#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gz4 n PRO 3 N 0.00 3.29 -3.83 3.69 -0.04 -1.26 -5.15 135.00 131.70 3gz4 n PRO 3 Ca 0.00 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.37 3gz4 n PRO 3 Cb 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.39 3gz4 n PRO 3 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3gz4 s LYS 4 N 1.13 0.82 0.00 0.54 2.47 -1.26 -5.09 119.74 118.35 3gz4 s LYS 4 Ca 0.00 -0.84 0.19 0.00 -1.56 0.00 0.00 55.97 53.76 3gz4 s LYS 4 Cb 0.00 0.34 0.67 0.00 -1.46 0.00 0.00 37.83 37.38 3gz4 s LYS 4 CO 0.00 -0.26 1.50 0.94 0.16 0.00 0.00 175.35 177.69 3gz4 n GLN 5 N 0.14 1.75 -0.03 4.03 7.27 -1.26 -2.15 117.38 127.14 3gz4 n GLN 5 Ca -0.16 -1.14 0.04 0.00 0.07 0.00 0.00 57.00 55.82 3gz4 n GLN 5 Cb 0.61 -1.38 0.05 0.00 2.41 0.00 0.00 30.24 31.94 3gz4 n GLN 5 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 3gz4 n ASP 6 N 0.37 1.93 -0.15 1.69 5.75 -1.26 -4.26 116.55 120.61 3gz4 n ASP 6 Ca 0.15 -1.49 -0.13 0.00 -0.01 0.00 0.00 54.79 53.31 3gz4 n ASP 6 Cb 0.33 -0.04 -0.10 0.00 -1.03 0.00 0.00 41.12 40.28 3gz4 n ASP 6 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 3gz4 h LEU 7 N 1.68 -1.83 -0.78 -2.12 5.85 -1.58 0.28 115.31 116.82 3gz4 h LEU 7 Ca 0.00 0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.96 3gz4 h LEU 7 Cb 0.43 0.75 0.00 0.00 0.37 0.00 0.00 40.66 42.21 3gz4 h LEU 7 CO 0.00 -0.38 0.00 0.18 -0.34 0.00 0.00 178.44 177.90 3gz4 n LEU 8 N -5.29 1.07 -4.67 2.25 4.77 -0.98 -4.86 117.00 109.29 3gz4 n LEU 8 Ca -0.03 -0.54 -0.56 0.00 -0.03 0.00 0.00 56.01 54.85 3gz4 n LEU 8 Cb 0.33 -0.21 -0.07 0.00 -2.33 0.00 0.00 43.42 41.14 3gz4 n LEU 8 CO -0.00 0.23 1.15 -3.20 -1.33 0.00 0.00 177.39 174.23 3gz4 n ASN 9 N -0.03 1.97 -3.44 -1.43 2.85 0.99 -1.64 115.26 114.54 3gz4 n ASN 9 Ca 0.05 1.10 -0.25 0.00 -0.11 0.00 0.00 54.58 55.37 3gz4 n ASN 9 Cb 0.20 -1.13 0.03 0.00 1.24 0.00 0.00 39.78 40.12 3gz4 n ASN 9 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3gz4 n ASP 10 N 4.22 -5.29 -4.78 1.20 8.00 -1.23 -4.94 116.55 113.72 3gz4 n ASP 10 Ca 0.24 -0.49 -0.33 0.00 0.71 0.00 0.00 54.79 54.92 3gz4 n ASP 10 Cb 0.13 -4.25 -0.07 0.00 -0.02 0.00 0.00 41.12 36.91 3gz4 n ASP 10 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3gz4 s ARG 11 N -6.13 3.09 -0.30 -1.24 1.81 -0.65 -5.01 118.95 110.51 3gz4 s ARG 11 Ca 0.48 -0.45 -0.02 0.00 -1.72 0.00 0.00 55.73 54.01 3gz4 s ARG 11 Cb -0.23 -2.88 0.05 0.00 -0.45 0.00 0.00 34.95 31.44 3gz4 s ARG 11 CO 0.59 0.66 0.00 0.42 -0.68 0.00 0.00 175.30 176.29 3gz4 s ILE 12 N -1.16 3.05 -0.10 1.52 1.01 -1.26 -1.65 121.20 122.60 3gz4 s ILE 12 Ca 0.22 -1.34 0.03 0.00 0.00 0.00 0.00 60.65 59.56 3gz4 s ILE 12 Cb -0.12 -2.74 0.01 0.00 0.01 0.00 0.00 42.46 39.62 3gz4 s ILE 12 CO 0.12 -0.10 -0.21 -0.63 0.00 0.00 0.00 174.94 174.13 3gz4 s ILE 13 N 1.27 1.88 -0.16 2.92 1.01 -0.29 -1.58 121.20 126.25 3gz4 s ILE 13 Ca -0.05 -0.90 -0.08 0.00 0.00 0.00 0.00 60.65 59.62 3gz4 s ILE 13 Cb -0.20 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 3gz4 s ILE 13 CO -0.01 0.52 0.12 -0.22 0.00 0.00 0.00 174.94 175.35 3gz4 s LEU 14 N 0.55 4.21 -0.14 2.97 0.20 -0.86 0.46 118.68 126.07 3gz4 s LEU 14 Ca -0.15 0.31 -0.01 0.00 0.69 0.00 0.00 54.13 54.97 3gz4 s LEU 14 Cb -0.17 -2.05 0.04 0.00 -0.43 0.00 0.00 46.19 43.57 3gz4 s LEU 14 CO 0.05 0.28 -0.05 -0.69 -0.29 0.00 0.00 176.35 175.65 3gz4 s VAL 15 N -0.26 1.00 0.42 1.68 1.01 0.23 -0.95 120.40 123.52 3gz4 s VAL 15 Ca 0.11 -0.45 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 3gz4 s VAL 15 Cb -0.12 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 3gz4 s VAL 15 CO 0.01 0.21 0.75 0.42 0.00 0.00 0.00 175.10 176.49 3gz4 s THR 16 N 1.69 4.85 -1.57 3.92 -4.23 -0.66 -0.36 115.64 119.28 3gz4 s THR 16 Ca 0.02 0.43 -0.01 0.00 -1.18 0.00 0.00 61.69 60.95 3gz4 s THR 16 Cb -0.14 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 69.92 3gz4 s THR 16 CO -0.08 -0.61 0.09 0.61 -0.54 0.00 0.00 174.62 174.09 3gz4 n GLY 17 N -1.59 -0.40 0.29 3.99 0.00 -0.79 -3.30 105.19 103.39 3gz4 n GLY 17 Ca 0.01 -0.07 0.18 0.00 0.00 0.00 0.00 46.02 46.14 3gz4 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gz4 h ALA 18 N 0.89 1.05 -0.17 4.61 0.00 -1.47 -3.23 119.26 120.95 3gz4 h ALA 18 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3gz4 h ALA 18 Cb 1.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3gz4 h ALA 18 CO 0.52 0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.68 3gz4 n SER 19 N -3.19 1.07 0.00 0.00 3.41 -1.26 -2.69 113.62 110.97 3gz4 n SER 19 Ca -0.01 -1.83 0.00 0.00 -0.26 0.00 0.00 58.87 56.77 3gz4 n SER 19 Cb 0.23 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 3gz4 n SER 19 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3gz4 n ASP 20 N 0.02 0.00 0.00 4.04 -0.08 -1.24 -4.81 116.55 114.47 3gz4 n ASP 20 Ca 0.10 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.38 3gz4 n ASP 20 Cb 0.20 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.66 3gz4 n ASP 20 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3gz4 n GLY 21 N -0.21 2.71 0.12 0.27 0.00 -1.26 -3.25 105.19 103.57 3gz4 n GLY 21 Ca 0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 46.02 45.69 3gz4 n GLY 21 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3gz4 h ILE 22 N 0.00 1.43 -0.10 -0.61 2.04 -1.94 -3.19 117.51 115.14 3gz4 h ILE 22 Ca 0.00 -2.36 -0.20 0.00 1.00 0.00 0.00 64.86 63.30 3gz4 h ILE 22 Cb 0.00 2.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.37 3gz4 h ILE 22 CO 0.00 0.66 -0.76 1.23 0.00 0.00 0.00 178.15 179.28 3gz4 h GLY 23 N 2.18 0.62 0.35 5.37 0.00 -1.60 -2.33 103.07 107.67 3gz4 h GLY 23 Ca -0.01 -0.89 0.11 0.00 0.00 0.00 0.00 47.33 46.54 3gz4 h GLY 23 CO 0.09 0.79 0.30 -0.09 0.00 0.00 0.00 176.54 177.63 3gz4 h ARG 24 N 0.38 0.49 0.03 4.80 2.43 -1.49 -0.35 114.38 120.67 3gz4 h ARG 24 Ca -0.04 -0.03 -0.23 0.00 -0.81 0.00 0.00 59.98 58.87 3gz4 h ARG 24 Cb 1.36 -0.11 0.02 0.00 -0.42 0.00 0.00 29.97 30.82 3gz4 h ARG 24 CO 0.14 0.32 -0.91 1.49 -1.51 0.00 0.00 179.97 179.50 3gz4 h GLU 25 N 0.50 0.57 0.43 0.20 4.57 -1.54 -0.64 114.58 118.66 3gz4 h GLU 25 Ca 0.36 -0.65 -0.01 0.00 -1.18 0.00 0.00 59.36 57.88 3gz4 h GLU 25 Cb 0.45 0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 29.22 3gz4 h GLU 25 CO -0.32 1.26 -0.34 0.00 -1.18 0.00 0.00 179.01 178.43 3gz4 h ALA 26 N 0.34 -0.78 -0.63 2.92 0.00 -1.20 0.43 119.26 120.33 3gz4 h ALA 26 Ca -0.12 -0.14 0.13 0.00 0.00 0.00 0.00 54.91 54.78 3gz4 h ALA 26 Cb 1.60 0.46 -0.12 0.00 0.00 0.00 0.00 17.79 19.73 3gz4 h ALA 26 CO 0.18 -0.97 -0.18 0.00 0.00 0.00 0.00 179.25 178.28 3gz4 h ALA 27 N -0.32 0.37 -0.42 0.00 0.00 -1.06 0.70 119.26 118.53 3gz4 h ALA 27 Ca -0.04 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3gz4 h ALA 27 Cb 0.66 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 3gz4 h ALA 27 CO -0.01 -0.45 0.20 0.52 0.00 0.00 0.00 179.25 179.50 3gz4 h MET 28 N -0.02 0.60 0.25 0.00 2.07 -0.89 -2.32 114.93 114.63 3gz4 h MET 28 Ca 0.30 -0.09 -0.01 0.00 -2.07 0.00 0.00 59.70 57.83 3gz4 h MET 28 Cb 0.48 -0.11 0.00 0.00 -1.87 0.00 0.00 31.60 30.11 3gz4 h MET 28 CO -0.66 0.53 -0.12 1.15 1.07 0.00 0.00 176.91 178.88 3gz4 h THR 29 N 0.53 0.76 -0.77 2.22 2.02 0.86 -2.77 112.91 115.76 3gz4 h THR 29 Ca 0.14 -0.77 0.15 0.00 0.77 0.00 0.00 66.41 66.70 3gz4 h THR 29 Cb 0.13 1.15 -0.15 0.00 -1.74 0.00 0.00 68.15 67.55 3gz4 h THR 29 CO -0.02 0.15 -0.23 1.88 0.37 0.00 0.00 175.52 177.68 3gz4 h TYR 30 N -0.78 -0.52 0.00 3.16 0.05 0.33 -0.97 116.97 118.24 3gz4 h TYR 30 Ca -0.03 0.07 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 3gz4 h TYR 30 Cb 0.50 0.35 -0.00 0.00 1.01 0.00 0.00 36.73 38.59 3gz4 h TYR 30 CO 0.04 -0.35 -0.05 0.00 -1.05 0.00 0.00 178.16 176.76 3gz4 h ALA 31 N 1.66 1.71 0.00 3.88 0.00 -1.28 -0.00 119.26 125.23 3gz4 h ALA 31 Ca 0.36 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3gz4 h ALA 31 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3gz4 h ALA 31 CO -0.80 0.06 -0.23 0.54 0.00 0.00 0.00 179.25 178.82 3gz4 n ARG 32 N -4.17 0.07 -0.70 0.00 1.74 -0.40 -2.69 116.66 110.50 3gz4 n ARG 32 Ca -0.03 0.04 0.05 0.00 -0.77 0.00 0.00 57.85 57.13 3gz4 n ARG 32 Cb 0.13 -1.56 0.30 0.00 -1.02 0.00 0.00 32.46 30.31 3gz4 n ARG 32 