#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gzi s SER 3 N 0.00 -0.28 0.47 4.31 1.04 -1.26 -5.05 113.70 112.93 2gzi s SER 3 Ca 0.00 0.54 0.17 0.00 0.48 0.00 0.00 55.95 57.14 2gzi s SER 3 Cb 0.00 0.52 1.12 0.00 0.10 0.00 0.00 66.02 67.75 2gzi s SER 3 CO 0.00 -0.11 2.02 0.50 0.98 0.00 0.00 173.24 176.63 2gzi h LYS 4 N 6.04 0.00 0.00 4.02 3.64 -2.00 -2.14 116.57 126.13 2gzi h LYS 4 Ca -0.29 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 2gzi h LYS 4 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2gzi h LYS 4 CO 0.35 0.16 0.00 2.89 -2.27 0.00 0.00 179.45 180.58 2gzi n ARG 5 N -4.20 0.23 -0.09 1.90 1.85 -1.26 -2.95 116.66 112.13 2gzi n ARG 5 Ca -0.02 0.13 0.12 0.00 -1.00 0.00 0.00 57.85 57.07 2gzi n ARG 5 Cb 0.23 -1.50 0.25 0.00 -1.05 0.00 0.00 32.46 30.39 2gzi n ARG 5 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2gzi n ASN 6 N -1.20 2.78 -4.78 2.89 5.03 -0.81 -0.37 115.26 118.80 2gzi n ASN 6 Ca 0.06 -1.89 -0.38 0.00 0.87 0.00 0.00 54.58 53.24 2gzi n ASN 6 Cb 0.08 -0.12 -0.06 0.00 -1.02 0.00 0.00 39.78 38.65 2gzi n ASN 6 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 2gzi s LYS 7 N -1.75 4.14 0.66 3.52 2.20 -1.15 -4.60 119.74 122.76 2gzi s LYS 7 Ca 0.34 0.48 -0.17 0.00 -0.36 0.00 0.00 55.97 56.26 2gzi s LYS 7 Cb 0.21 -3.31 -0.00 0.00 -1.51 0.00 0.00 37.83 33.22 2gzi s LYS 7 CO 0.30 0.47 1.27 -2.14 -0.36 0.00 0.00 175.35 174.89 2gzi s PRO 8 N -0.39 2.47 0.17 4.03 0.02 -1.16 -4.55 135.00 135.59 2gzi s PRO 8 Ca 0.25 2.00 -0.24 0.00 0.02 0.00 0.00 61.00 63.03 2gzi s PRO 8 Cb -0.17 -1.84 0.06 0.00 0.02 0.00 0.00 34.50 32.57 2gzi s PRO 8 CO 0.13 -1.64 0.91 0.20 -0.33 0.00 0.00 177.00 176.27 2gzi s GLY 9 N -1.52 -0.22 -0.12 0.52 0.00 -0.21 -4.98 107.32 100.78 2gzi s GLY 9 Ca 0.81 0.08 -0.05 0.00 0.00 0.00 0.00 44.72 45.56 2gzi s GLY 9 CO 0.40 -0.00 0.05 0.54 0.00 0.00 0.00 173.10 174.10 2gzi s LYS 10 N -3.39 3.42 0.31 2.90 1.02 -1.26 -0.67 119.74 122.06 2gzi s LYS 10 Ca 0.12 -0.32 -0.28 0.00 0.02 0.00 0.00 55.97 55.50 2gzi s LYS 10 Cb -0.02 -3.02 -0.10 0.00 -0.52 0.00 0.00 37.83 34.17 2gzi s LYS 10 CO 0.03 0.58 1.14 0.00 -0.92 0.00 0.00 175.35 176.17 2gzi s ALA 11 N -0.51 3.37 0.24 5.17 0.00 -0.73 -4.78 121.76 124.51 2gzi s ALA 11 Ca 0.10 0.95 0.01 0.00 0.00 0.00 0.00 51.96 53.02 2gzi s ALA 11 Cb -0.12 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 2gzi s ALA 11 CO 0.02 -0.28 0.13 0.95 0.00 0.00 0.00 175.76 176.58 2gzi s THR 12 N -1.23 0.23 0.00 0.00 -4.23 -0.86 -0.76 115.64 108.79 2gzi s THR 12 Ca 0.48 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 2gzi s THR 12 Cb -0.32 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 70.97 2gzi s THR 12 CO 0.42 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.11 2gzi n GLY 13 N -0.39 2.05 0.12 3.99 0.00 -1.26 -0.18 105.19 109.52 2gzi n GLY 13 Ca 0.02 -1.96 -0.16 0.00 0.00 0.00 0.00 46.02 43.91 2gzi n GLY 13 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2gzi n LYS 14 N 1.48 0.69 0.00 1.61 4.81 -1.26 -4.84 118.16 120.65 2gzi n LYS 14 Ca 0.00 0.18 0.00 0.00 -0.87 0.00 0.00 58.31 57.62 2gzi n LYS 14 Cb 0.00 -1.63 0.00 0.00 0.02 0.00 0.00 35.03 33.42 2gzi n LYS 14 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2gzi n GLY 15 N 1.97 -0.76 3.07 3.14 0.00 -1.26 -4.25 105.19 107.09 2gzi n GLY 15 Ca -0.34 -1.10 -0.08 0.00 0.00 0.00 0.00 46.02 44.50 2gzi n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gzi s LYS 16 N 0.00 0.52 0.25 1.61 -0.14 -0.77 -4.60 119.74 116.61 2gzi s LYS 16 Ca 0.00 -0.90 -0.30 0.00 -1.36 0.00 0.00 55.97 53.41 2gzi s LYS 16 Cb 0.00 0.19 -0.10 0.00 -1.68 0.00 0.00 37.83 36.24 2gzi s LYS 16 CO 0.00 -0.11 1.45 -2.14 -0.76 0.00 0.00 175.35 173.79 2gzi s PRO 17 N -2.81 4.26 0.32 -1.68 0.02 -1.26 -0.19 135.00 133.66 2gzi s PRO 17 Ca -0.03 2.32 0.06 0.00 0.02 0.00 0.00 61.00 63.37 2gzi s PRO 17 Cb -0.00 -3.10 -0.06 0.00 0.02 0.00 0.00 34.50 31.35 2gzi s PRO 17 CO -0.06 -0.43 -0.01 0.14 -0.33 0.00 0.00 177.00 176.31 2gzi s VAL 18 N -0.03 1.55 0.00 3.83 -7.23 -1.26 -4.93 120.40 112.33 2gzi s VAL 18 Ca 0.59 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.70 2gzi s VAL 18 Cb -0.42 -2.67 0.00 0.00 0.56 0.00 0.00 36.38 33.84 2gzi s VAL 18 CO 0.44 -0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.70 2gzi n GLY 19 N -0.69 4.98 0.36 2.32 0.00 -1.26 -5.02 105.19 105.88 2gzi n GLY 19 Ca -0.04 -2.01 0.18 0.00 0.00 0.00 0.00 46.02 44.15 2gzi n GLY 19 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2gzi h ASP 20 N 0.00 