0.13 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2gir h LYS 523 CO -0.18 0.40 -0.96 1.88 -0.57 0.00 0.00 179.45 180.02 2gir h TYR 524 N 0.13 0.19 -0.04 -1.35 -1.99 -1.07 -3.15 116.97 109.69 2gir h TYR 524 Ca 0.06 -0.14 -0.12 0.00 2.00 0.00 0.00 58.73 60.53 2gir h TYR 524 Cb 0.23 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.94 2gir h TYR 524 CO 0.00 1.37 -0.54 -0.07 -0.00 0.00 0.00 178.16 178.93 2gir h LEU 525 N -0.71 0.11 -3.04 3.88 3.38 -1.11 -3.30 115.31 114.52 2gir h LEU 525 Ca -0.23 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2gir h LEU 525 Cb 1.41 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2gir h LEU 525 CO -0.04 0.63 0.00 0.49 0.09 0.00 0.00 178.44 179.61 2gir n PHE 526 N -3.91 0.16 0.17 1.13 3.72 -1.15 -4.63 117.46 112.95 2gir n PHE 526 Ca -0.02 -0.90 0.07 0.00 -0.05 0.00 0.00 57.45 56.55 2gir n PHE 526 Cb 0.56 -0.16 0.57 0.00 -0.94 0.00 0.00 39.48 39.51 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 0.33 0.15 0.01 4.37 -0.00 -1.63 -1.89 115.58 116.93 2gir h ASN 527 Ca 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.30 2gir h ASN 527 Cb 1.00 -0.04 -0.00 0.00 -0.00 0.00 0.00 38.32 39.28 2gir h ASN 527 CO 0.03 0.11 -0.00 4.11 -0.00 0.00 0.00 177.43 181.68 2gir h TRP 528 N 0.18 0.00 -0.01 0.67 5.08 -1.82 -3.03 115.95 117.02 2gir h TRP 528 Ca 0.06 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.03 2gir h TRP 528 Cb 0.02 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.18 2gir h TRP 528 CO -0.00 0.00 -0.32 0.00 -1.28 0.00 0.00 178.44 176.84 2gir n ALA 529 N -2.21 3.22 -2.90 0.11 0.00 -0.71 -4.92 120.51 113.11 2gir n ALA 529 Ca -0.03 -0.50 -0.25 0.00 0.00 0.00 0.00 53.44 52.66 2gir n ALA 529 Cb 0.08 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.49 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 -2.46 5.02 -0.07 0.00 -7.23 -1.15 -4.76 120.40 109.75 2gir s VAL 530 Ca 0.23 -0.90 -0.26 0.00 -1.81 0.00 0.00 61.98 59.24 2gir s VAL 530 Cb 0.19 -3.62 -0.24 0.00 0.56 0.00 0.00 36.38 33.27 2gir s VAL 530 CO 0.53 -0.16 0.97 0.07 -0.31 0.00 0.00 175.10 176.20 2gir h LYS 531 N 1.99 0.12 -4.37 4.82 2.10 -1.91 -3.39 116.57 115.93 2gir h LYS 531 Ca -0.49 -0.14 -0.74 0.00 -2.00 0.00 0.00 60.65 57.29 2gir h LYS 531 Cb 1.21 0.04 -0.22 0.00 -0.90 0.00 0.00 32.23 32.36 2gir h LYS 531 CO 0.65 0.92 0.11 -0.08 -2.00 0.00 0.00 179.45 179.06 2gir s THR 532 N -2.94 5.10 0.51 0.07 -1.32 -1.26 -5.04 115.64 110.76 2gir s THR 532 Ca -0.17 -1.56 -0.20 0.00 -1.21 0.00 0.00 61.69 58.55 2gir s THR 532 Cb -0.00 -4.48 -0.07 0.00 -1.51 0.00 0.00 72.50 66.44 2gir s THR 532 CO 0.73 -1.09 1.11 -0.54 -2.21 0.00 0.00 174.62 172.62 2gir s LYS 533 N 1.79 3.57 0.40 7.08 3.01 -1.26 -5.04 119.74 129.28 2gir s LYS 533 Ca 0.14 1.56 -0.23 0.00 -1.01 0.00 0.00 55.97 56.42 2gir s LYS 533 Cb -0.20 -2.11 -0.09 0.00 -1.01 0.00 0.00 37.83 34.42 2gir s LYS 533 CO -0.00 -0.66 1.02 -0.51 0.51 0.00 0.00 175.35 175.70 2gir s LEU 534 N -3.56 4.10 -0.52 3.17 1.02 -1.26 -5.01 118.68 116.62 2gir s LEU 534 Ca 0.69 1.95 -0.28 0.00 0.02 0.00 0.00 54.13 56.51 2gir s LEU 534 Cb -0.22 -4.26 0.01 0.00 0.02 0.00 0.00 46.19 41.74 2gir s LEU 534 CO 0.26 -0.45 1.39 -1.59 0.02 0.00 0.00 176.35 175.98 2gir s LYS 535 N -2.62 3.40 -0.15 1.70 -2.85 -1.26 -5.00 119.74 112.97 2gir s LYS 535 Ca 0.58 0.57 -0.29 0.00 -1.00 0.00 0.00 55.97 55.83 2gir s LYS 535 Cb -0.19 -4.08 -0.01 0.00 -2.06 0.00 0.00 37.83 31.49 2gir s LYS 535 CO 0.24 -1.80 1.14 -0.51 0.10 0.00 0.00 175.35 174.52 2gir s LEU 536 N 5.76 4.19 0.29 2.77 1.02 -1.26 -5.02 118.68 126.43 2gir s LEU 536 Ca 0.54 1.60 0.07 0.00 0.02 0.00 0.00 54.13 56.36 2gir s LEU 536 Cb -0.11 -3.55 -0.03 0.00 0.02 0.00 0.00 46.19 42.52 2gir s LEU 536 CO 0.27 -0.64 0.24 0.42 0.02 0.00 0.00 176.35 176.67 2gir s THR 537 N 2.87 3.99 0.25 5.49 -4.23 -1.26 -5.07 115.64 117.68 2gir s THR 537 Ca 0.51 -1.39 -0.31 0.00 -1.18 0.00 0.00 61.69 59.32 2gir s THR 537 Cb -0.20 -3.29 -0.13 0.00 1.34 0.00 0.00 72.50 70.22 2gir s THR 537 CO 0.14 -0.26 1.42 -2.65 -0.54 0.00 0.00 174.62 172.73 2gir n PRO 538 N -1.27 2.10 -2.65 3.99 -0.02 -1.26 -4.93 135.00 130.96 2gir n PRO 538 Ca -0.05 0.75 -0.43 0.00 -2.02 0.00 0.00 63.50 61.75 2gir n PRO 538 Cb 0.59 -2.41 -0.02 0.00 -0.02 0.00 0.00 33.50 31.63 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 -0.11 4.55 0.13 4.25 1.01 -1.26 -4.95 121.20 124.82 2gir s ILE 539 Ca 0.67 1.77 -0.19 0.00 0.00 0.00 0.00 60.65 62.89 2gir s ILE 539 Cb -0.63 -4.39 -0.01 0.00 0.01 0.00 0.00 42.46 37.44 2gir s ILE 539 CO 0.50 -0.42 1.70 -0.65 0.00 0.00 0.00 174.94 176.07 2gir h PRO 540 N 7.99 0.02 -0.72 2.79 0.11 -2.04 -2.68 132.00 137.47 2gir h PRO 540 Ca -0.20 -0.00 0.18 0.00 0.11 0.00 0.00 66.00 66.08 2gir h PRO 540 Cb 1.06 -0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 2gir h PRO 540 CO 1.02 0.01 0.50 0.00 -0.21 0.00 0.00 178.00 179.32 2gir h ALA 541 N 1.22 2.38 -0.61 -0.75 0.00 -2.02 -1.93 119.26 117.55 2gir h ALA 541 Ca 0.11 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.12 2gir h ALA 541 Cb 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.87 