#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gq3 n ASP 3 N 0.00 0.00 -4.67 3.42 5.68 -1.26 -5.11 116.55 114.61 2gq3 n ASP 3 Ca 0.00 0.00 -0.45 0.00 -0.50 0.00 0.00 54.79 53.84 2gq3 n ASP 3 Cb 0.00 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 39.95 2gq3 n ASP 3 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2gq3 n ARG 4 N 0.00 2.05 -2.77 0.11 1.74 -1.26 -4.59 116.66 111.94 2gq3 n ARG 4 Ca 0.00 0.74 -0.40 0.00 -0.77 0.00 0.00 57.85 57.41 2gq3 n ARG 4 Cb 0.00 -2.44 -0.05 0.00 -1.02 0.00 0.00 32.46 28.95 2gq3 n ARG 4 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2gq3 s VAL 5 N 0.36 4.35 -0.40 1.55 1.01 -0.34 -4.72 120.40 122.21 2gq3 s VAL 5 Ca 0.73 2.02 -0.11 0.00 0.00 0.00 0.00 61.98 64.63 2gq3 s VAL 5 Cb -0.67 -4.30 0.05 0.00 0.00 0.00 0.00 36.38 31.46 2gq3 s VAL 5 CO 0.45 0.40 0.24 -0.55 0.00 0.00 0.00 175.10 175.64 2gq3 s SER 6 N -0.53 5.72 -0.23 3.32 0.15 -1.26 -0.24 113.70 120.62 2gq3 s SER 6 Ca 0.43 -1.22 0.00 0.00 0.70 0.00 0.00 55.95 55.86 2gq3 s SER 6 Cb -0.24 -2.02 0.03 0.00 -1.71 0.00 0.00 66.02 62.08 2gq3 s SER 6 CO 0.30 -0.47 -0.11 -0.69 1.20 0.00 0.00 173.24 173.48 2gq3 s VAL 7 N 1.51 2.50 0.00 4.45 1.01 -0.29 -4.97 120.40 124.61 2gq3 s VAL 7 Ca 0.02 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 60.85 2gq3 s VAL 7 Cb -0.21 -2.27 0.00 0.00 0.00 0.00 0.00 36.38 33.90 2gq3 s VAL 7 CO 0.05 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.98 2gq3 n GLY 8 N 4.60 1.12 0.30 4.51 0.00 -1.26 -0.39 105.19 114.07 2gq3 n GLY 8 Ca -0.17 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.35 2gq3 n GLY 8 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2gq3 n ASN 9 N 2.67 0.00 -4.36 1.61 5.15 -1.26 -5.03 115.26 114.04 2gq3 n ASN 9 Ca 0.00 -1.60 -0.27 0.00 -0.60 0.00 0.00 54.58 52.11 2gq3 n ASN 9 Cb 0.00 -0.12 -0.13 0.00 -0.53 0.00 0.00 39.78 39.00 2gq3 n ASN 9 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2gq3 s LEU 10 N 0.00 2.34 -0.28 1.20 1.43 0.47 -2.35 118.68 121.49 2gq3 s LEU 10 Ca 0.00 -0.76 0.02 0.00 -1.03 0.00 0.00 54.13 52.36 2gq3 s LEU 10 Cb 0.00 -1.08 0.06 0.00 0.03 0.00 0.00 46.19 45.20 2gq3 s LEU 10 CO 0.00 0.12 -0.06 -0.13 0.23 0.00 0.00 176.35 176.51 2gq3 s ARG 11 N -2.16 2.21 -0.17 1.70 0.52 0.27 -1.14 118.95 120.18 2gq3 s ARG 11 Ca 0.13 -1.39 -0.16 0.00 -0.52 0.00 0.00 55.73 53.79 2gq3 s ARG 11 Cb -0.09 -3.02 -0.04 0.00 0.52 0.00 0.00 34.95 32.32 2gq3 s ARG 11 CO 0.06 -0.63 0.40 0.42 0.02 0.00 0.00 175.30 175.57 2gq3 s ILE 12 N 1.12 5.21 0.21 1.52 1.09 0.66 -1.89 121.20 129.12 2gq3 s ILE 12 Ca -0.06 0.75 -0.32 0.00 -1.10 