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3gz4 n TYR 33 N -1.67 1.53 0.00 -1.55 4.02 -0.06 -4.93 117.16 114.50 3gz4 n TYR 33 Ca 0.06 -0.96 0.00 0.00 -0.01 0.00 0.00 57.90 56.99 3gz4 n TYR 33 Cb 0.36 -0.45 0.00 0.00 -0.02 0.00 0.00 39.34 39.23 3gz4 n TYR 33 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3gz4 n GLY 34 N -0.21 1.58 3.66 2.72 0.00 -1.10 -2.32 105.19 109.51 3gz4 n GLY 34 Ca 0.28 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.91 3gz4 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gz4 n ALA 35 N -1.40 0.61 -2.55 4.61 0.00 -0.94 -3.58 120.51 117.26 3gz4 n ALA 35 Ca 0.00 0.07 -0.41 0.00 0.00 0.00 0.00 53.44 53.09 3gz4 n ALA 35 Cb 0.00 -2.19 -0.09 0.00 0.00 0.00 0.00 19.45 17.18 3gz4 n ALA 35 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3gz4 s THR 36 N -1.41 5.09 -0.05 0.00 2.01 -0.66 -4.42 115.64 116.20 3gz4 s THR 36 Ca 0.74 0.17 -0.02 0.00 0.31 0.00 0.00 61.69 62.89 3gz4 s THR 36 Cb -0.43 -3.90 -0.04 0.00 0.01 0.00 0.00 72.50 68.14 3gz4 s THR 36 CO 0.48 -0.17 0.07 0.68 -0.69 0.00 0.00 174.62 174.99 3gz4 s VAL 37 N 2.21 4.73 -0.20 3.82 -7.23 -1.26 -1.13 120.40 121.34 3gz4 s VAL 37 Ca 0.15 -0.26 -0.04 0.00 -1.81 0.00 0.00 61.98 60.02 3gz4 s VAL 37 Cb -0.16 -3.10 -0.02 0.00 0.56 0.00 0.00 36.38 33.67 3gz4 s VAL 37 CO 0.13 0.47 -0.03 -0.63 -0.31 0.00 0.00 175.10 174.73 3gz4 s ILE 38 N -1.08 3.68 -0.21 -0.62 1.01 0.17 -3.85 121.20 120.31 3gz4 s ILE 38 Ca 0.19 -0.40 -0.11 0.00 0.00 0.00 0.00 60.65 60.32 3gz4 s ILE 38 Cb -0.12 -2.66 -0.05 0.00 0.01 0.00 0.00 42.46 39.65 3gz4 s ILE 38 CO 0.09 0.44 0.20 -0.76 0.00 0.00 0.00 174.94 174.90 3gz4 s LEU 39 N 1.09 4.17 0.05 2.97 1.43 -0.70 0.74 118.68 128.43 3gz4 s LEU 39 Ca 0.02 0.25 0.09 0.00 -1.03 0.00 0.00 54.13 53.46 3gz4 s LEU 39 Cb -0.15 -2.19 -0.03 0.00 0.03 0.00 0.00 46.19 43.86 3gz4 s LEU 39 CO 0.01 0.09 -0.25 -0.76 0.23 0.00 0.00 176.35 175.67 3gz4 s LEU 40 N 0.78 2.28 0.00 1.79 1.02 0.51 -1.09 118.68 123.98 3gz4 s LEU 40 Ca 0.10 -0.58 0.00 0.00 0.02 0.00 0.00 54.13 53.68 3gz4 s LEU 40 Cb -0.13 -1.33 0.00 0.00 0.02 0.00 0.00 46.19 44.75 3gz4 s LEU 40 CO 0.03 0.25 0.00 0.61 0.02 0.00 0.00 176.35 177.26 3gz4 n GLY 41 N 1.62 1.36 0.00 -3.19 0.00 -1.08 -1.78 105.19 102.12 3gz4 n GLY 41 Ca -0.17 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.08 3gz4 n GLY 41 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3gz4 n ARG 42 N 0.00 0.17 -3.94 1.61 1.85 -1.26 -1.40 116.66 113.70 3gz4 n ARG 42 Ca 0.00 -0.67 -0.31 0.00 -1.00 0.00 0.00 57.85 55.87 3gz4 n ARG 42 Cb 0.00 -0.90 -0.15 0.00 -1.05 0.00 0.00 32.46 30.36 3gz4 n ARG 42 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 3gz4 s ASN 43 N -0.24 4.09 0.12 2.89 3.84 -1.26 -4.94 114.94 119.43 3gz4 s ASN 43 Ca 0.00 -1.42 -0.22 0.00 0.21 0.00 0.00 52.86 51.43 3gz4 s ASN 43 Cb 0.00 -1.25 -0.05 0.00 -0.55 0.00 0.00 41.25 39.40 3gz4 s ASN 43 CO 0.00 -0.28 1.69 -0.33 -2.79 0.00 0.00 177.10 175.39 3gz4 h GLU 44 N 7.90 -0.09 0.08 0.43 5.08 -1.98 -1.01 114.58 124.98 3gz4 h GLU 44 Ca -0.15 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 3gz4 h GLU 44 Cb 1.05 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.32 3gz4 h GLU 44 CO 0.44 -0.06 -0.04 1.49 -1.00 0.00 0.00 179.01 179.84 3gz4 h GLU 45 N -0.10 -0.10 -0.78 2.33 4.57 -1.98 0.86 114.58 119.38 3gz4 h GLU 45 Ca 0.08 0.01 0.17 0.00 -1.18 0.00 0.00 59.36 58.44 3gz4 h GLU 45 Cb 0.21 0.02 -0.11 0.00 -0.16 0.00 0.00 28.75 28.71 3gz4 h GLU 45 CO -0.18 0.04 0.23 0.87 -1.18 0.00 0.00 179.01 178.79 3gz4 h LYS 46 N -0.22 0.31 -0.23 1.92 1.57 -1.90 -1.06 116.57 116.96 3gz4 h LYS 46 Ca -0.01 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.68 3gz4 h LYS 46 Cb 0.18 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 3gz4 h LYS 46 CO 0.02 0.20 -0.12 -0.07 -0.57 0.00 0.00 179.45 178.91 3gz4 h LEU 47 N 0.31 0.51 -0.61 2.94 3.38 -0.40 -2.24 115.31 119.20 3gz4 h LEU 47 Ca 0.45 -0.42 0.12 0.00 0.09 0.00 0.00 57.88 58.12 3gz4 h LEU 47 Cb 0.78 -0.14 -0.09 0.00 0.09 0.00 0.00 40.66 41.30 3gz4 h LEU 47 CO -0.51 0.81 0.11 0.03 0.09 0.00 0.00 178.44 178.98 3gz4 h ARG 48 N 0.20 0.23 -0.01 1.13 3.08 0.11 -1.69 114.38 117.43 3gz4 h ARG 48 Ca 0.05 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 3gz4 h ARG 48 Cb 0.63 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.63 3gz4 h ARG 48 CO 0.04 0.15 0.01 1.96 -1.07 0.00 0.00 179.97 181.05 3gz4 h GLN 49 N 0.24 0.02 -0.82 0.04 4.20 -1.10 -1.66 115.11 116.03 3gz4 h GLN 49 Ca 0.32 -0.00 0.04 0.00 0.06 0.00 0.00 58.65 59.07 3gz4 h GLN 49 Cb 0.49 -0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.22 3gz4 h GLN 49 CO -0.43 0.15 0.52 0.28 -0.67 0.00 0.00 178.83 178.68 3gz4 h VAL 50 N -0.11 1.11 0.43 -0.54 2.07 -1.14 -0.79 116.25 117.28 3gz4 h VAL 50 Ca 0.00 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 3gz4 h VAL 50 Cb 0.14 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 3gz4 h VAL 50 CO -0.00 0.18 -0.23 0.00 0.02 0.00 0.00 177.57 177.55 3gz4 h ALA 51 N 1.35 -0.60 -0.81 1.67 0.00 -1.17 -0.84 119.26 118.86 3gz4 h ALA 51 Ca 0.33 -0.13 0.19 0.00 0.00 0.00 0.00 54.91 55.30 3gz4 h ALA 51 Cb 0.04 0.26 -0.12 0.00 0.00 0.00 0.00 17.79 17.96 3gz4 h ALA 51 CO -0.12 -0.84 0.26 1.03 0.00 0.00 0.00 179.25 179.57 3gz4 h SER 52 N -0.61 0.12 -0.30 0.00 0.87 -1.11 0.16 113.55 112.68 3gz4 h SER 52 Ca -0.06 0.15 -0.04 0.00 -1.23 0.00 0.00 61.79 60.62 3gz4 h SER 52 Cb 0.48 0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 3gz4 h SER 52 CO 0.08 -0.03 0.05 -0.74 -0.53 0.00 0.00 176.83 175.66 3gz4 h HIS 53 N 0.31 0.54 -0.20 2.24 6.17 -0.78 -1.89 115.15 121.55 3gz4 h HIS 53 Ca 0.48 -0.08 -0.09 0.00 0.71 0.00 0.00 60.37 61.39 3gz4 h HIS 53 Cb 0.87 -0.15 -0.01 0.00 2.52 0.00 0.00 27.41 30.64 3gz4 h HIS 53 CO -0.22 0.59 -0.29 0.82 0.71 0.00 0.00 177.93 179.54 3gz4 h ILE 54 N 0.33 1.27 0.58 6.26 2.04 -0.62 -2.24 117.51 125.12 3gz4 h ILE 54 Ca 0.09 -1.30 -0.02 0.00 1.00 0.00 0.00 64.86 64.64 3gz4 h ILE 54 Cb 0.35 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 3gz4 h ILE 54 CO 0.01 0.40 -0.49 -1.13 0.00 0.00 0.00 178.15 176.94 3gz4 h ASN 55 N 0.34 -1.32 0.07 1.72 -1.24 -0.52 -1.06 115.58 113.57 3gz4 h ASN 55 Ca 0.05 0.10 -0.00 0.00 0.71 0.00 0.00 56.30 57.15 3gz4 h ASN 55 Cb 0.69 0.42 -0.00 0.00 0.73 0.00 0.00 38.32 40.16 3gz4 h ASN 55 CO 0.05 -0.68 -0.00 -0.33 -1.29 0.00 0.00 177.43 175.18 3gz4 h GLU 56 N -1.05 0.00 0.08 6.67 5.08 -1.13 1.14 114.58 125.37 3gz4 h GLU 56 Ca -0.08 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 57.97 3gz4 h GLU 56 Cb 0.89 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 3gz4 h GLU 56 CO -0.01 0.00 -1.75 0.93 -1.00 0.00 0.00 179.01 177.18 3gz4 h GLU 57 N 0.00 0.16 0.00 2.33 5.08 -1.27 -3.43 114.58 117.45 3gz4 h GLU 57 Ca -0.00 -0.28 -0.12 0.00 -1.00 0.00 0.00 59.36 57.97 3gz4 h GLU 57 Cb 0.04 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3gz4 h GLU 57 CO 0.00 0.93 -1.43 0.25 -1.00 0.00 0.00 179.01 177.75 3gz4 n THR 58 N -3.32 0.44 -0.40 1.13 -2.24 -0.41 -5.01 114.28 104.47 3gz4 n THR 58 Ca -0.22 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 3gz4 n THR 58 Cb 1.05 -0.83 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 3gz4 n THR 58 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gz4 n GLY 59 N 2.69 0.92 3.40 3.38 0.00 0.38 -5.02 105.19 110.94 3gz4 n GLY 59 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 3gz4 n GLY 59 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gz4 s ARG 60 N -0.49 3.52 -0.21 1.61 3.52 -1.26 -5.02 118.95 120.62 3gz4 s ARG 60 Ca 0.00 -0.58 -0.16 0.00 -0.13 0.00 0.00 55.73 54.87 3gz4 s ARG 60 Cb 0.00 -2.96 -0.04 0.00 -1.56 0.00 0.00 34.95 30.39 3gz4 s ARG 60 CO 0.00 0.02 0.39 -1.14 -0.81 0.00 0.00 175.30 173.76 3gz4 s GLN 61 N 0.93 4.15 0.79 5.12 0.74 -1.26 -3.57 119.66 126.56 3gz4 s GLN 61 Ca -0.00 0.17 -0.10 0.00 0.05 0.00 0.00 55.36 55.48 3gz4 s GLN 61 Cb -0.15 -3.55 0.07 0.00 1.10 0.00 0.00 33.01 30.48 3gz4 s GLN 61 CO 0.01 -0.06 1.10 -1.25 -0.55 0.00 0.00 175.29 174.53 3gz4 s PRO 62 N 1.39 2.10 0.05 1.67 0.04 -1.26 -5.02 135.00 133.97 3gz4 s PRO 62 Ca 0.18 1.19 -0.07 0.00 0.04 0.00 0.00 61.00 62.33 3gz4 s PRO 62 Cb -0.15 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 