2gir h ALA 541 CO -0.22 -0.59 0.14 0.00 0.00 0.00 0.00 179.25 178.58 2gir h ALA 542 N 1.66 0.73 -0.03 0.00 0.00 -1.81 -0.41 119.26 119.39 2gir h ALA 542 Ca 0.35 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.39 2gir h ALA 542 Cb 1.09 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2gir h ALA 542 CO -0.07 -0.29 0.25 1.03 0.00 0.00 0.00 179.25 180.17 2gir h SER 543 N 0.28 0.00 1.07 0.00 0.87 -1.48 0.06 113.55 114.35 2gir h SER 543 Ca 0.32 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 2gir h SER 543 Cb 0.47 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.43 2gir h SER 543 CO -0.39 0.00 -0.27 0.54 -0.53 0.00 0.00 176.83 176.18 2gir n ARG 544 N -3.02 0.19 -1.92 2.24 1.74 -0.17 -4.92 116.66 110.80 2gir n ARG 544 Ca -0.02 0.11 -0.42 0.00 -0.77 0.00 0.00 57.85 56.75 2gir n ARG 544 Cb 0.31 -1.67 -0.03 0.00 -1.02 0.00 0.00 32.46 30.05 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 -3.96 4.37 -0.62 0.55 1.43 0.00 -4.96 118.68 115.50 2gir s LEU 545 Ca 0.10 2.64 -0.22 0.00 -1.03 0.00 0.00 54.13 55.62 2gir s LEU 545 Cb 0.15 -3.60 0.08 0.00 0.03 0.00 0.00 46.19 42.84 2gir s LEU 545 CO 0.64 -0.83 0.88 -0.62 0.23 0.00 0.00 176.35 176.65 2gir s ASP 546 N 1.10 6.19 -0.22 2.29 -1.08 -1.26 -4.86 116.67 118.83 2gir s ASP 546 Ca 0.70 -1.04 0.14 0.00 -0.52 0.00 0.00 52.55 51.83 2gir s ASP 546 Cb -0.44 -2.38 0.56 0.00 -1.46 0.00 0.00 42.92 39.19 2gir s ASP 546 CO 0.32 -1.31 1.49 0.18 0.52 0.00 0.00 175.17 176.36 2gir n LEU 547 N 7.26 4.26 -4.76 -1.34 4.32 -1.26 -4.99 117.00 120.49 2gir n LEU 547 Ca -0.05 -3.20 -0.39 0.00 -0.02 0.00 0.00 56.01 52.35 2gir n LEU 547 Cb 0.45 -0.59 0.01 0.00 -1.62 0.00 0.00 43.42 41.66 2gir n LEU 547 CO 0.62 0.81 0.95 -0.94 -1.22 0.00 0.00 177.39 177.61 2gir s SER 548 N -1.93 5.94 0.00 -1.43 1.04 -1.26 -2.46 113.70 113.60 2gir s SER 548 Ca 0.45 2.63 0.00 0.00 0.48 0.00 0.00 55.95 59.50 2gir s SER 548 Cb 0.37 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.86 2gir s SER 548 CO 0.08 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.81 2gir n GLY 549 N 0.62 3.21 3.73 7.32 0.00 -1.26 -5.02 105.19 113.79 2gir n GLY 549 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.84 3.77 -1.27 1.61 0.52 -1.03 -4.17 118.94 116.54 2gir s TRP 550 Ca 0.00 1.76 -0.01 0.00 0.02 0.00 0.00 56.10 57.87 2gir s TRP 550 Cb 0.00 -3.10 -0.00 0.00 -1.15 0.00 0.00 33.47 29.22 2gir s TRP 550 CO 0.00 0.04 0.77 1.19 0.02 0.00 0.00 176.95 178.97 2gir n PHE 551 N 2.67 -1.99 -0.09 -1.98 3.72 -1.26 -4.91 117.46 113.62 