0.00 0.00 60.65 59.92 2gq3 s ILE 12 Cb -0.20 -3.74 -0.13 0.00 -1.06 0.00 0.00 42.46 37.34 2gq3 s ILE 12 CO -0.04 0.29 1.62 0.00 -0.10 0.00 0.00 174.94 176.70 2gq3 n ALA 13 N 4.13 2.04 -0.07 9.38 0.00 -0.70 -1.20 120.51 134.10 2gq3 n ALA 13 Ca -0.09 0.42 -0.07 0.00 0.00 0.00 0.00 53.44 53.70 2gq3 n ALA 13 Cb 0.51 -2.42 -0.01 0.00 0.00 0.00 0.00 19.45 17.53 2gq3 n ALA 13 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2gq3 h ARG 14 N 5.90 -0.19 -0.60 0.00 9.65 -1.90 0.94 114.38 128.17 2gq3 h ARG 14 Ca -0.44 0.01 0.09 0.00 -1.10 0.00 0.00 59.98 58.53 2gq3 h ARG 14 Cb 1.23 0.04 -0.09 0.00 -1.39 0.00 0.00 29.97 29.77 2gq3 h ARG 14 CO 0.89 -0.13 -0.25 0.28 2.80 0.00 0.00 179.97 183.55 2gq3 n VAL 15 N -5.37 -0.33 -0.04 0.20 0.31 -1.26 0.33 118.33 112.17 2gq3 n VAL 15 Ca -0.00 1.40 -0.14 0.00 -0.01 0.00 0.00 64.34 65.59 2gq3 n VAL 15 Cb 0.28 -1.83 -0.09 0.00 -0.91 0.00 0.00 33.84 31.29 2gq3 n VAL 15 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2gq3 h LEU 16 N 0.00 0.28 -0.76 7.52 5.85 -1.26 -2.86 115.31 124.09 2gq3 h LEU 16 Ca 0.19 -0.60 0.07 0.00 0.84 0.00 0.00 57.88 58.38 2gq3 h LEU 16 Cb 0.34 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.22 2gq3 h LEU 16 CO -0.59 0.83 0.43 0.22 -0.34 0.00 0.00 178.44 179.00 2gq3 h TYR 17 N -0.26 0.79 -0.01 1.25 3.20 -0.06 -1.12 116.97 120.77 2gq3 h TYR 17 Ca -0.00 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.74 2gq3 h TYR 17 Cb 0.80 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.80 2gq3 h TYR 17 CO 0.12 0.37 -0.69 -0.44 -1.64 0.00 0.00 178.16 175.88 2gq3 h ASP 18 N 0.78 0.08 0.52 -2.11 3.32 -0.20 -1.90 116.42 116.91 2gq3 h ASP 18 Ca 0.34 -0.05 -0.24 0.00 0.02 0.00 0.00 57.03 57.10 2gq3 h ASP 18 Cb 0.24 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 2gq3 h ASP 18 CO -0.20 0.74 -1.06 0.15 -1.72 0.00 0.00 179.24 177.16 2gq3 h PHE 19 N 0.05 0.49 0.05 4.55 3.57 -1.23 -2.68 116.94 121.73 2gq3 h PHE 19 Ca -0.01 -0.30 -0.00 0.00 3.53 0.00 0.00 57.97 61.18 2gq3 h PHE 19 Cb 1.22 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.92 2gq3 h PHE 19 CO 0.01 1.17 -0.03 0.28 -2.23 0.00 0.00 178.31 177.51 2gq3 h VAL 20 N 0.14 1.29 -0.41 1.41 2.07 -1.12 -0.44 116.25 119.19 2gq3 h VAL 20 Ca -0.09 -1.36 -0.02 0.00 0.82 0.00 0.00 66.70 66.05 2gq3 h VAL 20 Cb 1.73 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 33.64 2gq3 h VAL 20 CO 0.17 0.33 0.17 0.78 0.02 0.00 0.00 177.57 179.04 2gq3 h ASN 21 N -0.70 0.56 0.83 0.57 -0.26 -1.50 1.03 115.58 116.11 2gq3 h ASN 21 Ca -0.01 -0.16 -0.06 0.00 -0.56 0.00 0.00 56.30 55.51 2gq3 h ASN 21 Cb 