3gz4 s PRO 62 CO 0.08 -1.76 0.33 -0.65 0.04 0.00 0.00 177.00 175.04 3gz4 s GLN 63 N -4.88 3.65 0.16 4.56 -0.21 -1.25 -4.93 119.66 116.75 3gz4 s GLN 63 Ca 0.62 0.01 0.10 0.00 0.02 0.00 0.00 55.36 56.10 3gz4 s GLN 63 Cb -0.18 -3.03 -0.04 0.00 1.00 0.00 0.00 33.01 30.77 3gz4 s GLN 63 CO 0.56 0.60 -0.22 1.67 -2.12 0.00 0.00 175.29 175.78 3gz4 s TRP 64 N -1.37 2.06 0.03 0.91 1.48 -1.26 -1.73 118.94 119.06 3gz4 s TRP 64 Ca 0.31 -0.41 0.02 0.00 -1.06 0.00 0.00 56.10 54.96 3gz4 s TRP 64 Cb -0.13 -1.06 -0.02 0.00 -1.16 0.00 0.00 33.47 31.10 3gz4 s TRP 64 CO 0.18 0.37 -0.07 -0.06 -4.06 0.00 0.00 176.95 173.31 3gz4 s PHE 65 N -1.60 0.62 -0.28 1.66 0.08 -0.25 -4.96 117.98 113.25 3gz4 s PHE 65 Ca 0.16 -0.37 -0.14 0.00 0.12 0.00 0.00 56.93 56.69 3gz4 s PHE 65 Cb -0.08 -0.38 -0.04 0.00 -0.57 0.00 0.00 43.02 41.96 3gz4 s PHE 65 CO 0.07 -0.06 0.35 0.42 -0.10 0.00 0.00 175.22 175.91 3gz4 s ILE 66 N -0.99 5.19 -0.12 0.64 -1.09 -1.26 -2.64 121.20 120.93 3gz4 s ILE 66 Ca -0.06 0.49 -0.03 0.00 -2.23 0.00 0.00 60.65 58.82 3gz4 s ILE 66 Cb -0.08 -3.69 0.05 0.00 -1.58 0.00 0.00 42.46 37.16 3gz4 s ILE 66 CO 0.00 0.15 0.06 -0.22 -1.23 0.00 0.00 174.94 173.70 3gz4 s LEU 67 N 2.04 0.41 -0.71 2.97 2.96 -0.49 -4.99 118.68 120.86 3gz4 s LEU 67 Ca 0.14 -0.34 -0.26 0.00 -0.22 0.00 0.00 54.13 53.46 3gz4 s LEU 67 Cb -0.16 -0.28 0.04 0.00 0.50 0.00 0.00 46.19 46.29 3gz4 s LEU 67 CO 0.10 -0.29 1.19 -0.62 -1.32 0.00 0.00 176.35 175.41 3gz4 s ASP 68 N 2.09 6.17 0.00 3.68 3.68 -1.26 -4.39 116.67 126.65 3gz4 s ASP 68 Ca 0.03 -0.58 0.13 0.00 2.13 0.00 0.00 52.55 54.27 3gz4 s ASP 68 Cb -0.14 -2.52 0.80 0.00 -1.45 0.00 0.00 42.92 39.61 3gz4 s ASP 68 CO -0.06 -1.72 1.24 0.18 0.13 0.00 0.00 175.17 174.94 3gz4 n LEU 69 N 8.89 0.00 0.00 -1.34 4.77 -1.26 -0.54 117.00 127.52 3gz4 n LEU 69 Ca 0.01 0.02 -0.06 0.00 -0.03 0.00 0.00 56.01 55.95 3gz4 n LEU 69 Cb 0.48 -0.02 -0.12 0.00 -2.33 0.00 0.00 43.42 41.43 3gz4 n LEU 69 CO 0.69 -0.01 -0.38 0.25 -1.33 0.00 0.00 177.39 176.61 3gz4 h LEU 70 N 0.00 0.00 0.00 2.23 5.85 -1.89 -3.26 115.31 118.24 3gz4 h LEU 70 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3gz4 h LEU 70 Cb 0.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.04 3gz4 h LEU 70 CO 0.00 0.90 -0.32 0.35 -0.34 0.00 0.00 178.44 179.03 3gz4 n THR 71 N -3.05 0.00 -1.68 1.05 -2.24 0.30 -4.90 114.28 103.77 3gz4 n THR 71 Ca -0.13 -0.37 -0.35 0.00 -2.27 0.00 0.00 64.05 60.94 3gz4 n THR 71 Cb 0.99 0.92 0.07 0.00 -2.10 0.00 0.00 70.33 70.20 3gz4 n THR 71 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gz4 s THR 73 N -1.85 3.11 0.28 0.00 -4.23 -1.26 -5.00 115.64 106.69 3gz4 s THR 73 Ca 0.75 -1.67 0.02 0.00 -1.18 0.00 0.00 61.69 59.61 3gz4 s THR 73 Cb -0.29 -3.00 0.27 0.00 1.34 0.00 0.00 72.50 70.82 3gz4 s THR 73 CO 0.40 -0.19 1.74 -1.28 -0.54 0.00 0.00 174.62 174.75 3gz4 h SER 74 N 1.54 0.49 0.40 3.99 0.87 -1.96 -2.04 113.55 116.84 3gz4 h SER 74 Ca -0.44 0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.23 3gz4 h SER 74 Cb 1.25 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 63.25 3gz4 h SER 74 CO 0.63 0.13 -0.29 -0.08 -0.53 0.00 0.00 176.83 176.69 3gz4 h GLU 75 N 0.55 -0.65 -0.90 2.24 4.57 -1.99 -1.53 114.58 116.87 3gz4 h GLU 75 Ca 0.52 0.04 0.23 0.00 -1.18 0.00 0.00 59.36 58.98 3gz4 h GLU 75 Cb 0.87 0.15 -0.13 0.00 -0.16 0.00 0.00 28.75 29.48 3gz4 h GLU 75 CO -0.44 -0.43 0.36 -0.44 -1.18 0.00 0.00 179.01 176.88 3gz4 h ASP 76 N -0.68 0.25 0.18 1.04 3.32 -1.77 0.19 116.42 118.95 3gz4 h ASP 76 Ca -0.04 0.17 -0.19 0.00 0.02 0.00 0.00 57.03 56.99 3gz4 h ASP 76 Cb 0.58 0.17 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 3gz4 h ASP 76 CO 0.01 -0.06 -0.72 0.00 -1.72 0.00 0.00 179.24 176.76 3gz4 h GLN 78 N 0.33 0.48 -0.16 0.00 4.20 0.33 -2.02 115.11 118.26 3gz4 h GLN 78 Ca -0.03 -0.15 0.03 0.00 0.06 0.00 0.00 58.65 58.56 3gz4 h GLN 78 Cb 1.30 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.97 3gz4 h GLN 78 CO 0.13 0.63 -0.53 1.96 -0.67 0.00 0.00 178.83 180.36 3gz4 h GLN 79 N 0.27 -0.52 -0.71 1.46 4.20 -0.96 -0.98 115.11 117.87 3gz4 h GLN 79 Ca 0.08 0.04 0.14 0.00 0.06 0.00 0.00 58.65 58.97 3gz4 h GLN 79 Cb 0.42 0.12 -0.13 0.00 0.30 0.00 0.00 27.48 28.18 3gz4 h GLN 79 CO 0.01 -0.35 -0.15 1.25 -0.67 0.00 0.00 178.83 178.93 3gz4 h LEU 80 N -0.54 -0.60 -1.45 1.46 5.85 -1.29 0.24 115.31 118.97 3gz4 h LEU 80 Ca 0.03 0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 3gz4 h LEU 80 Cb 0.65 0.42 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 3gz4 h LEU 80 CO -0.44 -0.22 0.22 0.00 -0.34 0.00 0.00 178.44 177.66 3gz4 h ALA 81 N 1.70 1.58 -0.30 1.25 0.00 -0.97 0.33 119.26 122.85 3gz4 h ALA 81 Ca 0.35 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 3gz4 h ALA 81 Cb 0.54 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3gz4 h ALA 81 CO -0.71 0.35 -0.07 1.96 0.00 0.00 0.00 179.25 180.78 3gz4 h GLN 82 N 0.60 0.58 -0.44 0.00 4.20 0.73 0.34 115.11 121.11 3gz4 h GLN 82 Ca 0.15 -0.22 0.08 0.00 0.06 0.00 0.00 58.65 58.72 3gz4 h GLN 82 Cb 0.05 -0.03 -0.06 0.00 0.30 0.00 0.00 27.48 27.73 3gz4 h GLN 82 CO -0.02 0.77 0.06 0.00 -0.67 0.00 0.00 178.83 178.96 3gz4 h ARG 83 N 0.35 0.18 -0.43 1.46 3.08 0.49 -1.94 114.38 117.57 3gz4 h ARG 83 Ca 0.08 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 3gz4 h ARG 83 Cb 0.55 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 3gz4 h ARG 83 CO 0.03 0.12 0.16 0.82 -1.07 0.00 0.00 179.97 180.03 3gz4 h ILE 84 N 0.19 1.21 0.00 2.04 2.04 -0.28 -3.01 117.51 119.70 3gz4 h ILE 84 Ca 0.22 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.43 3gz4 h ILE 84 Cb 0.29 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.20 3gz4 h ILE 84 CO -0.31 0.24 -0.02 0.00 0.00 0.00 0.00 178.15 178.05 3gz4 h ALA 85 N 1.01 1.58 -0.04 1.87 0.00 -0.43 -1.11 119.26 122.14 3gz4 h ALA 85 Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3gz4 h ALA 85 Cb 0.21 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3gz4 h ALA 85 CO -0.01 0.03 -0.02 0.28 0.00 0.00 0.00 179.25 179.53 3gz4 h VAL 86 N 0.00 1.32 0.00 0.00 2.07 -1.22 -3.25 116.25 115.18 3gz4 h VAL 86 Ca -0.00 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.52 3gz4 h VAL 86 Cb 0.05 1.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 3gz4 h VAL 86 CO 0.00 0.27 -0.37 0.59 0.02 0.00 0.00 177.57 178.08 3gz4 n ASN 87 N -4.84 0.38 -4.08 0.57 3.02 -1.02 -4.94 115.26 104.36 3gz4 n ASN 87 Ca -0.08 -0.03 -0.21 0.00 -0.03 0.00 0.00 54.58 54.23 3gz4 n ASN 87 Cb 0.23 0.04 -0.15 0.00 -0.61 0.00 0.00 39.78 39.30 3gz4 n ASN 87 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3gz4 s TYR 88 N -3.01 1.09 -1.78 3.10 2.02 -0.45 -5.04 117.35 113.28 3gz4 s TYR 88 Ca 0.12 -0.23 0.20 0.00 -0.37 0.00 0.00 57.07 56.79 3gz4 s TYR 88 Cb 0.18 -0.70 0.54 0.00 -0.40 0.00 0.00 41.96 41.58 3gz4 s TYR 88 CO 0.66 -0.01 1.45 -0.35 -1.57 0.00 0.00 175.55 175.73 3gz4 n PRO 89 N 2.65 2.71 -3.53 -1.71 -0.04 -1.26 -4.46 135.00 129.35 3gz4 n PRO 89 Ca -0.14 -2.47 0.00 0.00 -0.04 0.00 0.00 63.50 60.84 3gz4 n PRO 89 Cb 0.56 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 3gz4 n PRO 89 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 3gz4 n ARG 90 N 1.37 -2.02 -3.61 0.54 1.85 -1.26 -4.88 116.66 108.64 3gz4 n ARG 90 Ca 0.21 0.00 -0.16 0.00 -1.00 0.00 0.00 57.85 56.90 3gz4 n ARG 90 Cb 0.57 0.00 -0.14 0.00 -1.05 0.00 0.00 32.46 31.84 3gz4 n ARG 90 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3gz4 s LEU 91 N 0.00 -0.16 0.00 2.89 1.43 -0.71 -4.87 118.68 117.26 3gz4 s LEU 91 Ca 0.00 0.24 0.30 0.00 -1.03 0.00 0.00 54.13 53.64 3gz4 s LEU 91 Cb 0.00 0.44 1.41 0.00 0.03 0.00 0.00 46.19 48.08 3gz4 s LEU 91 CO 0.00 -0.27 2.00 0.47 0.23 0.00 0.00 176.35 178.78 3gz4 n ASP 92 N 5.33 0.07 -3.64 2.29 8.00 -0.61 -4.20 116.55 123.80 3gz4 n ASP 92 Ca -0.05 -0.10 -0.05 0.00 0.71 0.00 0.00 54.79 55.30 3gz4 n ASP 92 Cb 0.50 -0.28 -0.06 0.00 -0.02 0.00 0.00 41.12 41.26 3gz4 n ASP 92 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3gz4 s GLY 93 N -2.64 0.10 -0.05 0.44 0.00 -1.17 -0.06 107.32 103.94 3gz4 s GLY 93 Ca 0.26 2.98 -0.01 0.00 0.00 0.00 0.00 44.72 47.95 3gz4 s GLY 93 CO 0.48 1.63 0.02 0.14 0.00 0.00 0.00 173.10 175.37 3gz4 s VAL 94 N -0.28 0.17 -0.33 1.40 1.01 0.15 -2.03 