0.00 -0.44 1.61 3.32 -2.01 -1.84 116.42 117.05 2gzi h ASP 20 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2gzi h ASP 20 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2gzi h ASP 20 CO 0.00 0.00 0.00 1.17 -1.72 0.00 0.00 179.24 178.69 2gzi n LYS 21 N -3.42 2.36 -0.12 3.56 4.81 -1.26 -4.66 118.16 119.43 2gzi n LYS 21 Ca 0.03 -1.73 -0.12 0.00 -0.87 0.00 0.00 58.31 55.62 2gzi n LYS 21 Cb 0.47 -1.49 -0.07 0.00 0.02 0.00 0.00 35.03 33.95 2gzi n LYS 21 CO 0.00 0.00 0.00 2.35 1.17 0.00 0.00 177.40 180.92 2gzi h TRP 22 N 2.65 -1.48 0.00 5.64 7.01 -1.73 -0.94 115.95 127.11 2gzi h TRP 22 Ca 0.00 0.07 0.00 0.00 2.11 0.00 0.00 58.89 61.07 2gzi h TRP 22 Cb 0.79 0.70 0.00 0.00 -2.10 0.00 0.00 29.16 28.55 2gzi h TRP 22 CO 0.39 -0.47 0.00 -0.07 -2.79 0.00 0.00 178.44 175.50 2gzi h LEU 23 N -0.38 0.00 -1.18 0.65 3.38 -1.87 -2.37 115.31 113.54 2gzi h LEU 23 Ca 0.10 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2gzi h LEU 23 Cb 0.60 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2gzi h LEU 23 CO -0.58 0.00 0.09 0.44 0.09 0.00 0.00 178.44 178.49 2gzi h ASP 24 N 0.00 0.61 0.07 -0.43 3.45 -1.51 -2.61 116.42 116.00 2gzi h ASP 24 Ca 0.00 -0.10 -0.00 0.00 0.43 0.00 0.00 57.03 57.36 2gzi h ASP 24 Cb 0.59 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 39.20 2gzi h ASP 24 CO 0.00 0.62 -0.02 0.44 -1.57 0.00 0.00 179.24 178.71 2gzi h ASP 25 N 0.64 0.00 0.25 6.45 3.32 -1.16 -3.06 116.42 122.86 2gzi h ASP 25 Ca 0.14 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 2gzi h ASP 25 Cb 0.27 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 2gzi h ASP 25 CO -0.00 0.02 -0.01 0.00 -1.72 0.00 0.00 179.24 177.53 2gzi h ALA 26 N 1.98 1.08 -0.66 3.45 0.00 -1.55 -1.91 119.26 121.64 2gzi h ALA 26 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2gzi h ALA 26 Cb 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2gzi h ALA 26 CO 0.00 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.68 2gzi n GLY 27 N -0.83 2.51 3.21 0.00 0.00 -1.16 -1.58 105.19 107.35 2gzi n GLY 27 Ca -0.02 -0.81 -0.19 0.00 0.00 0.00 0.00 46.02 45.00 2gzi n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gzi s LYS 28 N -1.55 0.92 5.49 1.61 1.02 -0.72 -4.79 119.74 121.72 2gzi s LYS 28 Ca 0.49 -1.07 0.00 0.00 0.02 0.00 0.00 55.97 55.41 2gzi s LYS 28 Cb 0.29 -0.93 0.00 0.00 -0.52 0.00 0.00 37.83 36.67 2gzi s LYS 28 CO 0.27 0.20 0.00 -0.25 -0.92 0.00 0.00 175.35 174.65 2gzi n ASP 29 N 1.03 0.00 -0.86 2.83 8.00 -1.26 -0.99 116.55 125.30 2gzi n ASP 29 Ca -0.19 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.41 2gzi n ASP 29 Cb 0.55 0.00 0.28 0.00 -0.02 0.00 0.00 41.12 41.93 2gzi n ASP 29 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2gzi n SER 30 N 5.27 2.56 0.00 -2.24 7.64 -1.26 -5.01 113.62 120.58 2gzi n SER 30 Ca 0.00 -1.87 0.00 0.00 1.01 0.00 0.00 58.87 58.01 2gzi n SER 30 Cb 0.00 -0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.00 2gzi n SER 30 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gzi n GLY 31 N 1.31 -4.08 3.84 0.23 0.00 -0.16 -4.80 105.19 101.53 2gzi n GLY 31 Ca 0.17 -2.09 -0.34 0.00 0.00 0.00 0.00 46.02 43.76 2gzi n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gzi s ALA 32 N -1.09 3.49 0.83 4.61 0.00 0.13 -4.74 121.76 124.99 2gzi s ALA 32 Ca 0.00 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.79 2gzi s ALA 32 Cb 0.00 -2.62 0.09 0.00 0.00 0.00 0.00 23.12 20.59 2gzi s ALA 32 CO 0.00 0.41 1.09 -1.25 0.00 0.00 0.00 175.76 176.01 2gzi s PRO 33 N -2.32 1.78 0.05 0.00 0.04 -1.26 0.15 135.00 133.45 2gzi s PRO 33 Ca 0.44 0.87 -0.31 0.00 0.04 0.00 0.00 61.00 62.05 2gzi s PRO 33 Cb -0.14 -1.87 -0.07 0.00 0.04 0.00 0.00 34.50 32.47 2gzi s PRO 33 CO 0.20 -1.89 1.42 0.42 0.04 0.00 0.00 177.00 177.19 2gzi s ILE 34 N -2.98 3.50 0.38 0.56 -1.09 -1.25 -4.68 121.20 115.65 2gzi s ILE 34 Ca 0.62 0.98 -0.27 0.00 -2.23 0.00 0.00 60.65 59.75 2gzi s ILE 34 Cb -0.17 -3.63 -0.11 0.00 -1.58 0.00 0.00 42.46 36.98 2gzi s ILE 34 CO 0.56 0.03 1.38 -2.65 -1.23 0.00 0.00 174.94 173.03 2gzi n PRO 35 N 4.84 2.33 -0.33 2.79 -0.02 -1.26 -1.84 135.00 141.51 2gzi n PRO 35 Ca 0.13 0.82 0.16 0.00 -2.02 0.00 0.00 63.50 62.58 2gzi n PRO 35 Cb 0.43 -2.51 0.35 0.00 -0.02 0.00 0.00 33.50 31.75 2gzi n PRO 35 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2gzi h ASP 36 N 2.59 0.52 -0.91 2.55 3.04 -0.75 -1.93 116.42 121.54 2gzi h ASP 36 Ca -0.49 0.15 -0.00 0.00 -3.24 0.00 0.00 57.03 53.44 2gzi h ASP 36 Cb 1.27 0.08 -0.04 0.00 -1.04 0.00 0.00 