0.59 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 37.70 2gq3 h ASN 21 CO 0.01 0.57 -1.21 0.59 -1.06 0.00 0.00 177.43 176.33 2gq3 n ASN 22 N -4.64 0.80 -0.01 5.81 3.02 -1.01 -4.25 115.26 114.98 2gq3 n ASN 22 Ca 0.00 0.32 -0.02 0.00 -0.03 0.00 0.00 54.58 54.86 2gq3 n ASN 22 Cb 0.14 0.44 -0.01 0.00 -0.61 0.00 0.00 39.78 39.74 2gq3 n ASN 22 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2gq3 n GLU 23 N -2.73 0.03 -0.08 3.52 1.02 -0.59 -4.80 120.64 117.02 2gq3 n GLU 23 Ca -0.04 0.01 -0.13 0.00 -0.02 0.00 0.00 57.16 56.99 2gq3 n GLU 23 Cb 0.66 -0.62 -0.08 0.00 -0.02 0.00 0.00 31.44 31.37 2gq3 n GLU 23 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gq3 h ALA 24 N -0.05 0.09 -0.35 0.62 0.00 -0.48 -3.39 119.26 115.70 2gq3 h ALA 24 Ca -0.04 -0.66 -0.05 0.00 0.00 0.00 0.00 54.91 54.16 2gq3 h ALA 24 Cb 1.04 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 2gq3 h ALA 24 CO -0.02 0.33 -0.02 -0.07 0.00 0.00 0.00 179.25 179.47 2gq3 h LEU 25 N -1.00 0.52 -9.99 0.00 3.38 0.87 -3.43 115.31 105.65 2gq3 h LEU 25 Ca -0.12 -0.10 -0.50 0.00 0.09 0.00 0.00 57.88 57.24 2gq3 h LEU 25 Cb 0.85 -0.14 0.06 0.00 0.09 0.00 0.00 40.66 41.52 2gq3 h LEU 25 CO -0.07 0.60 0.48 -2.84 0.09 0.00 0.00 178.44 176.69 2gq3 s PRO 26 N -4.94 3.82 0.00 1.13 0.02 -1.26 -2.62 135.00 131.15 2gq3 s PRO 26 Ca -0.08 1.74 0.00 0.00 0.02 0.00 0.00 61.00 62.69 2gq3 s PRO 26 Cb 0.15 -2.43 0.00 0.00 0.02 0.00 0.00 34.50 32.24 2gq3 s PRO 26 CO 0.77 -0.49 0.00 0.41 -0.33 0.00 0.00 177.00 177.36 2gq3 n GLY 27 N 0.43 2.08 0.11 0.52 0.00 -1.26 -4.83 105.19 102.25 2gq3 n GLY 27 Ca 0.07 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.91 2gq3 n GLY 27 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2gq3 h THR 28 N 0.00 1.24 0.00 2.61 1.35 -1.77 -3.44 112.91 112.89 2gq3 h THR 28 Ca 0.00 -2.84 0.00 0.00 -0.55 0.00 0.00 66.41 63.02 2gq3 h THR 28 Cb 0.00 2.82 0.00 0.00 -1.73 0.00 0.00 68.15 69.24 2gq3 h THR 28 CO 0.00 0.84 0.00 0.47 -0.25 0.00 0.00 175.52 176.58 2gq3 n ASP 29 N -3.50 0.00 -4.75 5.36 8.00 -1.26 -5.07 116.55 115.34 2gq3 n ASP 29 Ca -0.15 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 54.94 2gq3 n ASP 29 Cb 1.04 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 42.13 2gq3 n ASP 29 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2gq3 s ILE 30 N -2.12 2.26 0.02 0.53 -1.09 -1.26 -4.97 121.20 114.57 2gq3 s ILE 30 Ca 0.00 0.22 -0.30 0.00 -2.23 0.00 0.00 60.65 58.34 2gq3 s ILE 30 Cb 0.00 -3.14 -0.06 0.00 -1.58 0.00 0.00 42.46 37.68 2gq3 s ILE 30 CO 0.00 0.04 1.42 -0.62 -1.23 0.00 0.00 174.94 174.55 2gq3 