120.40 120.49 3gz4 s VAL 94 Ca 0.05 0.19 -0.06 0.00 0.00 0.00 0.00 61.98 62.16 3gz4 s VAL 94 Cb -0.04 -0.33 0.04 0.00 0.00 0.00 0.00 36.38 36.05 3gz4 s VAL 94 CO -0.10 0.19 0.09 -0.22 0.00 0.00 0.00 175.10 175.07 3gz4 s LEU 95 N 1.65 4.21 -0.73 3.92 2.96 -0.13 -0.95 118.68 129.62 3gz4 s LEU 95 Ca -0.01 -1.09 -0.22 0.00 -0.22 0.00 0.00 54.13 52.59 3gz4 s LEU 95 Cb -0.13 -1.86 0.08 0.00 0.50 0.00 0.00 46.19 44.78 3gz4 s LEU 95 CO -0.03 -0.30 1.03 -1.00 -1.32 0.00 0.00 176.35 174.73 3gz4 s HIS 96 N 1.41 2.72 -0.12 5.38 3.76 -0.69 -1.65 115.29 126.08 3gz4 s HIS 96 Ca -0.01 -0.67 0.08 0.00 -0.15 0.00 0.00 55.06 54.31 3gz4 s HIS 96 Cb -0.19 -4.33 -0.13 0.00 1.11 0.00 0.00 32.58 29.03 3gz4 s HIS 96 CO 0.02 -1.66 0.00 -1.71 -0.85 0.00 0.00 174.74 170.55 3gz4 n ASN 97 N 7.67 2.28 -4.60 1.40 5.15 -1.22 -3.08 115.26 122.86 3gz4 n ASN 97 Ca 0.03 -0.02 -0.45 0.00 -0.60 0.00 0.00 54.58 53.54 3gz4 n ASN 97 Cb 0.46 0.57 -0.02 0.00 -0.53 0.00 0.00 39.78 40.27 3gz4 n ASN 97 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gz4 n ALA 98 N -2.53 -0.09 -3.45 5.20 0.00 -1.21 -4.85 120.51 113.58 3gz4 n ALA 98 Ca -0.20 0.41 -0.16 0.00 0.00 0.00 0.00 53.44 53.48 3gz4 n ALA 98 Cb 0.86 -2.07 -0.05 0.00 0.00 0.00 0.00 19.45 18.19 3gz4 n ALA 98 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3gz4 s GLY 99 N -0.33 -0.54 -0.10 0.00 0.00 -1.26 -4.88 107.32 100.21 3gz4 s GLY 99 Ca 0.62 0.97 0.01 0.00 0.00 0.00 0.00 44.72 46.33 3gz4 s GLY 99 CO 0.57 0.64 -0.11 -2.27 0.00 0.00 0.00 173.10 171.93 3gz4 s LEU 100 N -1.65 1.50 -0.09 0.66 2.96 -1.26 -5.05 118.68 115.75 3gz4 s LEU 100 Ca -0.08 -0.34 -0.25 0.00 -0.22 0.00 0.00 54.13 53.25 3gz4 s LEU 100 Cb -0.01 -0.91 -0.21 0.00 0.50 0.00 0.00 46.19 45.57 3gz4 s LEU 100 CO 0.03 -0.03 0.87 0.25 -1.32 0.00 0.00 176.35 176.15 3gz4 h LEU 101 N 7.57 -0.04 0.00 -0.68 5.85 -1.97 -3.46 115.31 122.58 3gz4 h LEU 101 Ca -0.31 -0.66 0.00 0.00 0.84 0.00 0.00 57.88 57.75 3gz4 h LEU 101 Cb 1.16 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.20 3gz4 h LEU 101 CO 0.46 0.70 0.00 0.61 -0.34 0.00 0.00 178.44 179.86 3gz4 n GLY 102 N 1.04 -0.49 3.69 3.75 0.00 -1.26 -4.36 105.19 107.57 3gz4 n GLY 102 Ca -0.08 -1.09 -0.41 0.00 0.00 0.00 0.00 46.02 44.44 3gz4 n GLY 102 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gz4 s ASP 103 N -4.00 7.00 -0.51 1.61 1.01 -1.26 -5.02 116.67 115.51 3gz4 s ASP 103 Ca 0.00 1.22 -0.19 0.00 0.71 0.00 0.00 52.55 54.30 3gz4 s ASP 103 Cb 0.00 -2.45 0.06 0.00 1.01 0.00 0.00 42.92 41.55 3gz4 s ASP 103 CO 0.00 -0.26 0.60 -0.69 0.21 0.00 0.00 175.17 175.03 3gz4 s VAL 104 N 1.46 4.92 -0.19 -1.27 1.01 -1.26 -4.65 120.40 120.42 3gz4 s VAL 104 Ca 0.39 -0.62 -0.34 0.00 0.00 0.00 0.00 61.98 61.41 3gz4 s VAL 104 Cb -0.18 -4.29 0.14 0.00 0.00 0.00 0.00 36.38 32.05 3gz4 s VAL 104 CO 0.16 -0.80 1.20 0.00 0.00 0.00 0.00 175.10 175.66 3gz4 n PRO 106 N -0.00 0.00 0.21 0.00 -0.01 -1.26 -4.46 135.00 129.48 3gz4 n PRO 106 Ca -0.01 0.00 0.14 0.00 -0.01 0.00 0.00 63.50 63.62 3gz4 n PRO 106 Cb 0.58 -0.77 0.76 0.00 -0.01 0.00 0.00 33.50 34.06 3gz4 n PRO 106 CO 0.00 0.00 0.00 0.52 -0.01 0.00 0.00 175.50 176.01 3gz4 h MET 107 N 0.93 0.00 -0.07 -0.52 2.86 -1.97 0.73 114.93 116.89 3gz4 h MET 107 Ca -0.23 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.43 3gz4 h MET 107 Cb 1.04 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.69 3gz4 h MET 107 CO 0.42 0.00 0.10 0.66 1.06 0.00 0.00 176.91 179.15 3gz4 h SER 108 N 0.00 0.00 0.00 1.22 4.64 -2.05 -3.31 113.55 114.06 3gz4 h SER 108 Ca 0.06 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.36 3gz4 h SER 108 Cb 0.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 3gz4 h SER 108 CO -0.00 0.00 -1.41 -0.62 -0.87 0.00 0.00 176.83 173.93 3gz4 n GLU 109 N -3.62 0.72 -1.39 4.77 1.02 0.25 -5.01 120.64 117.37 3gz4 n GLU 109 Ca -0.01 -0.06 -0.54 0.00 -0.02 0.00 0.00 57.16 56.52 3gz4 n GLU 109 Cb 0.19 -1.20 -0.08 0.00 -0.02 0.00 0.00 31.44 30.33 3gz4 n GLU 109 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3gz4 n GLN 110 N -1.89 0.00 -2.49 3.49 1.13 -0.84 -4.91 117.38 111.88 3gz4 n GLN 110 Ca -0.04 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.61 3gz4 n GLN 110 Cb 0.32 -1.33 -0.03 0.00 0.11 0.00 0.00 30.24 29.30 3gz4 n GLN 110 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3gz4 s ASP 111 N 0.68 7.18 0.27 1.08 3.68 -1.26 -4.96 116.67 123.34 3gz4 s ASP 111 Ca 0.84 1.99 -0.03 0.00 2.13 0.00 0.00 52.55 57.48 3gz4 s ASP 111 Cb -1.18 -2.59 0.36 0.00 -1.45 0.00 0.00 42.92 38.06 3gz4 s ASP 111 CO 0.56 -0.36 1.87 -0.65 0.13 0.00 0.00 175.17 176.73 3gz4 h PRO 112 N 6.23 1.03 -0.13 4.34 0.11 -1.99 0.57 132.00 142.17 3gz4 h PRO 112 Ca -0.42 -0.14 -0.06 0.00 0.11 0.00 0.00 66.00 65.48 3gz4 h PRO 112 Cb 1.21 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 3gz4 h PRO 112 CO 0.77 0.79 -0.17 0.37 -0.21 0.00 0.00 178.00 179.55 3gz4 h GLN 113 N 1.02 0.34 -0.36 1.05 -0.00 -1.99 -2.03 115.11 113.14 3gz4 h GLN 113 Ca 0.25 -0.19 0.04 0.00 -0.00 0.00 0.00 58.65 58.75 3gz4 h GLN 113 Cb 0.10 0.01 -0.04 0.00 0.00 0.00 0.00 27.48 27.55 3gz4 h GLN 113 CO -0.03 0.76 0.13 0.28 0.00 0.00 0.00 178.83 179.97 3gz4 h VAL 114 N -0.06 0.90 -0.78 2.39 2.07 -1.93 0.70 116.25 119.53 3gz4 h VAL 114 Ca 0.01 -0.10 0.17 0.00 0.82 0.00 0.00 66.70 67.61 3gz4 h VAL 114 Cb 0.72 0.59 -0.14 0.00 -1.52 0.00 0.00 31.29 30.94 3gz4 h VAL 114 CO 0.04 0.05 -0.05 -0.25 0.02 0.00 0.00 177.57 177.38 3gz4 h TRP 115 N 0.28 -0.15 -0.05 1.57 2.91 -0.85 -0.74 115.95 118.90 3gz4 h TRP 115 Ca 0.17 0.06 -0.18 0.00 1.13 0.00 0.00 58.89 60.07 3gz4 h TRP 115 Cb 0.14 0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.97 3gz4 h TRP 115 CO -0.14 -0.28 -0.73 1.96 -1.03 0.00 0.00 178.44 178.22 3gz4 h GLN 116 N 0.06 0.30 -0.86 2.65 4.20 -0.59 -2.77 115.11 118.10 3gz4 h GLN 116 Ca 0.42 -0.25 0.01 0.00 0.06 0.00 0.00 58.65 58.88 3gz4 h GLN 116 Cb 0.72 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.51 3gz4 h GLN 116 CO -0.72 0.90 0.57 -0.44 -0.67 0.00 0.00 178.83 178.47 3gz4 h ASP 117 N 0.20 0.99 0.24 1.46 3.32 -0.18 -2.38 116.42 120.07 3gz4 h ASP 117 Ca -0.03 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.84 3gz4 h ASP 117 Cb 1.29 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.59 3gz4 h ASP 117 CO 0.12 0.71 -0.62 0.58 -1.72 0.00 0.00 179.24 178.31 3gz4 h VAL 118 N 1.16 1.36 0.03 -1.35 2.07 -0.93 -1.90 116.25 116.70 3gz4 h VAL 118 Ca 0.32 -1.96 -0.21 0.00 0.82 0.00 0.00 66.70 65.66 3gz4 h VAL 118 Cb -0.13 1.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 3gz4 h VAL 118 CO -0.07 0.59 -0.99 0.24 0.02 0.00 0.00 177.57 177.36 3gz4 h MET 119 N 0.27 0.12 0.17 1.57 2.86 -1.43 -1.27 114.93 117.22 3gz4 h MET 119 Ca -0.01 -0.17 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 3gz4 h MET 119 Cb 1.15 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.86 3gz4 h MET 119 CO 0.10 1.01 -0.08 0.37 1.06 0.00 0.00 176.91 179.37 3gz4 h GLN 120 N 0.05 -0.21 0.36 1.72 5.75 -1.35 0.55 115.11 121.98 3gz4 h GLN 120 Ca -0.05 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.45 3gz4 h GLN 120 Cb 1.68 0.05 0.00 0.00 1.07 0.00 0.00 27.48 30.28 3gz4 h GLN 120 CO 0.14 0.16 -0.17 0.28 -2.65 0.00 0.00 178.83 176.59 3gz4 h VAL 121 N -0.65 0.65 0.03 2.39 2.07 -1.38 0.54 116.25 119.90 3gz4 h VAL 121 Ca -0.02 -0.06 -0.24 0.00 0.82 0.00 0.00 66.70 67.20 3gz4 h VAL 121 Cb 0.48 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3gz4 h VAL 121 CO 0.04 0.01 -1.15 0.78 0.02 0.00 0.00 177.57 177.27 3gz4 h ASN 122 N -0.52 0.10 0.00 0.57 4.21 -1.24 -3.22 115.58 115.48 3gz4 h ASN 122 Ca -0.05 -0.12 -0.07 0.00 1.21 0.00 0.00 56.30 57.28 3gz4 h ASN 122 Cb 0.39 -0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.55 3gz4 h ASN 122 CO 0.08 1.09 -0.93 0.52 -1.29 0.00 0.00 177.43 176.90 3gz4 n VAL 123 N -3.36 1.28 0.00 2.81 0.31 0.18 -4.62 118.33 114.94 3gz4 n VAL 123 Ca -0.04 0.13 -0.18 0.00 -0.01 0.00 0.00 64.34 64.24 3gz4 n VAL 123 Cb 0.97 -1.97 -0.10 0.00 -0.91 0.00 0.00 33.84 31.83 3gz4 n VAL 123 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 3gz4 h ASN 124 N -0.60 0.70 0.27 4.52 4.21 -1.27 0.26 115.58 123.66 3gz4 h ASN 124 Ca -0.10 -0.71 -0.20 0.00 1.21 0.00 0.00 56.30 56.50 3gz4 h ASN 124 