39.33 39.59 2gzi h ASP 36 CO 0.62 0.05 0.56 0.03 -2.04 0.00 0.00 179.24 178.46 2gzi h ARG 37 N 0.50 1.23 -0.19 4.15 3.08 -1.87 -1.23 114.38 120.05 2gzi h ARG 37 Ca 0.61 -0.11 -0.12 0.00 0.07 0.00 0.00 59.98 60.44 2gzi h ARG 37 Cb 1.16 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.95 2gzi h ARG 37 CO -0.50 0.85 -0.34 0.82 -1.07 0.00 0.00 179.97 179.73 2gzi h ILE 38 N 1.25 1.34 -0.89 2.04 1.08 -1.74 -3.08 117.51 117.52 2gzi h ILE 38 Ca 0.33 -1.57 0.05 0.00 -0.39 0.00 0.00 64.86 63.28 2gzi h ILE 38 Cb -0.07 1.87 -0.05 0.00 -3.07 0.00 0.00 36.82 35.50 2gzi h ILE 38 CO -0.06 0.48 0.58 0.00 -0.69 0.00 0.00 178.15 178.46 2gzi h ALA 39 N 0.60 1.49 -0.44 1.87 0.00 -1.18 -1.34 119.26 120.26 2gzi h ALA 39 Ca 0.01 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2gzi h ALA 39 Cb 0.93 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2gzi h ALA 39 CO 0.08 0.40 0.04 -0.44 0.00 0.00 0.00 179.25 179.33 2gzi h ASP 40 N 1.05 0.64 0.33 0.00 3.32 -1.19 0.13 116.42 120.70 2gzi h ASP 40 Ca 0.37 -0.12 -0.17 0.00 0.02 0.00 0.00 57.03 57.13 2gzi h ASP 40 Cb 0.12 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2gzi h ASP 40 CO -0.12 0.68 -0.67 0.11 -1.72 0.00 0.00 179.24 177.51 2gzi h LYS 41 N 0.65 0.31 0.00 3.56 1.79 -1.19 -3.36 116.57 118.33 2gzi h LYS 41 Ca 0.14 -0.24 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 2gzi h LYS 41 Cb 0.34 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 2gzi h LYS 41 CO 0.01 0.87 -1.56 1.28 -1.08 0.00 0.00 179.45 178.97 2gzi n LEU 42 N -3.84 0.41 -4.70 2.94 4.77 -0.66 -4.93 117.00 110.99 2gzi n LEU 42 Ca -0.03 -0.16 -0.43 0.00 -0.03 0.00 0.00 56.01 55.35 2gzi n LEU 42 Cb 0.67 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.73 2gzi n LEU 42 CO 0.46 0.08 0.98 -1.14 -1.33 0.00 0.00 177.39 176.45 2gzi n ARG 43 N -1.99 2.17 -0.54 3.23 0.63 -0.01 -1.94 116.66 118.21 2gzi n ARG 43 Ca -0.01 0.77 0.00 0.00 -0.92 0.00 0.00 57.85 57.69 2gzi n ARG 43 Cb 0.48 -2.40 0.00 0.00 0.45 0.00 0.00 32.46 30.99 2gzi n ARG 43 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2gzi n ASP 44 N 1.39 0.00 -4.78 6.15 8.00 0.06 -4.96 116.55 122.41 2gzi n ASP 44 Ca 0.07 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.21 2gzi n ASP 44 Cb 0.35 -0.92 -0.05 0.00 -0.02 0.00 0.00 41.12 40.47 2gzi n ASP 44 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2gzi s LYS 45 N -0.29 4.31 -0.10 -1.24 1.02 -0.82 -4.79 119.74 117.83 2gzi s LYS 45 Ca 0.00 1.43 -0.15 0.00 0.02 0.00 0.00 55.97 57.27 2gzi s LYS 45 Cb 0.00 -2.61 -0.05 0.00 -0.52 0.00 0.00 37.83 34.66 2gzi s LYS 45 CO 0.00 0.01 0.36 -2.00 -0.92 0.00 0.00 175.35 172.80 2gzi s GLU 46 N -2.39 4.11 -0.05 1.68 2.12 -1.26 -1.78 118.70 121.13 2gzi s GLU 46 Ca 0.55 0.26 0.06 0.00 0.36 0.00 0.00 54.97 56.21 2gzi s GLU 46 Cb -0.20 -3.35 -0.01 0.00 0.26 0.00 0.00 34.13 30.83 2gzi s GLU 46 CO 0.25 0.40 -0.25 -0.06 -0.54 0.00 0.00 175.26 175.06 2gzi s PHE 47 N -0.07 2.43 0.23 5.30 0.40 0.16 -4.98 117.98 121.45 2gzi s PHE 47 Ca 0.21 -0.67 0.17 0.00 -0.60 0.00 0.00 56.93 56.04 2gzi s PHE 47 Cb -0.15 -1.58 0.66 0.00 0.51 0.00 0.00 43.02 42.46 2gzi s PHE 47 CO 0.08 -0.18 1.74 -0.22 0.70 0.00 0.00 175.22 177.34 2gzi h LYS 48 N 5.96 0.00 -2.93 0.44 3.64 -1.91 -0.55 116.57 121.23 2gzi h LYS 48 Ca -0.34 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.08 2gzi h LYS 48 Cb 1.17 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.90 2gzi h LYS 48 CO 0.47 0.41 0.25 -1.54 -2.27 0.00 0.00 179.45 176.78 2gzi s SER 49 N -6.58 -0.38 0.30 4.20 1.04 -1.26 -2.99 113.70 108.03 2gzi s SER 49 Ca -0.01 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.09 2gzi s SER 49 Cb 0.12 0.65 0.46 0.00 0.10 0.00 0.00 66.02 67.35 2gzi s SER 49 CO 0.70 -1.14 1.86 0.15 0.98 0.00 0.00 173.24 175.79 2gzi h PHE 50 N 2.00 0.80 -0.72 5.02 3.57 -0.99 -2.41 116.94 124.20 2gzi h PHE 50 Ca -0.25 -0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.20 2gzi h PHE 50 Cb 1.27 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.74 2gzi h PHE 50 CO 0.34 0.66 0.48 0.22 -2.23 0.00 0.00 178.31 177.78 2gzi h ASP 51 N 0.76 0.81 -0.58 0.41 1.82 -1.96 0.12 116.42 117.80 2gzi h ASP 51 Ca 0.17 -0.02 -0.04 0.00 -0.39 0.00 0.00 57.03 56.75 2gzi h ASP 51 Cb 0.25 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 40.04 2gzi h ASP 51 CO -0.01 0.57 0.20 0.44 -1.61 0.00 0.00 179.24 178.84 2gzi h ASP 52 N 0.95 0.82 -0.39 2.28 5.19 -1.84 -2.03 116.42 121.39 2gzi h ASP 52 Ca 0.27 -0.19 0.05 0.00 -0.62 0.00 0.00 57.03 56.53 