2gir n PHE 551 Ca 0.02 0.85 -0.17 0.00 -0.05 0.00 0.00 57.45 58.10 2gir n PHE 551 Cb 0.48 -4.52 -0.06 0.00 -0.94 0.00 0.00 39.48 34.44 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 -4.20 0.94 -3.64 -4.37 0.31 -1.21 -4.24 118.33 101.92 2gir n VAL 552 Ca -0.29 -0.26 -0.10 0.00 -0.01 0.00 0.00 64.34 63.68 2gir n VAL 552 Cb 0.67 -1.63 -0.03 0.00 -0.91 0.00 0.00 33.84 31.94 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 -2.32 -1.20 0.15 3.52 0.00 -1.24 -4.06 121.76 116.61 2gir s ALA 553 Ca -0.24 0.02 -0.10 0.00 0.00 0.00 0.00 51.96 51.65 2gir s ALA 553 Cb 0.09 0.85 -0.06 0.00 0.00 0.00 0.00 23.12 23.99 2gir s ALA 553 CO 0.31 -0.81 0.48 0.20 0.00 0.00 0.00 175.76 175.94 2gir s GLY 554 N -2.83 2.34 0.00 0.00 0.00 -1.26 -4.93 107.32 100.64 2gir s GLY 554 Ca 0.06 -0.31 0.20 0.00 0.00 0.00 0.00 44.72 44.67 2gir s GLY 554 CO -0.06 -0.12 1.13 -1.72 0.00 0.00 0.00 173.10 172.33 2gir n TYR 555 N 0.46 0.00 -1.68 1.90 4.01 -0.06 -4.54 117.16 117.24 2gir n TYR 555 Ca -0.04 -0.41 -0.45 0.00 -0.16 0.00 0.00 57.90 56.84 2gir n TYR 555 Cb 0.52 -0.10 -0.04 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 0.38 3.45 0.00 7.72 2.88 -1.25 -0.18 113.62 126.63 2gir n SER 556 Ca 0.03 1.05 0.00 0.00 -1.33 0.00 0.00 58.87 58.62 2gir n SER 556 Cb 1.04 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 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 3.77 0.64 0.73 0.46 0.00 -1.26 -4.08 105.19 105.45 2gir n GLY 557 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 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 -2.08 0.61 3.43 -0.02 0.00 0.75 -2.81 105.19 105.07 2gir n GLY 558 Ca 0.00 -0.55 -0.18 0.00 0.00 0.00 0.00 46.02 45.29 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 0.73 -2.51 -4.42 1.61 2.03 -1.26 -4.56 116.55 108.17 2gir n ASP 559 Ca 0.17 -0.61 -0.33 0.00 0.52 0.00 0.00 54.79 54.55 2gir n ASP 559 Cb 0.45 -5.08 -0.14 0.00 -0.72 0.00 0.00 41.12 35.64 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 -3.35 3.12 -0.18 5.18 -1.09 -1.26 -4.36 121.20 119.26 2gir s ILE 560 Ca 0.06 -0.66 0.01 0.00 -2.23 0.00 0.00 60.65 57.83 2gir s ILE 560 Cb -0.03 -2.28 0.03 0.00 -1.58 0.00 0.00 42.46 38.60 2gir s ILE 560 CO 0.72 0.55 -0.16 -0.47 -1.23 0.00 0.00 174.94 174.35 2gir s TYR 561 N -0.06 2.53 0.00 3.97 5.04 0.67 -0.51 117.35 128.99 2gir s TYR 561 Ca -0.02 -1.53 0.00 0.00 -2.44 0.00 0.00 57.07 53.08 2gir s TYR 561 Cb -0.14 -1.76 0.00 0.00 0.35 0.00 0.00 41.96 40.41 2gir s TYR 561 CO 0.04 -0.75 0.00 0.72 -1.34 0.00 0.00 175.55 174.21