Cb 0.79 -0.21 -0.00 0.00 -1.12 0.00 0.00 38.32 37.78 3gz4 h ASN 124 CO -0.06 1.31 -0.81 0.00 -1.29 0.00 0.00 177.43 176.57 3gz4 h ALA 125 N 0.41 0.49 -0.33 -0.83 0.00 -1.04 0.11 119.26 118.07 3gz4 h ALA 125 Ca -0.07 -0.65 -0.13 0.00 0.00 0.00 0.00 54.91 54.06 3gz4 h ALA 125 Cb 1.37 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 3gz4 h ALA 125 CO 0.14 0.78 -0.34 1.15 0.00 0.00 0.00 179.25 180.98 3gz4 h THR 126 N 0.27 1.28 0.75 0.00 2.02 -1.56 0.39 112.91 116.06 3gz4 h THR 126 Ca -0.05 -1.49 -0.03 0.00 0.77 0.00 0.00 66.41 65.61 3gz4 h THR 126 Cb 1.41 1.39 -0.00 0.00 -1.74 0.00 0.00 68.15 69.21 3gz4 h THR 126 CO 0.14 0.49 -0.44 0.15 0.37 0.00 0.00 175.52 176.23 3gz4 h PHE 127 N 0.62 -1.15 -0.53 3.16 3.57 -0.39 -1.12 116.94 121.10 3gz4 h PHE 127 Ca 0.06 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 3gz4 h PHE 127 Cb 0.87 0.40 -0.03 0.00 2.79 0.00 0.00 35.95 39.99 3gz4 h PHE 127 CO 0.04 -0.66 0.25 0.52 -2.23 0.00 0.00 178.31 176.23 3gz4 h MET 128 N -1.10 0.75 -0.18 1.11 2.86 -0.58 -1.54 114.93 116.24 3gz4 h MET 128 Ca -0.10 -0.09 -0.05 0.00 -2.06 0.00 0.00 59.70 57.40 3gz4 h MET 128 Cb 0.88 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.39 3gz4 h MET 128 CO 0.11 0.59 -0.08 1.25 1.06 0.00 0.00 176.91 179.85 3gz4 h LEU 129 N 0.75 0.39 -0.65 1.22 5.85 -0.26 -2.29 115.31 120.32 3gz4 h LEU 129 Ca 0.19 -0.40 0.08 0.00 0.84 0.00 0.00 57.88 58.59 3gz4 h LEU 129 Cb 0.09 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 40.95 3gz4 h LEU 129 CO -0.02 0.70 0.30 0.74 -0.34 0.00 0.00 178.44 179.82 3gz4 h THR 130 N 0.07 0.85 -0.19 1.05 2.02 -0.80 -2.60 112.91 113.31 3gz4 h THR 130 Ca 0.04 -0.18 0.01 0.00 0.77 0.00 0.00 66.41 67.05 3gz4 h THR 130 Cb 0.55 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 3gz4 h THR 130 CO 0.02 0.10 0.11 -0.61 0.37 0.00 0.00 175.52 175.51 3gz4 h GLN 131 N 0.54 0.22 0.00 6.66 4.15 -1.20 -2.24 115.11 123.23 3gz4 h GLN 131 Ca 0.32 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.72 3gz4 h GLN 131 Cb 0.32 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.96 3gz4 h GLN 131 CO -0.26 0.14 0.00 0.00 -1.93 0.00 0.00 178.83 176.79 3gz4 n ALA 132 N -2.17 1.33 0.22 3.38 0.00 -0.87 -2.95 120.51 119.44 3gz4 n ALA 132 Ca -0.03 0.08 0.02 0.00 0.00 0.00 0.00 53.44 53.51 3gz4 n ALA 132 Cb 0.04 -1.25 0.01 0.00 0.00 0.00 0.00 19.45 18.25 3gz4 n ALA 132 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gz4 n LEU 133 N -1.94 1.06 -0.06 0.00 4.77 -0.89 -4.67 117.00 115.27 3gz4 n LEU 133 Ca 0.01 -0.85 -0.07 0.00 -0.03 0.00 0.00 56.01 55.07 3gz4 n LEU 133 Cb 0.11 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.31 3gz4 n LEU 133 CO 0.11 0.23 0.70 -0.07 -1.33 0.00 0.00 177.39 177.03 3gz4 h LEU 134 N 0.71 0.71 0.12 2.23 3.38 -1.32 -2.21 115.31 118.93 3gz4 h LEU 134 Ca 0.00 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.72 3gz4 h LEU 134 Cb 0.18 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3gz4 h LEU 134 CO 0.00 0.93 -0.19 1.55 0.09 0.00 0.00 178.44 180.83 3gz4 h PRO 135 N 0.61 -0.35 -0.80 1.13 0.13 -1.83 -0.29 132.00 130.59 3gz4 h PRO 135 Ca 0.08 0.02 0.11 0.00 -0.87 0.00 0.00 66.00 65.35 3gz4 h PRO 135 Cb 0.73 0.08 -0.06 0.00 0.13 0.00 0.00 31.00 31.89 3gz4 h PRO 135 CO 0.06 -0.23 0.52 -0.07 -0.23 0.00 0.00 178.00 178.05 3gz4 h LEU 136 N -0.37 0.61 -0.61 1.56 3.38 -1.85 -1.40 115.31 116.64 3gz4 h LEU 136 Ca 0.02 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 3gz4 h LEU 136 Cb 0.38 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3gz4 h LEU 136 CO -0.09 0.35 -0.25 -0.07 0.09 0.00 0.00 178.44 178.46 3gz4 h LEU 137 N 0.67 0.86 -1.88 1.67 3.38 -0.94 -1.79 115.31 117.27 3gz4 h LEU 137 Ca 0.38 -0.33 0.06 0.00 0.09 0.00 0.00 57.88 58.08 3gz4 h LEU 137 Cb 0.56 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3gz4 h LEU 137 CO -0.15 1.06 0.21 -0.07 0.09 0.00 0.00 178.44 179.58 3gz4 h LEU 138 N 0.72 0.13 0.00 1.67 3.38 0.05 -1.64 115.31 119.62 3gz4 h LEU 138 Ca 0.09 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3gz4 h LEU 138 Cb 0.79 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.51 3gz4 h LEU 138 CO 0.07 0.09 0.00 0.29 0.09 0.00 0.00 178.44 178.97 3gz4 n LYS 139 N -4.48 0.17 -2.31 1.13 5.02 -0.99 -4.79 118.16 111.91 3gz4 n LYS 139 Ca 0.03 0.17 -0.29 0.00 -2.02 0.00 0.00 58.31 56.20 3gz4 n LYS 139 Cb 0.27 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 3gz4 n LYS 139 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3gz4 s SER 140 N -2.64 6.27 0.18 4.39 0.15 -0.62 -4.88 113.70 116.54 3gz4 s SER 140 Ca 0.13 1.16 0.09 0.00 0.70 0.00 0.00 55.95 58.02 3gz4 s SER 140 Cb 0.10 -2.35 -0.02 0.00 -1.71 0.00 0.00 66.02 62.04 3gz4 s SER 140 CO 0.23 -0.70 1.39 -2.24 1.20 0.00 0.00 173.24 173.12 3gz4 h ASP 141 N 0.04 0.00 -0.25 5.45 3.04 -1.88 -3.38 116.42 119.45 3gz4 h ASP 141 Ca -0.46 0.00 -0.21 0.00 -3.24 0.00 0.00 57.03 53.12 3gz4 h ASP 141 Cb 1.20 0.00 -0.30 0.00 -1.04 0.00 0.00 39.33 39.19 3gz4 h ASP 141 CO 0.62 0.85 -0.76 0.00 -2.04 0.00 0.00 179.24 177.91 3gz4 n ALA 142 N -2.36 2.72 -1.04 4.15 0.00 -1.26 -5.08 120.51 117.64 3gz4 n ALA 142 Ca -0.00 -2.02 -0.34 0.00 0.00 0.00 0.00 53.44 51.08 3gz4 n ALA 142 Cb 0.83 -0.85 -0.01 0.00 0.00 0.00 0.00 19.45 19.42 3gz4 n ALA 142 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gz4 n GLY 143 N -0.99 -1.98 2.99 0.00 0.00 -1.26 -4.71 105.19 99.24 3gz4 n GLY 143 Ca -0.03 0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 3gz4 n GLY 143 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3gz4 s SER 144 N -0.79 2.32 -0.20 1.61 0.15 0.91 -2.00 113.70 115.70 3gz4 s SER 144 Ca 0.47 -0.38 -0.04 0.00 0.70 0.00 0.00 55.95 56.70 3gz4 s SER 144 Cb -0.55 -0.99 -0.02 0.00 -1.71 0.00 0.00 66.02 62.75 3gz4 s SER 144 CO 0.48 -0.05 -0.03 -0.22 1.20 0.00 0.00 173.24 174.62 3gz4 s LEU 145 N 1.35 3.03 -0.08 3.45 2.96 0.77 0.32 118.68 130.48 3gz4 s LEU 145 Ca -0.00 -0.31 0.03 0.00 -0.22 0.00 0.00 54.13 53.63 3gz4 s LEU 145 Cb -0.14 -1.76 0.01 0.00 0.50 0.00 0.00 46.19 44.80 3gz4 s LEU 145 CO -0.06 0.03 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.14 3gz4 s VAL 146 N 1.19 1.50 0.33 1.68 1.01 -0.13 -1.11 120.40 124.87 3gz4 s VAL 146 Ca 0.03 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 61.38 3gz4 s VAL 146 Cb -0.14 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 34.88 3gz4 s VAL 146 CO -0.00 0.44 0.34 -0.36 0.00 0.00 0.00 175.10 175.51 3gz4 s PHE 147 N 0.53 2.98 -0.16 5.22 0.08 -0.30 -1.71 117.98 124.62 3gz4 s PHE 147 Ca -0.16 -0.27 -0.01 0.00 0.12 0.00 0.00 56.93 56.61 3gz4 s PHE 147 Cb -0.17 -1.83 -0.01 0.00 -0.57 0.00 0.00 43.02 40.44 3gz4 s PHE 147 CO 0.06 0.15 -0.13 0.99 -0.10 0.00 0.00 175.22 176.19 3gz4 s THR 148 N -2.26 2.89 0.00 0.64 2.01 -1.18 0.52 115.64 118.27 3gz4 s THR 148 Ca 0.42 -0.69 0.00 0.00 0.31 0.00 0.00 61.69 61.72 3gz4 s THR 148 Cb -0.07 -2.24 0.00 0.00 0.01 0.00 0.00 72.50 70.21 3gz4 s THR 148 CO 0.28 0.51 0.00 -0.24 -0.69 0.00 0.00 174.62 174.47 3gz4 n SER 149 N 4.00 1.04 -3.72 3.53 2.88 0.19 -4.91 113.62 116.63 3gz4 n SER 149 Ca -0.19 -0.18 -0.11 0.00 -1.33 0.00 0.00 58.87 57.06 3gz4 n SER 149 Cb 0.52 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.92 3gz4 n SER 149 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3gz4 s SER 150 N -0.15 -0.13 0.62 -3.46 0.15 -1.26 -4.36 113.70 105.11 3gz4 s SER 150 Ca 0.00 -0.33 0.34 0.00 0.70 0.00 0.00 55.95 56.66 3gz4 s SER 150 Cb 0.00 0.41 1.95 0.00 -1.71 0.00 0.00 66.02 66.66 3gz4 s SER 150 CO 0.00 -0.74 2.22 0.77 1.20 0.00 0.00 173.24 176.69 3gz4 h SER 151 N 2.75 0.00 -0.07 5.45 4.64 -1.95 0.52 113.55 124.89 3gz4 h SER 151 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3gz4 h SER 151 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3gz4 h SER 151 CO 0.49 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.78 3gz4 n VAL 152 N -3.53 0.08 1.14 0.95 0.24 -1.26 -2.14 118.33 113.81 3gz4 n VAL 152 Ca -0.02 -0.16 0.13 0.00 -2.04 0.00 0.00 64.34 62.25 3gz4 n VAL 152 Cb 0.17 0.02 0.39 0.00 -1.47 0.00 0.00 33.84 32.95 3gz4 n VAL 152 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3gz4 n GLY 153 N 0.98 -1.03 0.00 7.63 0.00 0.18 -3.96 105.19 108.99 3gz4 n GLY 153 Ca 0.16 -0.33 0.03 0.00 0.00 0.00 