s ASP 31 N 0.46 6.82 0.16 3.58 -1.08 -1.26 -4.93 116.67 120.42 2gq3 s ASP 31 Ca 0.62 2.18 -0.28 0.00 -0.52 0.00 0.00 52.55 54.55 2gq3 s ASP 31 Cb -0.46 -2.56 -0.01 0.00 -1.46 0.00 0.00 42.92 38.43 2gq3 s ASP 31 CO 0.46 -0.72 1.56 -0.65 0.52 0.00 0.00 175.17 176.33 2gq3 h PRO 32 N 7.74 -0.21 -0.28 4.34 0.11 -1.95 0.09 132.00 141.84 2gq3 h PRO 32 Ca -0.39 0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.82 2gq3 h PRO 32 Cb 1.19 0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2gq3 h PRO 32 CO 0.90 -0.14 0.23 -0.44 -0.21 0.00 0.00 178.00 178.34 2gq3 h ASP 33 N -0.22 0.00 0.11 -2.05 3.32 -2.00 -1.42 116.42 114.17 2gq3 h ASP 33 Ca 0.16 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.97 2gq3 h ASP 33 Cb 0.55 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.12 2gq3 h ASP 33 CO -0.73 0.00 -1.01 0.28 -1.72 0.00 0.00 179.24 176.06 2gq3 h SER 34 N 0.00 0.69 0.20 6.45 0.02 -1.46 -2.54 113.55 116.92 2gq3 h SER 34 Ca 0.13 -0.85 0.01 0.00 -0.84 0.00 0.00 61.79 60.24 2gq3 h SER 34 Cb 0.60 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.88 2gq3 h SER 34 CO -0.00 1.48 -0.40 0.15 -1.14 0.00 0.00 176.83 176.91 2gq3 h PHE 35 N 0.00 -1.12 -0.31 3.45 3.57 -0.04 0.07 116.94 122.56 2gq3 h PHE 35 Ca -0.16 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.34 2gq3 h PHE 35 Cb 1.73 0.47 -0.02 0.00 2.79 0.00 0.00 35.95 40.92 2gq3 h PHE 35 CO 0.15 -0.52 0.08 -1.49 -2.23 0.00 0.00 178.31 174.30 2gq3 h TRP 36 N -0.69 0.44 -0.48 0.41 4.06 -1.48 0.54 115.95 118.74 2gq3 h TRP 36 Ca 0.01 -0.02 0.05 0.00 2.06 0.00 0.00 58.89 60.99 2gq3 h TRP 36 Cb 0.69 -0.14 -0.05 0.00 -1.00 0.00 0.00 29.16 28.66 2gq3 h TRP 36 CO -0.31 0.38 0.22 0.00 -3.56 0.00 0.00 178.44 175.16 2gq3 h ALA 37 N 1.66 0.60 -0.12 1.49 0.00 -1.20 0.17 119.26 121.86 2gq3 h ALA 37 Ca 0.11 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2gq3 h ALA 37 Cb 0.16 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2gq3 h ALA 37 CO -0.01 -0.15 -0.11 0.78 0.00 0.00 0.00 179.25 179.76 2gq3 h GLY 38 N 0.43 0.31 0.30 0.00 0.00 -0.28 -2.34 103.07 101.48 2gq3 h GLY 38 Ca 0.22 -0.32 0.12 0.00 0.00 0.00 0.00 47.33 47.35 2gq3 h GLY 38 CO -0.18 0.29 0.31 -2.08 0.00 0.00 0.00 176.54 174.87 2gq3 h VAL 39 N -0.10 0.74 0.24 4.60 2.07 0.21 0.06 116.25 124.06 2gq3 h VAL 39 Ca 0.02 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 2gq3 h VAL 39 Cb 0.63 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2gq3 h VAL 39 CO 0.03 0.09 -0.20 -0.78 0.02 0.00 0.00 177.57 176.73 2gq3 h ASP 40 N 0.49 -0.52 -0.55 0.57 -0.00 -0.65 -2.63 116.42 113.12 2gq3 h