2gzi h ASP 52 Cb -0.06 -0.21 -0.04 0.00 0.18 0.00 0.00 39.33 39.19 2gzi h ASP 52 CO -0.07 0.80 0.14 0.15 -3.12 0.00 0.00 179.24 177.14 2gzi h PHE 53 N 0.80 0.25 -0.47 4.55 3.57 -0.97 -2.21 116.94 122.47 2gzi h PHE 53 Ca 0.19 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.77 2gzi h PHE 53 Cb 0.26 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.89 2gzi h PHE 53 CO 0.02 0.10 0.16 -0.09 -2.23 0.00 0.00 178.31 176.27 2gzi h ARG 54 N 0.30 0.32 -0.84 1.11 2.43 -0.73 -1.07 114.38 115.91 2gzi h ARG 54 Ca 0.18 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.41 2gzi h ARG 54 Cb 0.16 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 29.57 2gzi h ARG 54 CO -0.18 0.21 0.50 -0.22 -1.51 0.00 0.00 179.97 178.77 2gzi h LYS 55 N 0.33 0.84 -0.44 0.20 3.64 -1.27 -2.64 116.57 117.23 2gzi h LYS 55 Ca 0.22 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.52 2gzi h LYS 55 Cb 0.23 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 2gzi h LYS 55 CO -0.23 0.55 0.15 0.00 -2.27 0.00 0.00 179.45 177.65 2gzi h ALA 56 N 1.44 0.57 -0.32 5.00 0.00 -0.72 -1.22 119.26 124.01 2gzi h ALA 56 Ca 0.39 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.20 2gzi h ALA 56 Cb 0.29 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 2gzi h ALA 56 CO -0.22 0.21 -0.06 0.28 0.00 0.00 0.00 179.25 179.46 2gzi h VAL 57 N 0.57 0.70 -0.18 0.00 2.07 -0.88 -1.34 116.25 117.19 2gzi h VAL 57 Ca 0.14 -0.01 -0.15 0.00 0.82 0.00 0.00 66.70 67.51 2gzi h VAL 57 Cb 0.24 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2gzi h VAL 57 CO -0.01 0.00 -0.51 -0.50 0.02 0.00 0.00 177.57 176.58 2gzi h TRP 58 N 0.02 0.61 -0.77 1.57 4.06 -1.18 0.08 115.95 120.34 2gzi h TRP 58 Ca 0.16 -0.20 -0.05 0.00 2.06 0.00 0.00 58.89 60.85 2gzi h TRP 58 Cb 0.23 -0.12 -0.03 0.00 -1.00 0.00 0.00 29.16 28.24 2gzi h TRP 58 CO -0.28 0.90 0.29 0.93 -3.56 0.00 0.00 178.44 176.72 2gzi h GLU 59 N 0.39 1.17 -0.46 0.49 5.08 -1.09 -0.29 114.58 119.86 2gzi h GLU 59 Ca 0.02 -0.23 -0.14 0.00 -1.00 0.00 0.00 59.36 58.01 2gzi h GLU 59 Cb 1.03 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 2gzi h GLU 59 CO 0.09 0.96 -0.25 0.93 -1.00 0.00 0.00 179.01 179.74 2gzi h GLU 60 N 1.13 0.99 -0.98 2.33 4.39 -0.91 -2.75 114.58 118.78 2gzi h GLU 60 Ca 0.26 -0.44 0.04 0.00 0.34 0.00 0.00 59.36 59.55 2gzi h GLU 60 Cb 0.25 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.82 2gzi h GLU 60 CO -0.02 1.12 0.64 0.28 -1.16 0.00 0.00 179.01 179.87 2gzi h VAL 61 N 0.84 1.15 -0.04 3.13 2.07 -0.55 -2.03 116.25 120.83 2gzi h VAL 61 Ca 0.10 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 2gzi h VAL 61 Cb 0.84 -0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2gzi h VAL 61 CO 0.07 0.22 -0.06 0.77 0.02 0.00 0.00 177.57 178.60 2gzi h SER 62 N 1.23 0.05 0.17 0.57 4.64 -0.78 -1.74 113.55 117.69 2gzi h SER 62 Ca 0.40 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2gzi h SER 62 Cb 0.03 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2gzi h SER 62 CO -0.13 0.12 -0.26 0.29 -0.87 0.00 0.00 176.83 175.98 2gzi n LYS 63 N -4.44 1.01 -3.54 4.77 5.02 -0.81 -4.86 118.16 115.31 2gzi n LYS 63 Ca -0.02 -0.64 -0.40 0.00 -2.02 0.00 0.00 58.31 55.23 2gzi n LYS 63 Cb 0.16 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.57 2gzi n LYS 63 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2gzi s ASP 64 N -2.43 6.06 0.18 4.39 3.68 -0.65 -4.98 116.67 122.91 2gzi s ASP 64 Ca 0.25 -0.26 -0.14 0.00 2.13 0.00 0.00 52.55 54.54 2gzi s ASP 64 Cb 0.19 -2.14 0.12 0.00 -1.45 0.00 0.00 42.92 39.64 2gzi s ASP 64 CO 0.50 -0.18 1.78 1.55 0.13 0.00 0.00 175.17 178.95 2gzi h PRO 65 N 8.44 0.46 0.00 4.34 0.13 -1.89 0.38 132.00 143.87 2gzi h PRO 65 Ca -0.32 -0.03 -0.10 0.00 -0.87 0.00 0.00 66.00 64.68 2gzi h PRO 65 Cb 1.17 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 2gzi h PRO 65 CO 0.61 0.31 -0.49 0.93 -0.23 0.00 0.00 178.00 179.13 2gzi h GLU 66 N 0.48 0.00 0.09 0.86 4.39 -1.94 -2.09 114.58 116.37 2gzi h GLU 66 Ca 0.21 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.56 2gzi h GLU 66 Cb 0.12 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 2gzi h GLU 66 CO -0.15 0.49 -1.98 1.28 -1.16 0.00 0.00 179.01 177.49 2gzi n LEU 67 N -3.61 2.26 0.07 1.33 4.77 -0.98 -4.31 117.00 116.53 2gzi n LEU 67 Ca -0.00 0.22 -0.07 0.00 -0.03 0.00 0.00 56.01 56.12 2gzi n LEU 67 Cb 0.57 -0.82 -0.11 0.00 -2.33 0.00 0.00 43.42 40.74 2gzi n LEU 67 CO 0.39 0.76 0.14 0.77 -1.33 0.00 0.00 177.39 178.13 2gzi h SER 68 N 0.05 0.04 -0.82 -1.43 4.64 -0.30 -3.30 113.55 112.43 2gzi h SER 68 Ca -0.41 -0.04 0.24 0.00 -0.47 0.00 0.00 61.79 61.11 2gzi h SER 68 Cb 2.03 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 64.07 2gzi h SER 68 CO 0.07 1.01 0.63 0.07 -0.87 0.00 0.00 176.83 177.75 2gzi h LYS 69 N 0.01 0.00 -0.72 4.77 2.10 -1.55 -0.03 116.57 121.15 2gzi h LYS 69 Ca -0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2gzi h LYS 69 Cb 1.75 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.08 2gzi h LYS 69 CO 0.13 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.67 2gzi n ASN 70 N -4.13 4.04 -4.41 7.07 5.03 -1.24 -4.85 115.26 116.77 2gzi n ASN 70 Ca 0.17 -2.58 -0.30 0.00 0.87 0.00 0.00 54.58 52.73 2gzi n ASN 70 Cb 0.92 -0.61 -0.13 0.00 -1.02 0.00 0.00 39.78 38.94 2gzi n ASN 70 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2gzi s LEU 71 N -1.77 2.40 0.79 3.41 1.43 -0.03 -5.07 118.68 119.85 2gzi s LEU 71 Ca 0.35 -0.55 -0.11 0.00 -1.03 0.00 0.00 54.13 52.80 2gzi s LEU 71 Cb 0.27 -1.39 0.09 0.00 0.03 0.00 0.00 46.19 45.19 2gzi s LEU 71 CO 0.11 0.24 1.14 0.54 0.23 0.00 0.00 176.35 178.61 2gzi s ASN 72 N -1.51 4.43 0.30 2.29 6.03 -1.26 -4.76 114.94 120.47 2gzi s ASN 72 Ca 0.14 0.61 0.04 0.00 -1.03 0.00 0.00 52.86 52.61 2gzi s ASN 72 Cb -0.10 -1.09 0.66 0.00 -3.03 0.00 0.00 41.25 37.69 2gzi s ASN 72 CO 0.05 -1.91 1.83 -0.65 -2.03 0.00 0.00 177.10 174.38 2gzi h PRO 73 N -0.98 0.85 -0.34 3.55 0.11 -1.99 -0.55 132.00 132.64 2gzi h PRO 73 Ca -0.45 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 2gzi h PRO 73 Cb 1.31 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2gzi h PRO 73 CO 0.61 0.56 0.01 0.77 -0.21 0.00 0.00 178.00 179.74 2gzi h SER 74 N 0.88 0.58 0.02 -2.05 0.02 -2.00 -1.94 113.55 109.06 2gzi h SER 74 Ca 0.51 -0.30 -0.08 0.00 -0.84 0.00 0.00 61.79 61.07 2gzi h SER 74 Cb 0.64 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 2gzi h SER 74 CO -0.28 0.74 -0.24 0.78 -1.14 0.00 0.00 176.83 176.69 2gzi h ASN 75 N 0.41 0.36 -0.58 3.07 2.35 -1.79 -2.80 115.58 116.61 2gzi h ASN 75 Ca 0.10 -0.11 0.04 0.00 -0.55 0.00 0.00 56.30 55.77 2gzi h ASN 75 Cb 0.43 -0.10 -0.04 0.00 0.05 0.00 0.00 38.32 38.66 2gzi h ASN 75 CO 0.02 0.61 0.34 0.11 -1.65 0.00 0.00 177.43 176.85 2gzi h LYS 76 N 0.33 0.64 -0.92 0.81 1.57 -0.88 -1.25 116.57 116.86 2gzi h LYS 76 Ca 0.05 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.83 2gzi h LYS 76 Cb 0.60 -0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.72 2gzi h LYS 76 CO 0.04 0.42 0.60 0.77 -0.57 0.00 0.00 179.45 180.71 2gzi h SER 77 N 0.65 1.00 0.31 0.86 0.02 -1.15 -1.66 113.55 113.59 2gzi h SER 77 Ca 0.24 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 2gzi h SER 77 Cb 0.08 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.39 2gzi h SER 77 CO -0.13 0.69 -0.15 0.28 -1.14 0.00 0.00 176.83 176.39 2gzi h SER 78 N 1.17 -0.35 0.43 3.07 0.02 -1.19 -3.14 113.55 113.56 2gzi h SER 78 Ca 0.37 -0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 2gzi h SER 78 Cb -0.01 0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 2gzi h SER 78 CO -0.12 -0.04 -0.16 -0.37 -1.14 0.00 0.00 176.83 175.00 2gzi h VAL 79 N -0.67 0.66 -0.03 2.27 -1.51 -1.07 -1.80 116.25 114.10 2gzi h VAL 79 Ca -0.04 -0.68 -0.02 0.00 -1.23 0.00 0.00 66.70 64.72 2gzi h VAL 79 Cb 0.47 1.43 -0.00 0.00 -2.13 0.00 0.00 31.29 31.05 2gzi h VAL 79 CO 0.07 0.16 -0.08 0.28 -1.23 0.00 0.00 177.57 176.76 2gzi h SER 80 N 0.00 0.04 -0.04 4.19 0.02 -1.26 -0.95 113.55 115.56 2gzi h SER 80 Ca -0.00 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2gzi h SER 80 Cb 0.42 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.95 2gzi h SER 80 CO 0.02 0.14 0.00 0.29 -1.14 0.00 0.00 176.83 176.14 2gzi n LYS 81 N -4.41 1.31 -1.02 3.45 5.02 -0.72 -4.90 118.16 116.89 2gzi n LYS 81 Ca -0.02 -0.45 -0.01 0.00 -2.02 0.00 0.00 58.31 55.81 2gzi n LYS 81 Cb 0.17 -1.42 -0.00 0.00 -0.02 0.00 0.00 35.03 33.76 2gzi n LYS 81 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gzi n GLY 82 N 1.02 0.47 3.81 0.72 0.00 -0.36 -5.02 105.19 105.82 2gzi n GLY 82 Ca 0.19 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2gzi n GLY 82 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gzi s TYR 83 N -1.92 3.37 0.33 1.61 2.02 -0.96 -4.40 117.35 117.40 2gzi s TYR 83 Ca 0.00 1.64 -0.28 0.00 -0.37 0.00 0.00 57.07 58.06 2gzi s TYR 83 Cb 0.00 -2.86 -0.09 0.00 -0.40 0.00 0.00 41.96 38.60 2gzi s TYR 83 CO 0.00 -0.06 1.15 0.45 -1.57 0.00 0.00 175.55 175.52 2gzi s SER 84 N -2.09 6.92 