0.00 46.02 45.89 3gz4 n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gz4 n ARG 154 N -1.15 0.22 -3.18 1.61 3.00 -1.06 -3.57 116.66 112.52 3gz4 n ARG 154 Ca 0.09 -0.06 0.01 0.00 -0.01 0.00 0.00 57.85 57.88 3gz4 n ARG 154 Cb 0.33 -1.16 -0.01 0.00 0.00 0.00 0.00 32.46 31.61 3gz4 n ARG 154 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 3gz4 s GLN 155 N -2.48 0.54 0.38 5.56 2.00 -0.91 -5.13 119.66 119.62 3gz4 s GLN 155 Ca -0.03 0.44 -0.28 0.00 -2.00 0.00 0.00 55.36 53.50 3gz4 s GLN 155 Cb 0.04 0.14 -0.11 0.00 0.80 0.00 0.00 33.01 33.89 3gz4 s GLN 155 CO 0.29 -1.05 1.48 0.20 -0.50 0.00 0.00 175.29 175.70 3gz4 s GLY 156 N 2.74 2.94 0.34 2.59 0.00 -1.25 -4.19 107.32 110.48 3gz4 s GLY 156 Ca 0.10 1.56 0.03 0.00 0.00 0.00 0.00 44.72 46.41 3gz4 s GLY 156 CO -0.26 2.24 0.13 0.50 0.00 0.00 0.00 173.10 175.70 3gz4 s ARG 157 N -2.13 1.69 0.35 2.90 1.81 -1.26 -5.08 118.95 117.23 3gz4 s ARG 157 Ca 0.54 -1.98 -0.29 0.00 -1.72 0.00 0.00 55.73 52.28 3gz4 s ARG 157 Cb -0.46 -0.41 -0.11 0.00 -0.45 0.00 0.00 34.95 33.52 3gz4 s ARG 157 CO 0.62 -0.40 1.52 0.00 -0.68 0.00 0.00 175.30 176.37 3gz4 s ALA 158 N -3.44 3.64 0.00 2.13 0.00 -1.26 -3.18 121.76 119.64 3gz4 s ALA 158 Ca 0.32 1.57 0.00 0.00 0.00 0.00 0.00 51.96 53.85 3gz4 s ALA 158 Cb 0.05 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.55 3gz4 s ALA 158 CO 0.16 -1.03 0.00 0.09 0.00 0.00 0.00 175.76 174.98 3gz4 n ASN 159 N 1.09 0.00 -0.02 0.00 5.03 -1.26 -4.87 115.26 115.23 3gz4 n ASN 159 Ca 0.04 0.00 0.13 0.00 0.87 0.00 0.00 54.58 55.61 3gz4 n ASN 159 Cb 0.39 0.00 0.39 0.00 -1.02 0.00 0.00 39.78 39.54 3gz4 n ASN 159 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 3gz4 n TRP 160 N -2.00 0.00 0.00 3.10 7.02 -1.19 -1.44 117.44 122.93 3gz4 n TRP 160 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 3gz4 n TRP 160 Cb 0.00 -0.32 0.00 0.00 -2.42 0.00 0.00 31.31 28.57 3gz4 n TRP 160 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3gz4 n GLY 161 N 1.48 1.50 0.37 6.99 0.00 -1.26 -1.92 105.19 112.35 3gz4 n GLY 161 Ca 0.07 0.27 0.02 0.00 0.00 0.00 0.00 46.02 46.38 3gz4 n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gz4 h ALA 162 N 0.00 1.38 -0.27 4.61 0.00 -1.90 -2.28 119.26 120.80 3gz4 h ALA 162 Ca 0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 3gz4 h ALA 162 Cb 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 3gz4 h ALA 162 CO 0.00 0.50 -0.48 -0.92 0.00 0.00 0.00 179.25 178.34 3gz4 h TYR 163 N 1.22 0.91 -0.30 0.00 3.20 -1.58 0.37 116.97 120.79 3gz4 h TYR 163 Ca 0.41 -0.30 -0.07 0.00 3.14 0.00 0.00 58.73 61.92 3gz4 h TYR 163 Cb 0.09 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 3gz4 h TYR 163 CO -0.00 1.08 -0.07 0.00 -1.64 0.00 0.00 178.16 177.52 3gz4 h ALA 164 N 0.87 0.41 -0.89 1.82 0.00 -1.36 -1.71 119.26 118.41 3gz4 h ALA 164 Ca 0.03 -0.28 0.08 0.00 0.00 0.00 0.00 54.91 54.74 3gz4 h ALA 164 Cb 1.05 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.66 3gz4 h ALA 164 CO 0.10 0.23 0.54 0.00 0.00 0.00 0.00 179.25 180.12 3gz4 h ALA 165 N 0.79 1.26 -0.00 0.00 0.00 -1.16 -2.15 119.26 118.00 3gz4 h ALA 165 Ca 0.07 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 3gz4 h ALA 165 Cb 0.55 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3gz4 h ALA 165 CO 0.03 0.22 -0.68 0.66 0.00 0.00 0.00 179.25 179.48 3gz4 h SER 166 N 0.93 0.01 0.54 0.00 4.64 -0.06 -2.30 113.55 117.32 3gz4 h SER 166 Ca 0.41 -0.01 -0.28 0.00 -0.47 0.00 0.00 61.79 61.44 3gz4 h SER 166 Cb 0.29 -0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.39 3gz4 h SER 166 CO -0.22 0.69 -1.26 0.11 -0.87 0.00 0.00 176.83 175.29 3gz4 h LYS 167 N 0.01 0.34 -0.10 4.77 1.79 -1.08 -2.00 116.57 120.29 3gz4 h LYS 167 Ca -0.01 -0.55 0.03 0.00 -2.18 0.00 0.00 60.65 57.94 3gz4 h LYS 167 Cb 1.21 0.20 -0.03 0.00 -1.58 0.00 0.00 32.23 32.03 3gz4 h LYS 167 CO 0.09 1.25 -0.07 0.74 -1.08 0.00 0.00 179.45 180.38 3gz4 h PHE 168 N 0.10 -0.16 0.00 -1.35 -1.00 -1.40 -0.12 116.94 113.01 3gz4 h PHE 168 Ca -0.15 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.64 3gz4 h PHE 168 Cb 1.97 0.09 0.00 0.00 3.61 0.00 0.00 35.95 41.62 3gz4 h PHE 168 CO 0.08 -0.11 0.00 0.00 -1.61 0.00 0.00 178.31 176.67 3gz4 h ALA 169 N 1.02 1.00 0.09 2.45 0.00 -1.34 0.49 119.26 122.96 3gz4 h ALA 169 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 3gz4 h ALA 169 Cb 0.16 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.96 3gz4 h ALA 169 CO -0.15 0.00 -0.67 1.15 0.00 0.00 0.00 179.25 179.59 3gz4 h THR 170 N 0.00 1.51 0.30 0.00 2.02 -0.76 -1.25 112.91 114.72 3gz4 h THR 170 Ca 0.00 -2.44 -0.01 0.00 0.77 0.00 0.00 66.41 64.72 3gz4 h THR 170 Cb 0.01 3.15 0.00 0.00 -1.74 0.00 0.00 68.15 69.57 3gz4 h THR 170 CO 0.00 0.66 -0.15 -0.33 0.37 0.00 0.00 175.52 176.07 3gz4 h GLU 171 N -0.59 -0.40 -0.80 6.66 4.39 -0.01 -1.22 114.58 122.60 3gz4 h GLU 171 Ca -0.13 0.03 0.10 0.00 0.34 0.00 0.00 59.36 59.70 3gz4 h GLU 171 Cb 1.44 0.09 -0.12 0.00 -0.10 0.00 0.00 28.75 30.06 3gz4 h GLU 171 CO 0.07 -0.27 -0.49 0.78 -1.16 0.00 0.00 179.01 177.95 3gz4 h GLY 172 N -0.42 -0.50 0.27 -3.84 0.00 -1.06 -1.39 103.07 96.13 3gz4 h GLY 172 Ca -0.04 0.65 0.02 0.00 0.00 0.00 0.00 47.33 47.96 3gz4 h GLY 172 CO 0.06 -0.10 -0.40 1.98 0.00 0.00 0.00 176.54 178.08 3gz4 h MET 173 N -0.11 -0.59 -0.91 4.80 1.85 -1.00 -1.83 114.93 117.14 3gz4 h MET 173 Ca 0.20 0.04 0.24 0.00 -0.61 0.00 0.00 59.70 59.58 3gz4 h MET 173 Cb 0.53 0.13 -0.14 0.00 0.43 0.00 0.00 31.60 32.55 3gz4 h MET 173 CO -0.84 -0.39 0.36 1.98 -0.40 0.00 0.00 176.91 177.62 3gz4 h MET 174 N -0.61 0.30 -0.24 0.39 -1.53 -0.69 -1.02 114.93 111.53 3gz4 h MET 174 Ca 0.03 -0.02 -0.09 0.00 -3.44 0.00 0.00 59.70 56.18 3gz4 h MET 174 Cb 0.66 -0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.62 3gz4 h MET 174 CO -0.25 0.20 -0.26 1.96 0.14 0.00 0.00 176.91 178.70 3gz4 h GLN 175 N 0.31 0.46 0.00 0.39 4.20 -0.42 0.22 115.11 120.27 3gz4 h GLN 175 Ca 0.59 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 59.12 3gz4 h GLN 175 Cb 1.19 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.94 3gz4 h GLN 175 CO -0.59 0.68 0.00 0.28 -0.67 0.00 0.00 178.83 178.53 3gz4 n VAL 176 N -4.12 0.00 -0.27 -0.54 0.31 -0.41 -0.86 118.33 112.43 3gz4 n VAL 176 Ca -0.00 1.26 0.22 0.00 -0.01 0.00 0.00 64.34 65.81 3gz4 n VAL 176 Cb 0.41 -2.24 0.42 0.00 -0.91 0.00 0.00 33.84 31.51 3gz4 n VAL 176 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3gz4 n LEU 177 N -1.76 0.18 -0.14 7.52 4.77 -1.05 0.82 117.00 127.35 3gz4 n LEU 177 Ca 0.00 1.38 -0.05 0.00 -0.03 0.00 0.00 56.01 57.31 3gz4 n LEU 177 Cb 0.00 -0.62 0.13 0.00 -2.33 0.00 0.00 43.42 40.59 3gz4 n LEU 177 CO 0.00 -1.50 0.87 0.00 -1.33 0.00 0.00 177.39 175.43 3gz4 h ALA 178 N 1.65 1.04 -0.33 -1.18 0.00 -0.34 -2.44 119.26 117.66 3gz4 h ALA 178 Ca 0.65 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 55.18 3gz4 h ALA 178 Cb 1.63 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 3gz4 h ALA 178 CO -0.68 0.60 -0.18 0.22 0.00 0.00 0.00 179.25 179.22 3gz4 h ASP 179 N 0.80 0.73 1.49 0.00 3.58 0.24 -3.13 116.42 120.13 3gz4 h ASP 179 Ca 0.15 -0.41 0.00 0.00 0.42 0.00 0.00 57.03 57.19 3gz4 h ASP 179 Cb 0.47 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.32 3gz4 h ASP 179 CO 0.02 0.98 0.00 -0.33 -2.88 0.00 0.00 179.24 177.03 3gz4 h GLU 180 N 0.47 0.00 0.00 0.28 5.08 -1.06 -3.33 114.58 116.02 3gz4 h GLU 180 Ca 0.07 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3gz4 h GLU 180 Cb 0.72 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3gz4 h GLU 180 CO 0.05 0.00 -0.17 0.66 -1.00 0.00 0.00 179.01 178.55 3gz4 n TYR 181 N -2.98 0.00 -1.62 4.33 4.02 -0.93 -4.98 117.16 115.00 3gz4 n TYR 181 Ca 0.03 -1.09 -0.47 0.00 -0.01 0.00 0.00 57.90 56.35 3gz4 n TYR 181 Cb 0.41 -0.17 -0.04 0.00 -0.02 0.00 0.00 39.34 39.52 3gz4 n TYR 181 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3gz4 n GLN 182 N -1.27 1.57 -0.52 -0.72 6.02 -1.18 0.68 117.38 121.97 3gz4 n GLN 182 Ca 0.16 0.56 0.00 0.00 -0.01 0.00 0.00 57.00 57.71 3gz4 n GLN 182 Cb 0.66 -2.15 0.00 0.00 1.02 0.00 0.00 30.24 29.78 3gz4 n GLN 182 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3gz4 n GLN 183 N 2.04 0.00 -0.08 -1.09 6.02 -1.26 -4.68 117.38 118.32 3gz4 n GLN 183 Ca 0.14 