ASP 40 Ca 0.37 0.04 -0.03 0.00 -0.00 0.00 0.00 57.03 57.42 2gq3 h ASP 40 Cb 0.50 0.17 -0.02 0.00 -0.00 0.00 0.00 39.33 39.98 2gq3 h ASP 40 CO -0.34 -0.30 0.24 0.50 -0.00 0.00 0.00 179.24 179.34 2gq3 h LYS 41 N -0.45 0.81 -0.21 0.28 3.64 -1.04 -0.53 116.57 119.07 2gq3 h LYS 41 Ca -0.01 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.19 2gq3 h LYS 41 Cb 0.41 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 2gq3 h LYS 41 CO -0.02 0.69 -0.02 0.28 -2.27 0.00 0.00 179.45 178.11 2gq3 h VAL 42 N 0.75 1.27 -0.29 2.00 2.07 -1.00 0.15 116.25 121.20 2gq3 h VAL 42 Ca 0.19 -0.95 0.07 0.00 0.82 0.00 0.00 66.70 66.82 2gq3 h VAL 42 Cb 0.16 1.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.34 2gq3 h VAL 42 CO -0.02 0.29 -0.23 0.58 0.02 0.00 0.00 177.57 178.21 2gq3 h VAL 43 N 0.13 0.40 -0.51 2.57 2.07 -1.49 -1.47 116.25 117.96 2gq3 h VAL 43 Ca 0.06 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.68 2gq3 h VAL 43 Cb 0.45 0.40 -0.10 0.00 -1.52 0.00 0.00 31.29 30.52 2gq3 h VAL 43 CO 0.02 0.00 -0.14 0.00 0.02 0.00 0.00 177.57 177.46 2gq3 h ALA 44 N 0.90 0.30 -0.03 1.67 0.00 -0.54 -2.47 119.26 119.09 2gq3 h ALA 44 Ca 0.15 0.20 -0.09 0.00 0.00 0.00 0.00 54.91 55.17 2gq3 h ALA 44 Cb 0.45 0.42 0.01 0.00 0.00 0.00 0.00 17.79 18.66 2gq3 h ALA 44 CO -0.41 -0.46 -0.34 -0.44 0.00 0.00 0.00 179.25 177.60 2gq3 h ASP 45 N -0.02 0.35 0.03 0.00 5.19 -0.45 -3.38 116.42 118.14 2gq3 h ASP 45 Ca 0.24 -0.71 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 2gq3 h ASP 45 Cb 0.39 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 39.80 2gq3 h ASP 45 CO -0.54 1.01 -1.95 0.18 -3.12 0.00 0.00 179.24 174.83 2gq3 n LEU 46 N -4.42 0.05 -0.24 1.55 4.77 -0.58 -4.30 117.00 113.83 2gq3 n LEU 46 Ca -0.09 -0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.92 2gq3 n LEU 46 Cb 0.53 -0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.78 2gq3 n LEU 46 CO 0.42 0.00 0.94 0.74 -1.33 0.00 0.00 177.39 178.15 2gq3 h THR 47 N 0.00 0.56 -0.66 -5.08 2.02 -1.61 -1.02 112.91 107.13 2gq3 h THR 47 Ca 0.00 -0.10 -0.06 0.00 0.77 0.00 0.00 66.41 67.02 2gq3 h THR 47 Cb 0.99 0.25 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 2gq3 h THR 47 CO 0.00 0.05 0.18 -0.65 0.37 0.00 0.00 175.52 175.47 2gq3 h PRO 48 N 0.28 1.05 -0.62 6.66 0.11 -1.79 -1.27 132.00 136.42 2gq3 h PRO 48 Ca 0.39 -0.24 -0.04 0.00 0.11 0.00 0.00 66.00 66.21 2gq3 h PRO 48 Cb 0.63 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.57 2gq3 h PRO 48 CO -0.47 0.93 0.23 0.37 -0.21 0.00 0.00 178.00 178.86 2gq3 h GLN 49 N 0.98 0.91 -0.61 1.05 4.15 -1.75 0.20 