0.51 2.29 0.15 -1.26 -3.64 113.70 116.57 2gzi s SER 84 Ca 0.60 2.35 -0.20 0.00 0.70 0.00 0.00 55.95 59.40 2gzi s SER 84 Cb -0.11 -2.62 -0.07 0.00 -1.71 0.00 0.00 66.02 61.51 2gzi s SER 84 CO 0.15 -0.40 1.09 -2.16 1.20 0.00 0.00 173.24 173.12 2gzi s PRO 85 N -1.84 3.61 0.32 5.44 0.04 -1.26 -4.79 135.00 136.52 2gzi s PRO 85 Ca 0.50 1.50 -0.28 0.00 0.04 0.00 0.00 61.00 62.76 2gzi s PRO 85 Cb -0.32 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.04 2gzi s PRO 85 CO 0.41 -0.61 1.16 -0.06 0.04 0.00 0.00 177.00 177.94 2gzi s PHE 86 N -1.85 3.33 0.68 0.56 0.40 -1.26 -1.69 117.98 118.14 2gzi s PHE 86 Ca 0.69 1.60 -0.08 0.00 -0.60 0.00 0.00 56.93 58.54 2gzi s PHE 86 Cb -0.21 -3.39 0.04 0.00 0.51 0.00 0.00 43.02 39.98 2gzi s PHE 86 CO 0.24 -1.01 1.01 0.95 0.70 0.00 0.00 175.22 177.11 2gzi s THR 87 N -1.24 2.90 0.50 0.64 -4.23 -0.64 -4.84 115.64 108.74 2gzi s THR 87 Ca 0.49 -0.02 -0.21 0.00 -1.18 0.00 0.00 61.69 60.77 2gzi s THR 87 Cb -0.33 -3.23 -0.08 0.00 1.34 0.00 0.00 72.50 70.20 2gzi s THR 87 CO 0.42 -0.26 0.96 -2.65 -0.54 0.00 0.00 174.62 172.55 2gzi n PRO 88 N -2.87 1.13 -0.36 3.99 -0.02 -1.26 -4.88 135.00 130.73 2gzi n PRO 88 Ca 0.07 0.42 0.12 0.00 -2.02 0.00 0.00 63.50 62.08 2gzi n PRO 88 Cb 0.59 -2.08 0.30 0.00 -0.02 0.00 0.00 33.50 32.30 2gzi n PRO 88 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2gzi h LYS 89 N 1.05 0.79 0.00 -0.52 3.64 -1.97 -1.40 116.57 118.15 2gzi h LYS 89 Ca -0.46 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2gzi h LYS 89 Cb 1.35 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2gzi h LYS 89 CO 0.54 0.52 0.00 0.27 -2.27 0.00 0.00 179.45 178.51 2gzi n ASN 90 N -4.73 0.00 -0.87 4.20 0.23 -1.26 -1.72 115.26 111.11 2gzi n ASN 90 Ca 0.22 0.39 0.10 0.00 -0.53 0.00 0.00 54.58 54.76 2gzi n ASN 90 Cb 0.53 -0.45 0.12 0.00 -2.08 0.00 0.00 39.78 37.90 2gzi n ASN 90 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2gzi n GLN 91 N -1.45 1.97 -3.06 -3.83 1.13 -0.53 -4.97 117.38 106.66 2gzi n GLN 91 Ca 0.05 -1.84 -0.30 0.00 -1.94 0.00 0.00 57.00 52.96 2gzi n GLN 91 Cb 0.17 -1.41 -0.04 0.00 0.11 0.00 0.00 30.24 29.07 2gzi n GLN 91 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2gzi s GLN 92 N -1.59 3.79 -0.30 -1.09 -0.21 -0.70 -1.60 119.66 117.96 2gzi s GLN 92 Ca 0.27 0.39 -0.01 0.00 0.02 0.00 0.00 55.36 56.03 2gzi s GLN 92 Cb 0.18 -2.47 0.10 0.00 1.00 0.00 0.00 33.01 31.81 2gzi s GLN 92 CO 0.26 0.08 0.09 0.08 -2.12 0.00 0.00 175.29 173.69 2gzi s VAL 93 N -2.19 0.79 0.00 1.09 1.01 -0.51 -4.72 120.40 115.86 2gzi s VAL 93 Ca 0.50 -1.30 0.00 0.00 0.00 0.00 0.00 61.98 61.18 2gzi s VAL 93 Cb -0.10 -1.58 0.00 0.00 0.00 0.00 0.00 36.38 34.70 2gzi s VAL 93 CO 0.28 -0.65 0.00 0.61 0.00 0.00 0.00 175.10 175.34 2gzi n GLY 94 N 4.89 3.95 0.00 4.51 0.00 -1.26 -1.87 105.19 115.41 2gzi n GLY 94 Ca -0.03 0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.12 2gzi n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gzi n GLY 95 N 0.00 -1.14 3.40 -0.02 0.00 -1.26 -4.54 105.19 101.63 2gzi n GLY 95 Ca 0.00 -0.09 -0.44 0.00 0.00 0.00 0.00 46.02 45.49 2gzi n GLY 95 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gzi s ARG 96 N -2.81 3.07 0.00 1.61 0.52 -0.78 -4.85 118.95 115.71 2gzi s ARG 96 Ca 0.15 -1.17 0.00 0.00 -0.52 0.00 0.00 55.73 54.19 2gzi s ARG 96 Cb 0.14 -4.22 0.00 0.00 0.52 0.00 0.00 34.95 31.39 2gzi s ARG 96 CO 0.37 -1.48 0.33 1.63 0.02 0.00 0.00 175.30 176.17 2gzi n LYS 97 N 6.39 0.09 -4.38 3.54 5.02 -1.26 -1.43 118.16 126.14 2gzi n LYS 97 Ca -0.08 -0.33 -0.21 0.00 -2.02 0.00 0.00 58.31 55.66 2gzi n LYS 97 Cb 0.43 -0.82 -0.10 0.00 -0.02 0.00 0.00 35.03 34.52 2gzi n LYS 97 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2gzi s VAL 98 N -0.11 2.00 0.31 -0.18 -7.23 -1.26 -1.62 120.40 112.31 2gzi s VAL 98 Ca 0.00 -2.18 -0.29 0.00 -1.81 0.00 0.00 61.98 57.69 2gzi s VAL 98 Cb 0.00 -2.07 -0.12 0.00 0.56 0.00 0.00 36.38 34.75 2gzi s VAL 98 CO 0.00 -0.45 1.46 -1.22 -0.31 0.00 0.00 175.10 174.58 2gzi n TYR 99 N -0.24 2.59 -4.80 2.82 4.02 -0.68 -4.34 117.16 116.52 2gzi n TYR 99 Ca -0.09 0.41 -0.32 0.00 -0.01 0.00 0.00 57.90 57.89 2gzi n TYR 99 Cb 0.59 -2.51 -0.13 0.00 -0.02 0.00 0.00 39.34 37.27 2gzi n TYR 99 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2gzi s GLU 100 N -1.16 2.33 -0.11 -0.72 2.02 0.30 -4.80 118.70 116.56 2gzi s GLU 100 Ca 0.60 -0.81 -0.18 0.00 0.02 0.00 0.00 54.97 54.60 2gzi s GLU 100 Cb -0.54 -2.30 -0.04 0.00 0.10 0.00 0.00 34.13 31.34 2gzi s GLU 100 CO 0.55 0.59 0.48 -0.51 0.02 0.00 0.00 175.26 176.39 2gzi s LEU 101 N -1.04 4.29 -0.04 1.80 1.43 -1.26 -0.66 118.68 123.20 2gzi s LEU 101 Ca 0.13 0.83 0.06 0.00 -1.03 0.00 0.00 54.13 54.13 2gzi s LEU 101 Cb -0.11 -2.70 -0.02 0.00 0.03 0.00 0.00 46.19 43.39 2gzi s LEU 101 CO 0.03 0.02 -0.22 -2.28 0.23 0.00 0.00 176.35 174.12 2gzi s HIS 102 N 0.53 2.47 -0.28 0.29 5.65 0.21 -4.97 115.29 119.19 2gzi s HIS 102 Ca 0.26 -0.42 -0.19 0.00 0.25 0.00 0.00 55.06 54.96 2gzi s HIS 102 Cb -0.15 -1.57 -0.02 0.00 -1.18 0.00 0.00 32.58 29.66 2gzi s HIS 102 CO 0.11 -0.02 0.56 -1.01 -0.65 0.00 0.00 174.74 173.73 2gzi s HIS 103 N -0.52 3.25 0.08 3.88 3.76 -1.26 -0.44 115.29 124.03 2gzi s HIS 103 Ca 0.07 0.62 -0.29 0.00 -0.15 0.00 0.00 55.06 55.32 2gzi s HIS 103 Cb -0.11 -2.82 -0.17 0.00 1.11 0.00 0.00 32.58 30.59 2gzi s HIS 103 CO 0.01 -0.35 1.67 0.22 -0.85 0.00 0.00 174.74 175.44 2gzi h ASP 104 N 8.07 -0.45 -3.54 1.40 3.58 -1.34 -3.31 116.42 120.83 2gzi h ASP 104 Ca -0.28 0.02 -0.62 0.00 0.42 0.00 0.00 57.03 56.57 2gzi h ASP 104 Cb 1.13 0.12 -0.12 0.00 1.72 0.00 0.00 39.33 42.17 2gzi h ASP 104 CO 0.75 -0.32 0.23 -0.75 -2.88 0.00 0.00 179.24 176.27 2gzi s LYS 105 N -6.11 3.75 0.47 0.28 2.20 -1.26 -5.05 119.74 114.01 2gzi s LYS 105 Ca -0.16 0.20 -0.23 0.00 -0.36 0.00 0.00 55.97 55.42 2gzi s LYS 105 Cb 0.04 -3.79 -0.08 0.00 -1.51 0.00 0.00 37.83 32.49 2gzi s LYS 105 CO 0.64 -0.74 1.16 -2.30 -0.36 0.00 0.00 175.35 173.74 2gzi n PRO 106 N 6.14 1.56 -0.19 4.03 -0.02 -1.25 -4.05 135.00 141.23 2gzi n PRO 106 Ca 0.00 0.56 -0.06 0.00 -2.02 0.00 0.00 63.50 61.98 2gzi n PRO 106 Cb 0.48 -2.28 0.03 0.00 -0.02 0.00 0.00 33.50 31.71 2gzi n PRO 106 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2gzi h ILE 107 N 1.56 1.13 -0.02 4.25 1.08 -1.88 0.13 117.51 123.76 2gzi h ILE 107 Ca -0.47 -0.25 0.01 0.00 -0.39 0.00 0.00 64.86 63.75 2gzi h ILE 107 Cb 1.32 0.34 -0.00 0.00 -3.07 0.00 0.00 36.82 35.41 2gzi h ILE 107 CO 0.57 0.13 0.12 0.77 -0.69 0.00 0.00 178.15 179.05 2gzi h SER 108 N 0.73 0.00 -0.40 1.72 4.64 -1.90 0.56 113.55 118.90 2gzi h SER 108 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2gzi h SER 108 Cb -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 2gzi h SER 108 CO -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.91 2gzi n GLN 109 N -3.15 3.57 -0.29 4.77 6.02 -0.33 -4.94 117.38 123.03 2gzi n GLN 109 Ca -0.02 -2.88 0.00 0.00 -0.01 0.00 0.00 57.00 54.09 2gzi n GLN 109 Cb 0.19 -1.92 0.00 0.00 1.02 0.00 0.00 30.24 29.52 2gzi n GLN 109 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2gzi n GLY 110 N 0.06 0.71 3.73 1.08 0.00 0.19 -4.89 105.19 106.07 2gzi n GLY 110 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.91 2gzi n GLY 110 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gzi s GLY 111 N -1.52 2.24 0.14 -0.02 0.00 0.30 -4.94 107.32 103.53 2gzi s GLY 111 Ca 0.00 0.77 -0.29 0.00 0.00 0.00 0.00 44.72 45.20 2gzi s GLY 111 CO 0.00 1.17 0.92 -0.54 0.00 0.00 0.00 173.10 174.65 2gzi s GLU 112 N -4.03 4.71 0.09 2.90 0.41 -1.26 -4.40 118.70 117.12 2gzi s GLU 112 Ca 0.72 1.40 -0.16 0.00 -0.41 0.00 0.00 54.97 56.52 2gzi s GLU 112 Cb -0.27 -3.34 -0.11 0.00 -1.78 0.00 0.00 34.13 28.64 2gzi s GLU 112 CO 0.46 0.33 1.38 0.28 -0.49 0.00 0.00 175.26 177.22 2gzi h VAL 113 N 3.76 1.31 -0.19 2.63 2.07 -1.96 -3.33 116.25 120.54 2gzi h VAL 113 Ca -0.44 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 65.58 2gzi h VAL 113 Cb 1.21 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.69 2gzi h VAL 113 CO 0.70 0.47 0.00 -1.22 0.02 0.00 0.00 177.57 177.55 2gzi n TYR 114 N -4.28 0.37 -2.65 1.57 4.02 -1.26 -4.92 117.16 110.01 2gzi n TYR 114 Ca -0.05 -0.63 -0.43 0.00 -0.01 0.00 0.00 57.90 56.79 2gzi n TYR 114 Cb 0.49 -0.10 -0.02 0.00 -0.02 0.00 0.00 39.34 39.68 2gzi n TYR 114 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2gzi s ASP 115 N -1.38 6.63 0.59 7.72 -1.08 -1.25 -2.03 116.67 125.86 2gzi s ASP 115 Ca 0.21 0.45 0.35 0.00 -0.52 0.00 0.00 52.55 53.03 2gzi s ASP 115 Cb 0.15 -2.53 1.84 0.00 -1.46 0.00 0.00 42.92 40.92 2gzi s ASP 115 CO 0.09 -1.18 2.19 0.24 0.52 0.00 0.00 175.17 177.03 2gzi h MET 116 N 9.10 0.00 0.00 4.34 2.86 -0.89 0.63 114.93 130.97 2gzi h MET 116 Ca -0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.41 2gzi h MET 116 Cb 1.