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.96 3gz4 n GLN 183 Cb 0.27 -4.35 -0.06 0.00 1.02 0.00 0.00 30.24 27.12 3gz4 n GLN 183 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3gz4 n ARG 184 N -2.00 0.34 -4.20 -1.09 1.74 0.58 -5.07 116.66 106.96 3gz4 n ARG 184 Ca 0.00 0.14 -0.19 0.00 -0.77 0.00 0.00 57.85 57.03 3gz4 n ARG 184 Cb 0.00 -1.08 -0.12 0.00 -1.02 0.00 0.00 32.46 30.24 3gz4 n ARG 184 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3gz4 s LEU 185 N -6.80 2.27 -0.10 0.55 1.43 0.22 -4.67 118.68 111.58 3gz4 s LEU 185 Ca -0.22 -0.61 -0.25 0.00 -1.03 0.00 0.00 54.13 52.01 3gz4 s LEU 185 Cb 0.08 -0.56 -0.03 0.00 0.03 0.00 0.00 46.19 45.72 3gz4 s LEU 185 CO 0.28 -0.05 0.80 -0.13 0.23 0.00 0.00 176.35 177.48 3gz4 s ARG 186 N -1.72 4.40 -0.26 1.70 0.52 -0.85 -4.55 118.95 118.19 3gz4 s ARG 186 Ca -0.01 1.02 -0.03 0.00 -0.52 0.00 0.00 55.73 56.19 3gz4 s ARG 186 Cb -0.10 -3.50 0.09 0.00 0.52 0.00 0.00 34.95 31.96 3gz4 s ARG 186 CO 0.02 -0.12 0.10 0.08 0.02 0.00 0.00 175.30 175.40 3gz4 s VAL 187 N 1.39 0.30 0.42 3.52 1.01 -1.25 -0.16 120.40 125.62 3gz4 s VAL 187 Ca 0.40 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.62 3gz4 s VAL 187 Cb -0.18 -1.12 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 3gz4 s VAL 187 CO 0.17 -0.55 0.14 0.20 0.00 0.00 0.00 175.10 175.07 3gz4 s ASN 188 N 1.93 2.84 0.09 3.32 0.01 -0.27 -0.87 114.94 121.99 3gz4 s ASN 188 Ca 0.06 -1.71 0.08 0.00 -0.71 0.00 0.00 52.86 50.58 3gz4 s ASN 188 Cb -0.17 0.56 -0.03 0.00 0.41 0.00 0.00 41.25 42.02 3gz4 s ASN 188 CO -0.24 -0.97 -0.20 0.00 -1.51 0.00 0.00 177.10 174.18 3gz4 s ILE 190 N -1.11 3.86 -0.45 0.00 1.01 0.19 -0.90 121.20 123.79 3gz4 s ILE 190 Ca 0.06 -0.38 -0.16 0.00 0.00 0.00 0.00 60.65 60.16 3gz4 s ILE 190 Cb -0.10 -2.66 0.05 0.00 0.01 0.00 0.00 42.46 39.76 3gz4 s ILE 190 CO 0.04 0.53 0.40 0.21 0.00 0.00 0.00 174.94 176.11 3gz4 s ASN 191 N 0.01 6.15 0.38 3.58 2.47 0.27 0.56 114.94 128.36 3gz4 s ASN 191 Ca 0.00 -1.09 0.05 0.00 0.42 0.00 0.00 52.86 52.24 3gz4 s ASN 191 Cb -0.13 -2.19 0.75 0.00 -1.45 0.00 0.00 41.25 38.22 3gz4 s ASN 191 CO 0.03 -0.61 2.02 -0.65 -3.72 0.00 0.00 177.10 174.17 3gz4 h PRO 192 N 8.74 0.65 0.00 0.43 0.11 -1.84 0.19 132.00 140.28 3gz4 h PRO 192 Ca -0.28 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3gz4 h PRO 192 Cb 1.11 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3gz4 h PRO 192 CO 0.84 0.45 0.00 0.41 -0.21 0.00 0.00 178.00 179.49 3gz4 n GLY 193 N -1.40 -0.56 3.69 -0.55 0.00 -1.26 -3.86 105.19 101.26 3gz4 n GLY 193 Ca 0.04 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 3gz4 n GLY 193 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gz4 s GLY 194 N -1.53 1.74 0.03 -0.02 0.00 -1.26 -5.00 107.32 101.29 3gz4 s GLY 194 Ca 0.00 1.03 0.04 0.00 0.00 0.00 0.00 44.72 45.79 3gz4 s GLY 194 CO 0.00 2.64 -0.13 -1.59 0.00 0.00 0.00 173.10 174.02 3gz4 s THR 195 N 2.39 1.04 -0.97 0.90 2.01 -1.26 -4.27 115.64 115.47 3gz4 s THR 195 Ca 0.68 -0.93 -0.24 0.00 0.31 0.00 0.00 61.69 61.51 3gz4 s THR 195 Cb -0.35 -0.94 -0.01 0.00 0.01 0.00 0.00 72.50 71.21 3gz4 s THR 195 CO 0.29 0.01 1.78 -0.60 -0.69 0.00 0.00 174.62 175.41 3gz4 s ARG 196 N -1.04 2.94 0.33 4.92 3.52 -0.00 -4.68 118.95 124.93 3gz4 s ARG 196 Ca 0.01 -0.67 0.07 0.00 -0.13 0.00 0.00 55.73 55.01 3gz4 s ARG 196 Cb -0.07 -5.19 -0.03 0.00 -1.56 0.00 0.00 34.95 28.10 3gz4 s ARG 196 CO 0.01 -2.99 0.27 0.95 -0.81 0.00 0.00 175.30 172.73 3gz4 s THR 197 N 8.27 0.01 0.09 4.11 -4.23 -1.26 -4.51 115.64 118.11 3gz4 s THR 197 Ca 0.62 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 59.16 3gz4 s THR 197 Cb -0.04 -2.50 -0.24 0.00 1.34 0.00 0.00 72.50 71.07 3gz4 s THR 197 CO -0.03 0.00 1.17 0.00 -0.54 0.00 0.00 174.62 175.22 3gz4 h ALA 198 N 2.15 0.29 -0.13 3.99 0.00 -1.99 -2.95 119.26 120.62 3gz4 h ALA 198 Ca -0.25 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 53.71 3gz4 h ALA 198 Cb 1.23 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 3gz4 h ALA 198 CO 0.37 1.18 0.07 1.98 0.00 0.00 0.00 179.25 182.85 3gz4 h MET 199 N 0.03 0.15 -0.18 0.00 1.85 -1.98 -0.50 114.93 114.29 3gz4 h MET 199 Ca -0.08 -0.01 0.05 0.00 -0.61 0.00 0.00 59.70 59.05 3gz4 h MET 199 Cb 1.86 -0.03 -0.06 0.00 0.43 0.00 0.00 31.60 33.80 3gz4 h MET 199 CO 0.15 0.10 -0.21 -0.09 -0.40 0.00 0.00 176.91 176.46 3gz4 h ARG 200 N 0.15 -0.23 -0.71 0.39 9.65 -1.83 -2.41 114.38 119.39 3gz4 h ARG 200 Ca 0.05 0.02 0.09 0.00 -1.10 0.00 0.00 59.98 59.03 3gz4 h ARG 200 Cb -0.00 0.05 -0.07 0.00 -1.39 0.00 0.00 29.97 28.56 3gz4 h ARG 200 CO -0.03 -0.15 0.36 0.00 2.80 0.00 0.00 179.97 182.96 3gz4 h ALA 201 N 0.81 0.98 -0.99 2.80 0.00 -1.31 0.23 119.26 121.79 3gz4 h ALA 201 Ca 0.12 0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.22 3gz4 h ALA 201 Cb 0.41 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.05 3gz4 h ALA 201 CO -0.32 -0.03 0.62 0.77 0.00 0.00 0.00 179.25 180.29 3gz4 h SER 202 N 0.62 0.84 0.93 0.00 0.02 -0.60 -1.20 113.55 114.17 3gz4 h SER 202 Ca 0.35 0.06 -0.22 0.00 -0.84 0.00 0.00 61.79 61.14 3gz4 h SER 202 Cb 0.34 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 3gz4 h SER 202 CO -0.26 0.40 -1.07 0.00 -1.14 0.00 0.00 176.83 174.77 3gz4 h ALA 203 N 1.58 0.34 -2.09 3.77 0.00 -0.82 -3.38 119.26 118.66 3gz4 h ALA 203 Ca 0.52 -0.94 -0.56 0.00 0.00 0.00 0.00 54.91 53.93 3gz4 h ALA 203 Cb 0.67 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 17.95 3gz4 h ALA 203 CO -0.29 1.24 -0.93 1.19 0.00 0.00 0.00 179.25 180.45 3gz4 n PHE 204 N -3.36 1.39 0.11 0.00 3.72 -0.09 -4.97 117.46 114.26 3gz4 n PHE 204 Ca -0.02 -3.83 0.18 0.00 -0.05 0.00 0.00 57.45 53.74 3gz4 n PHE 204 Cb 0.96 -0.44 0.75 0.00 -0.94 0.00 0.00 39.48 39.81 3gz4 n PHE 204 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3gz4 h PRO 205 N 3.71 0.00 0.04 -1.08 0.13 -1.43 -1.92 132.00 131.45 3gz4 h PRO 205 Ca 0.12 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.98 3gz4 h PRO 205 Cb 0.79 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.89 3gz4 h PRO 205 CO 0.62 0.00 -1.41 1.79 -0.23 0.00 0.00 178.00 178.77 3gz4 h THR 206 N 0.00 1.24 -1.88 1.56 1.35 -1.93 -3.47 112.91 109.78 3gz4 h THR 206 Ca 0.16 -2.99 -0.64 0.00 -0.55 0.00 0.00 66.41 62.39 3gz4 h THR 206 Cb 0.77 2.67 0.10 0.00 -1.73 0.00 0.00 68.15 69.96 3gz4 h THR 206 CO -0.00 0.76 0.01 1.21 -0.25 0.00 0.00 175.52 177.25 3gz4 n GLU 207 N -3.28 0.90 -2.85 4.72 2.13 -0.72 -4.93 120.64 116.62 3gz4 n GLU 207 Ca -0.11 0.32 -0.43 0.00 0.66 0.00 0.00 57.16 57.60 3gz4 n GLU 207 Cb 1.01 -1.65 -0.04 0.00 0.27 0.00 0.00 31.44 31.03 3gz4 n GLU 207 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3gz4 s ASP 208 N -0.46 6.59 0.18 4.31 2.15 -1.26 -4.92 116.67 123.25 3gz4 s ASP 208 Ca 0.66 0.38 0.17 0.00 0.43 0.00 0.00 52.55 54.19 3gz4 s ASP 208 Cb -0.83 -2.44 0.80 0.00 -0.30 0.00 0.00 42.92 40.14 3gz4 s ASP 208 CO 0.56 -0.88 1.54 -2.65 -0.17 0.00 0.00 175.17 173.57 3gz4 n PRO 209 N 6.80 0.11 0.00 4.34 -0.02 -1.26 -0.94 135.00 144.02 3gz4 n PRO 209 Ca 0.06 0.45 0.15 0.00 -2.02 0.00 0.00 63.50 62.13 3gz4 n PRO 209 Cb 0.48 -1.75 0.70 0.00 -0.02 0.00 0.00 33.50 32.90 3gz4 n PRO 209 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3gz4 n GLN 210 N -1.97 0.79 0.00 -0.52 1.13 -1.26 -2.89 117.38 112.66 3gz4 n GLN 210 Ca 0.01 -0.21 0.12 0.00 -1.94 0.00 0.00 57.00 54.98 3gz4 n GLN 210 Cb 0.13 -1.50 0.16 0.00 0.11 0.00 0.00 30.24 29.15 3gz4 n GLN 210 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3gz4 n LYS 211 N -0.92 0.32 -3.43 -1.09 5.02 -0.12 -4.92 118.16 113.02 3gz4 n LYS 211 Ca 0.17 -0.22 -0.27 0.00 -2.02 0.00 0.00 58.31 55.97 3gz4 n LYS 211 Cb 0.24 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.73 3gz4 n LYS 211 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3gz4 s LEU 212 N -2.83 4.08 0.52 -0.35 1.43 -1.14 -5.10 118.68 115.29 3gz4 s LEU 212 Ca 0.14 0.56 -0.20 0.00 -1.03 0.00 0.00 54.13 53.61 3gz4 s LEU 212 Cb 0.18 -3.38 -0.07 0.00 0.03 0.00 0.00 46.19 42.95 3gz4 s LEU 212 CO 0.69 -0.19 1.08 -0.54 0.23 0.00 0.00 176.35 177.61 3gz4 s LYS 213 N -3.73 3.56 0.62 1.70 1.02 -1.26 -4.77 119.74 116.87 3gz4 s LYS 213 Ca 0.41 1.46 -0.06 0.00 0.02 0.00 0.00 55.97 57.81 3gz4 s LYS 213 Cb -0.10 -2.05 0.02 0.00 -0.52 0.00 