115.11 120.05 2gq3 h GLN 49 Ca 0.21 -0.15 0.04 0.00 0.77 0.00 0.00 58.65 59.52 2gq3 h GLN 49 Cb 0.34 -0.16 -0.05 0.00 0.21 0.00 0.00 27.48 27.83 2gq3 h GLN 49 CO -0.00 0.76 0.35 -0.97 -1.93 0.00 0.00 178.83 177.03 2gq3 h ASN 50 N 0.90 0.54 0.51 -0.69 -0.00 -0.74 0.02 115.58 116.13 2gq3 h ASN 50 Ca 0.21 0.02 -0.03 0.00 -0.00 0.00 0.00 56.30 56.50 2gq3 h ASN 50 Cb 0.19 -0.09 0.01 0.00 -0.00 0.00 0.00 38.32 38.43 2gq3 h ASN 50 CO -0.02 0.37 -0.25 1.56 -0.00 0.00 0.00 177.43 179.09 2gq3 h GLN 51 N 0.67 -0.67 -0.92 6.67 1.08 -0.34 -2.51 115.11 119.09 2gq3 h GLN 51 Ca 0.26 0.05 0.15 0.00 -1.45 0.00 0.00 58.65 57.66 2gq3 h GLN 51 Cb 0.10 0.15 -0.16 0.00 -0.05 0.00 0.00 27.48 27.52 2gq3 h GLN 51 CO -0.14 -0.40 -0.34 0.00 -0.95 0.00 0.00 178.83 177.00 2gq3 h ALA 52 N -0.35 0.24 -0.05 3.87 0.00 -0.47 0.41 119.26 122.92 2gq3 h ALA 52 Ca -0.07 0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2gq3 h ALA 52 Cb 0.57 0.91 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 2gq3 h ALA 52 CO 0.12 -0.57 0.02 -0.07 0.00 0.00 0.00 179.25 178.74 2gq3 h LEU 53 N -0.03 0.06 -0.69 0.00 3.38 -0.98 -0.72 115.31 116.33 2gq3 h LEU 53 Ca 0.36 -0.11 0.10 0.00 0.09 0.00 0.00 57.88 58.31 2gq3 h LEU 53 Cb 0.61 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.27 2gq3 h LEU 53 CO -0.94 0.15 0.32 -0.07 0.09 0.00 0.00 178.44 177.99 2gq3 h LEU 54 N -0.04 0.39 -1.03 1.67 3.38 -0.79 -1.55 115.31 117.34 2gq3 h LEU 54 Ca 0.02 0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 2gq3 h LEU 54 Cb 0.11 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2gq3 h LEU 54 CO -0.00 0.22 -0.00 0.78 0.09 0.00 0.00 178.44 179.52 2gq3 h ASN 55 N 0.54 0.66 -0.52 -0.43 2.35 -0.75 -2.67 115.58 114.76 2gq3 h ASN 55 Ca 0.35 -0.15 0.09 0.00 -0.55 0.00 0.00 56.30 56.04 2gq3 h ASN 55 Cb 0.40 -0.17 -0.08 0.00 0.05 0.00 0.00 38.32 38.52 2gq3 h ASN 55 CO -0.29 0.73 0.09 0.00 -1.65 0.00 0.00 177.43 176.31 2gq3 h ALA 56 N 1.35 0.58 -0.02 -0.83 0.00 -0.18 -0.82 119.26 119.33 2gq3 h ALA 56 Ca 0.13 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.19 2gq3 h ALA 56 Cb 0.41 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2gq3 h ALA 56 CO 0.02 -0.32 -0.17 0.00 0.00 0.00 0.00 179.25 178.77 2gq3 h ARG 57 N 0.22 -0.26 -0.25 0.00 3.08 -1.03 -2.16 114.38 113.98 2gq3 h ARG 57 Ca 0.27 0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.38 2gq3 h ARG 57 Cb 0.38 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.44 2gq3 h ARG 57 CO -0.36 -0.17 -0.04 -0.44 -1.07 0.00 0.00 179.97 177.89 2gq3 h ASP 58 N -0.26 -0.18 0.17 7.04 3.32 -1.24 -0.73 116.42 