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.72 2gzi h MET 116 CO 1.10 0.04 0.00 -0.25 1.06 0.00 0.00 176.91 178.86 2gzi n ASP 117 N -3.41 0.55 -1.08 1.22 8.00 -1.26 -2.47 116.55 118.10 2gzi n ASP 117 Ca -0.02 0.61 0.10 0.00 0.71 0.00 0.00 54.79 56.19 2gzi n ASP 117 Cb 0.16 -0.74 0.25 0.00 -0.02 0.00 0.00 41.12 40.77 2gzi n ASP 117 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2gzi n ASN 118 N -2.08 3.51 -4.47 -2.24 5.15 0.21 -4.97 115.26 110.37 2gzi n ASN 118 Ca 0.03 -1.98 -0.32 0.00 -0.60 0.00 0.00 54.58 51.71 2gzi n ASN 118 Cb 0.26 -0.36 -0.13 0.00 -0.53 0.00 0.00 39.78 39.02 2gzi n ASN 118 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2gzi s ILE 119 N -1.07 2.97 0.08 -1.44 1.01 -1.03 -0.84 121.20 120.88 2gzi s ILE 119 Ca 0.39 -0.82 0.05 0.00 0.00 0.00 0.00 60.65 60.27 2gzi s ILE 119 Cb 0.21 -2.17 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 2gzi s ILE 119 CO 0.27 0.55 -0.14 -0.13 0.00 0.00 0.00 174.94 175.49 2gzi s ARG 120 N -0.85 0.83 -0.17 2.79 1.81 0.41 -3.75 118.95 120.02 2gzi s ARG 120 Ca 0.12 -0.99 -0.15 0.00 -1.72 0.00 0.00 55.73 53.00 2gzi s ARG 120 Cb -0.11 -0.80 -0.04 0.00 -0.45 0.00 0.00 34.95 33.55 2gzi s ARG 120 CO 0.01 0.17 0.33 0.08 -0.68 0.00 0.00 175.30 175.22 2gzi s VAL 121 N -1.43 5.27 0.12 3.52 1.01 0.12 -0.62 120.40 128.38 2gzi s VAL 121 Ca -0.01 0.62 0.07 0.00 0.00 0.00 0.00 61.98 62.65 2gzi s VAL 121 Cb -0.09 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2gzi s VAL 121 CO 0.02 0.35 -0.16 0.42 0.00 0.00 0.00 175.10 175.73 2gzi s THR 122 N 0.72 1.43 0.56 3.92 -4.23 0.17 -0.70 115.64 117.51 2gzi s THR 122 Ca 0.18 -1.66 -0.12 0.00 -1.18 0.00 0.00 61.69 58.92 2gzi s THR 122 Cb -0.14 -1.51 -0.05 0.00 1.34 0.00 0.00 72.50 72.14 2gzi s THR 122 CO 0.06 -0.31 0.96 0.42 -0.54 0.00 0.00 174.62 175.21 2gzi s THR 123 N -1.83 4.70 0.22 3.99 -4.23 -0.61 -0.54 115.64 117.34 2gzi s THR 123 Ca 0.08 0.85 -0.08 0.00 -1.18 0.00 0.00 61.69 61.35 2gzi s THR 123 Cb -0.07 -3.82 0.19 0.00 1.34 0.00 0.00 72.50 70.14 2gzi s THR 123 CO 0.04 -0.94 1.70 -0.65 -0.54 0.00 0.00 174.62 174.22 2gzi h PRO 124 N 0.19 0.27 -0.07 3.99 0.11 -1.75 0.26 132.00 135.00 2gzi h PRO 124 Ca -0.45 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.66 2gzi h PRO 124 Cb 1.19 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2gzi h PRO 124 CO 0.62 0.18 -0.03 -0.22 -0.21 0.00 0.00 178.00 178.34 2gzi h LYS 125 N 0.27 -0.02 -0.33 1.05 3.64 -1.58 -2.11 116.57 117.50 2gzi h LYS 125 Ca 0.35 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.70 2gzi h LYS 125 Cb 0.54 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 2gzi h LYS 125 CO -0.43 -0.01 0.10 -0.09 -2.27 0.00 0.00 179.45 176.75 2gzi h ARG 126 N -0.02 0.51 -0.92 1.90 9.65 -1.74 -2.92 114.38 120.84 2gzi h ARG 126 Ca 0.04 -0.11 0.05 0.00 -1.10 0.00 0.00 59.98 58.85 2gzi h ARG 126 Cb 0.07 -0.07 -0.06 0.00 -1.39 0.00 0.00 29.97 28.52 2gzi h ARG 126 CO -0.08 0.55 0.59 1.25 2.80 0.00 0.00 179.97 185.08 2gzi h HIS 127 N 0.37 1.11 -0.41 2.20 2.76 -0.75 -1.15 115.15 119.28 2gzi h HIS 127 Ca 0.11 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.25 2gzi h HIS 127 Cb 0.26 -0.36 -0.02 0.00 1.55 0.00 0.00 27.41 28.84 2gzi h HIS 127 CO 0.01 0.61 0.03 0.82 -1.30 0.00 0.00 177.93 178.10 2gzi h ILE 128 N 1.12 1.25 -0.58 6.26 2.04 -1.40 -2.74 117.51 123.45 2gzi h ILE 128 Ca 0.38 -0.95 -0.03 0.00 1.00 0.00 0.00 64.86 65.26 2gzi h ILE 128 Cb 0.07 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2gzi h ILE 128 CO -0.14 0.32 0.25 0.44 0.00 0.00 0.00 178.15 179.02 2gzi h ASP 129 N 0.54 0.80 -0.73 1.72 3.45 -1.26 -2.11 116.42 118.82 2gzi h ASP 129 Ca 0.12 -0.16 0.11 0.00 0.43 0.00 0.00 57.03 57.53 2gzi h ASP 129 Cb 0.43 -0.21 -0.08 0.00 -0.56 0.00 0.00 39.33 38.92 2gzi h ASP 129 CO 0.02 0.74 0.34 0.40 -1.57 0.00 0.00 179.24 179.16 2gzi h ILE 130 N 0.80 0.77 -0.00 0.35 2.04 -1.04 -2.13 117.51 118.30 2gzi h ILE 130 Ca 0.20 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.87 2gzi h ILE 130 Cb 0.18 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 2gzi h ILE 130 CO -0.02 0.10 -0.17 1.41 0.00 0.00 0.00 178.15 179.47 2gzi n HIS 131 N -4.92 0.00 1.21 1.37 8.25 -0.97 -2.40 115.22 117.77 2gzi n HIS 131 Ca 0.12 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.69 2gzi n HIS 131 Cb 0.33 -0.35 0.38 0.00 1.12 0.00 0.00 29.99 31.47 2gzi n HIS 131 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2gzi n ARG 132 N -1.38 1.76 -0.78 -0.41 1.74 -0.82 -5.11 116.66 111.66 2gzi n ARG 132 Ca 0.08 -1.14 0.00 0.00 -0.77 0.00 0.00 57.85 56.02 2gzi n ARG 132 Cb 0.32 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 2gzi n ARG 132 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52