0.00 37.83 35.18 3gz4 s LYS 213 CO 0.32 -0.65 0.93 0.95 -0.92 0.00 0.00 175.35 175.97 3gz4 s THR 214 N -1.92 3.32 0.29 2.17 -4.23 -1.26 -0.82 115.64 113.19 3gz4 s THR 214 Ca 0.69 -0.07 0.04 0.00 -1.18 0.00 0.00 61.69 61.18 3gz4 s THR 214 Cb -0.20 -3.34 0.30 0.00 1.34 0.00 0.00 72.50 70.60 3gz4 s THR 214 CO 0.24 -0.35 1.68 -0.65 -0.54 0.00 0.00 174.62 175.00 3gz4 h PRO 215 N -0.27 0.33 0.00 3.99 0.11 -1.92 -1.49 132.00 132.75 3gz4 h PRO 215 Ca -0.45 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.56 3gz4 h PRO 215 Cb 1.27 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 3gz4 h PRO 215 CO 0.60 0.22 -0.37 0.00 -0.21 0.00 0.00 178.00 178.24 3gz4 h ALA 216 N 1.74 1.20 0.00 -0.75 0.00 -1.95 -2.57 119.26 116.93 3gz4 h ALA 216 Ca 0.57 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 3gz4 h ALA 216 Cb 1.13 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 3gz4 h ALA 216 CO -0.57 0.46 -0.22 -0.44 0.00 0.00 0.00 179.25 178.48 3gz4 h ASP 217 N 0.00 0.00 -0.59 0.00 3.32 -1.63 -3.19 116.42 114.32 3gz4 h ASP 217 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gz4 h ASP 217 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3gz4 h ASP 217 CO 0.05 0.22 0.00 2.30 -1.72 0.00 0.00 179.24 180.08 3gz4 n ILE 218 N -4.15 0.92 0.22 0.35 -5.35 -0.97 -4.64 119.36 105.73 3gz4 n ILE 218 Ca -0.02 -0.96 0.09 0.00 -0.27 0.00 0.00 62.75 61.59 3gz4 n ILE 218 Cb 0.28 0.57 0.44 0.00 -1.74 0.00 0.00 39.64 39.20 3gz4 n ILE 218 CO 0.00 0.00 0.00 0.24 -1.76 0.00 0.00 176.55 175.03 3gz4 h MET 219 N 3.75 0.00 -0.75 6.28 2.86 -1.54 -3.33 114.93 122.21 3gz4 h MET 219 Ca 0.00 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.71 3gz4 h MET 219 Cb 0.92 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 32.49 3gz4 h MET 219 CO 0.00 0.25 -0.49 -1.35 1.06 0.00 0.00 176.91 176.38 3gz4 h PRO 220 N 0.00 -0.06 -0.43 -0.22 0.11 -1.85 -0.69 132.00 128.85 3gz4 h PRO 220 Ca -0.00 0.00 0.09 0.00 0.11 0.00 0.00 66.00 66.20 3gz4 h PRO 220 Cb 0.76 0.01 -0.08 0.00 0.11 0.00 0.00 31.00 31.80 3gz4 h PRO 220 CO 0.03 -0.04 -0.13 1.25 -0.21 0.00 0.00 178.00 178.90 3gz4 h LEU 221 N -0.07 -0.47 -1.96 2.35 5.85 -1.93 1.06 115.31 120.14 3gz4 h LEU 221 Ca 0.12 0.14 0.27 0.00 0.84 0.00 0.00 57.88 59.25 3gz4 h LEU 221 Cb 0.38 0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.66 3gz4 h LEU 221 CO -0.74 -0.17 0.71 1.88 -0.34 0.00 0.00 178.44 179.79 3gz4 h TYR 222 N -0.03 0.00 0.00 1.25 -1.99 -1.54 -1.62 116.97 113.03 3gz4 h TYR 222 Ca 0.21 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.74 3gz4 h TYR 222 Cb 0.35 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.05 3gz4 h TYR 222 CO -0.40 0.00 -1.33 1.28 -0.00 0.00 0.00 178.16 177.72 3gz4 n LEU 223 N -4.13 1.88 -0.28 3.88 4.77 0.13 -4.08 117.00 119.16 3gz4 n LEU 223 Ca 0.20 0.45 0.20 0.00 -0.03 0.00 0.00 56.01 56.83 3gz4 n LEU 223 Cb 1.04 -0.89 0.38 0.00 -2.33 0.00 0.00 43.42 41.62 3gz4 n LEU 223 CO 0.37 0.10 0.79 1.87 -1.33 0.00 0.00 177.39 179.20 3gz4 n TRP 224 N -4.44 0.77 0.29 -1.77 -0.00 0.32 -1.90 117.44 110.72 3gz4 n TRP 224 Ca -0.29 1.02 0.12 0.00 -0.00 0.00 0.00 57.50 58.35 3gz4 n TRP 224 Cb 0.61 -1.28 0.18 0.00 -0.00 0.00 0.00 31.31 30.81 3gz4 n TRP 224 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 3gz4 h LEU 225 N 0.00 0.00 -0.80 5.87 3.38 -1.47 -3.21 115.31 119.08 3gz4 h LEU 225 Ca 0.62 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.58 3gz4 h LEU 225 Cb 1.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.25 3gz4 h LEU 225 CO -0.73 0.01 -0.28 0.23 0.09 0.00 0.00 178.44 177.76 3gz4 n MET 226 N -2.81 1.15 -3.69 1.13 2.81 -0.80 -4.87 117.12 110.04 3gz4 n MET 226 Ca 0.03 -0.80 -0.20 0.00 -1.81 0.00 0.00 57.70 54.92 3gz4 n MET 226 Cb 0.51 -1.48 -0.04 0.00 -0.71 0.00 0.00 33.22 31.49 3gz4 n MET 226 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gz4 n GLY 227 N 1.35 3.79 0.11 3.03 0.00 -1.17 -4.95 105.19 107.35 3gz4 n GLY 227 Ca 0.12 -2.30 0.12 0.00 0.00 0.00 0.00 46.02 43.96 3gz4 n GLY 227 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gz4 n ASP 228 N -1.21 0.70 0.00 1.61 8.00 -1.26 -3.04 116.55 121.35 3gz4 n ASP 228 Ca -0.13 0.61 0.09 0.00 0.71 0.00 0.00 54.79 56.07 3gz4 n ASP 228 Cb 0.41 -0.78 0.42 0.00 -0.02 0.00 0.00 41.12 41.14 3gz4 n ASP 228 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3gz4 n ASP 229 N -2.20 0.00 -0.02 -2.24 8.00 -1.26 -2.73 116.55 116.09 3gz4 n ASP 229 Ca 0.04 0.46 0.03 0.00 0.71 0.00 0.00 54.79 56.03 3gz4 n ASP 229 Cb 0.34 -0.48 0.04 0.00 -0.02 0.00 0.00 41.12 41.00 3gz4 n ASP 229 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3gz4 n SER 230 N -1.48 2.10 -0.23 -2.24 3.41 -1.17 -4.88 113.62 109.13 3gz4 n SER 230 Ca 0.05 -2.34 0.16 0.00 -0.26 0.00 0.00 58.87 56.48 3gz4 n SER 230 Cb 0.22 -0.14 0.48 0.00 -0.26 0.00 0.00 64.21 64.51 3gz4 n SER 230 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3gz4 h ARG 231 N 0.00 0.46 -0.35 4.33 2.43 -1.68 -1.58 114.38 117.99 3gz4 h ARG 231 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3gz4 h ARG 231 Cb 0.66 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 3gz4 h ARG 231 CO 0.00 0.30 0.00 0.54 -1.51 0.00 0.00 179.97 179.30 3gz4 n ARG 232 N -4.52 2.38 -3.91 0.20 5.12 -1.26 -4.89 116.66 109.79 3gz4 n ARG 232 Ca 0.18 -2.09 -0.35 0.00 -1.93 0.00 0.00 57.85 53.66 3gz4 n ARG 232 Cb 0.60 -1.49 -0.09 0.00 -1.16 0.00 0.00 32.46 30.32 3gz4 n ARG 232 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3gz4 s LYS 233 N -1.55 4.01 0.13 5.56 -0.14 -0.59 -5.08 119.74 122.08 3gz4 s LYS 233 Ca 0.38 -0.29 -0.23 0.00 -1.36 0.00 0.00 55.97 54.47 3gz4 s LYS 233 Cb 0.22 -3.28 0.07 0.00 -1.68 0.00 0.00 37.83 33.16 3gz4 s LYS 233 CO 0.31 0.32 0.58 -0.08 -0.76 0.00 0.00 175.35 175.72 3gz4 s THR 234 N 0.27 0.01 -0.06 2.17 -1.32 -1.26 -4.66 115.64 110.79 3gz4 s THR 234 Ca 0.06 -0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.47 3gz4 s THR 234 Cb -0.12 -1.01 0.00 0.00 -1.51 0.00 0.00 72.50 69.86 3gz4 s THR 234 CO -0.00 -0.04 0.00 0.61 -2.21 0.00 0.00 174.62 172.98 3gz4 n GLY 235 N -0.22 0.47 3.41 6.08 0.00 -0.04 -4.96 105.19 109.92 3gz4 n GLY 235 Ca -0.17 -0.22 -0.28 0.00 0.00 0.00 0.00 46.02 45.35 3gz4 n GLY 235 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3gz4 s MET 236 N -0.69 1.47 -0.17 1.61 1.00 -1.26 -4.91 119.30 116.34 3gz4 s MET 236 Ca 0.00 -1.43 -0.08 0.00 0.00 0.00 0.00 55.69 54.18 3gz4 s MET 236 Cb 0.00 -1.88 -0.04 0.00 0.00 0.00 0.00 34.83 32.91 3gz4 s MET 236 CO 0.00 0.43 0.09 0.99 0.00 0.00 0.00 175.02 176.53 3gz4 s THR 237 N -1.36 5.08 -0.04 2.05 2.01 -1.26 -0.77 115.64 121.35 3gz4 s THR 237 Ca 0.17 0.07 0.06 0.00 0.31 0.00 0.00 61.69 62.30 3gz4 s THR 237 Cb -0.09 -3.28 -0.02 0.00 0.01 0.00 0.00 72.50 69.12 3gz4 s THR 237 CO 0.08 0.49 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.93 3gz4 s PHE 238 N 0.07 2.52 -0.20 4.92 0.08 -0.08 -4.94 117.98 120.35 3gz4 s PHE 238 Ca 0.07 -0.32 -0.20 0.00 0.12 0.00 0.00 56.93 56.60 3gz4 s PHE 238 Cb -0.12 -1.57 -0.03 0.00 -0.57 0.00 0.00 43.02 40.74 3gz4 s PHE 238 CO 0.00 0.06 0.59 -0.51 -0.10 0.00 0.00 175.22 175.26 3gz4 s ASP 239 N -0.64 6.64 0.49 1.36 1.01 -1.26 0.95 116.67 125.22 3gz4 s ASP 239 Ca 0.10 0.77 0.23 0.00 0.71 0.00 0.00 52.55 54.36 3gz4 s ASP 239 Cb -0.10 -2.33 1.28 0.00 1.01 0.00 0.00 42.92 42.78 3gz4 s ASP 239 CO -0.00 -0.24 2.04 0.00 0.21 0.00 0.00 175.17 177.17 3gz4 h ALA 240 N 7.49 1.41 -2.93 5.23 0.00 -0.79 -3.36 119.26 126.31 3gz4 h ALA 240 Ca -0.32 -0.14 -0.61 0.00 0.00 0.00 0.00 54.91 53.84 3gz4 h ALA 240 Cb 1.15 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 18.51 3gz4 h ALA 240 CO 0.76 0.19 -0.72 -0.65 0.00 0.00 0.00 179.25 178.83 3gz4 s GLN 241 N -4.33 1.65 -0.77 0.00 -0.21 -1.25 -4.93 119.66 109.82 3gz4 s GLN 241 Ca -0.03 -2.51 -0.25 0.00 0.02 0.00 0.00 55.36 52.59 3gz4 s GLN 241 Cb 0.14 -2.60 -0.15 0.00 1.00 0.00 0.00 33.01 31.41 3gz4 s GLN 241 CO 0.63 -1.24 2.40 -2.30 -2.12 0.00 0.00 175.29 172.66 3gz4 n PRO 242 N 2.86 0.58 0.00 2.91 -0.02 -1.26 -4.93 135.00 135.14 3gz4 n PRO 242 Ca 0.16 -0.67 0.00 0.00 -2.02 0.00 0.00 63.50 60.97 3gz4 n PRO 242 Cb 0.37 -3.44 0.00 0.00 -0.02 0.00 0.00 33.50 30.41 3gz4 n PRO 242 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89