124.54 2gq3 h ASP 58 Ca 0.06 0.07 0.02 0.00 0.02 0.00 0.00 57.03 57.19 2gq3 h ASP 58 Cb 0.35 0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.99 2gq3 h ASP 58 CO -0.18 -0.06 -0.42 -0.33 -1.72 0.00 0.00 179.24 176.54 2gq3 h GLU 59 N 0.03 -0.66 -0.04 3.56 5.08 -1.13 -2.19 114.58 119.23 2gq3 h GLU 59 Ca 0.12 0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.56 2gq3 h GLU 59 Cb 0.18 0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.53 2gq3 h GLU 59 CO -0.24 -0.44 -0.26 -0.07 -1.00 0.00 0.00 179.01 177.00 2gq3 h LEU 60 N -0.68 -0.79 -1.62 1.33 3.38 -1.15 -0.85 115.31 114.93 2gq3 h LEU 60 Ca 0.01 0.11 0.20 0.00 0.09 0.00 0.00 57.88 58.29 2gq3 h LEU 60 Cb 0.69 0.33 -0.06 0.00 0.09 0.00 0.00 40.66 41.71 2gq3 h LEU 60 CO -0.21 -0.33 0.58 -0.61 0.09 0.00 0.00 178.44 177.96 2gq3 h GLN 61 N -0.38 0.32 -0.00 1.13 5.75 -1.03 -0.24 115.11 120.65 2gq3 h GLN 61 Ca 0.07 -0.02 -0.14 0.00 -0.15 0.00 0.00 58.65 58.41 2gq3 h GLN 61 Cb 0.49 -0.07 0.01 0.00 1.07 0.00 0.00 27.48 28.98 2gq3 h GLN 61 CO -0.26 0.21 -0.55 0.00 -2.65 0.00 0.00 178.83 175.58 2gq3 h ALA 62 N 1.61 0.07 -0.59 3.38 0.00 -0.55 -1.02 119.26 122.17 2gq3 h ALA 62 Ca 0.44 -0.55 0.12 0.00 0.00 0.00 0.00 54.91 54.91 2gq3 h ALA 62 Cb 1.19 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.91 2gq3 h ALA 62 CO -0.13 0.31 -0.09 1.96 0.00 0.00 0.00 179.25 181.29 2gq3 h GLN 63 N -0.16 0.04 -0.30 0.00 4.20 -0.70 0.07 115.11 118.26 2gq3 h GLN 63 Ca -0.07 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 2gq3 h GLN 63 Cb 1.27 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 2gq3 h GLN 63 CO 0.11 0.02 0.10 0.82 -0.67 0.00 0.00 178.83 179.21 2gq3 h ILE 64 N 0.04 1.20 -0.71 2.54 2.04 -0.91 0.14 117.51 121.85 2gq3 h ILE 64 Ca 0.29 -0.64 0.13 0.00 1.00 0.00 0.00 64.86 65.64 2gq3 h ILE 64 Cb 0.46 1.06 -0.09 0.00 -0.74 0.00 0.00 36.82 37.51 2gq3 h ILE 64 CO -0.57 0.22 0.26 0.44 0.00 0.00 0.00 178.15 178.50 2gq3 h ASP 65 N 0.33 0.23 0.22 1.72 3.45 -0.97 -1.06 116.42 120.33 2gq3 h ASP 65 Ca 0.10 0.10 -0.01 0.00 0.43 0.00 0.00 57.03 57.65 2gq3 h ASP 65 Cb 0.24 0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.11 2gq3 h ASP 65 CO -0.00 0.09 -0.10 0.50 -1.57 0.00 0.00 179.24 178.16 2gq3 h LYS 66 N 0.41 -0.28 -0.75 3.56 3.64 -0.56 -0.57 116.57 122.03 2gq3 h LYS 66 Ca 0.38 0.02 0.17 0.00 -1.27 0.00 0.00 60.65 59.95 2gq3 h LYS 66 Cb 0.56 0.06 -0.13 0.00 -0.41 0.00 0.00 32.23 32.31 2gq3 h LYS 66 CO -0.39 0.08 -0.04 2.35 -2.27 0.00 0.00 179.45 179.17 2gq3 h TRP 67 N -0.71 -0.14 -0.21 1.91 7.01 -0.62 -2.23 115.95 120.96 2gq3 h TRP 67 Ca -0.03 0.06 -0.05 0.00 2.11 0.00 0.00 58.89 60.98 2gq3 h TRP 67 Cb 0.49 0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.72 2gq3 h TRP 67 CO 0.04 -0.26 -0.06 0.45 -2.79 0.00 0.00 178.44 175.82 2gq3 h HIS 68 N 0.07 0.47 -0.90 2.65 3.86 -0.97 -3.22 115.15 117.11 2gq3 h HIS 68 Ca 0.40 -0.10 0.13 0.00 -1.16 0.00 0.00 60.37 59.63 2gq3 h HIS 68 Cb 0.68 -0.11 -0.07 0.00 1.06 0.00 0.00 27.41 28.96 2gq3 h HIS 68 CO -0.46 0.67 0.58 0.00 0.86 0.00 0.00 177.93 179.57 2gq3 h ARG 69 N 0.14 0.73 0.00 2.45 3.08 -0.72 0.65 114.38 120.70 2gq3 h ARG 69 Ca 0.05 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2gq3 h ARG 69 Cb 0.52 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.40 2gq3 h ARG 69 CO 0.02 0.48 0.23 -0.09 -1.07 0.00 0.00 179.97 179.54 2gq3 h ARG 70 N 0.75 0.00 -0.13 0.04 9.65 -1.43 -3.31 114.38 119.95 2gq3 h ARG 70 Ca 0.44 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 59.13 2gq3 h ARG 70 Cb 0.64 0.00 -0.37 0.00 -1.39 0.00 0.00 29.97 28.85 2gq3 h ARG 70 CO -0.21 0.00 -1.02 0.54 2.80 0.00 0.00 179.97 182.09 2gq3 n ARG 71 N -2.85 0.66 -3.16 0.20 1.74 0.22 -5.11 116.66 108.35 2gq3 n ARG 71 Ca -0.02 -2.54 -0.33 0.00 -0.77 0.00 0.00 57.85 54.18 2gq3 n ARG 71 Cb 0.28 -0.59 -0.06 0.00 -1.02 0.00 0.00 32.46 31.07 2gq3 n ARG 71 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2gq3 s VAL 72 N -1.34 4.68 -1.82 1.55 0.11 -1.04 -3.70 120.40 118.84 2gq3 s VAL 72 Ca 0.33 0.98 0.00 0.00 -2.93 0.00 0.00 61.98 60.36 2gq3 s VAL 72 Cb 0.37 -3.68 0.00 0.00 -1.53 0.00 0.00 36.38 31.54 2gq3 s VAL 72 CO -0.12 -0.05 0.00 2.30 -3.33 0.00 0.00 175.10 173.89 2gq3 n ILE 73 N -0.01 -0.33 -4.79 7.04 -5.35 -1.26 -4.98 119.36 109.68 2gq3 n ILE 73 Ca 0.01 0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.17 2gq3 n ILE 73 Cb 0.52 -2.14 -0.13 0.00 -1.74 0.00 0.00 39.64 36.16 2gq3 n ILE 73 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2gq3 s GLU 74 N -4.07 2.47 0.11 6.28 2.02 -1.24 -5.08 118.70 119.19 2gq3 s GLU 74 Ca 0.00 -0.73 -0.31 0.00 0.02 0.00 0.00 54.97 53.95 2gq3 s GLU 74 Cb 0.00 -2.38 -0.10 0.00 0.10 0.00 0.00 34.13 31.75 2gq3 s GLU 74 CO 0.00 0.61 1.71 -1.25 0.02 0.00 0.00 175.26 176.35 2gq3 s PRO 75 N -0.92 4.17 0.14 0.39 0.04 -1.26 -4.93 135.00 132.63 2gq3 s PRO 75 Ca 0.13 2.45 -0.30 0.00 0.04 0.00 0.00 61.00 63.32 2gq3 s PRO 75 Cb -0.11 -3.49 -0.08 0.00 0.04 0.00 0.00 34.50 30.87 2gq3 s PRO 75 CO 0.02 -0.76 1.28 -1.50 0.04 0.00 0.00 177.00 176.09 2gq3 s ILE 76 N 2.33 3.50 -0.73 0.56 2.07 -1.26 -4.97 121.20 122.70 2gq3 s ILE 76 Ca 0.76 1.15 -0.27 0.00 -1.41 0.00 0.00 60.65 60.88 2gq3 s ILE 76 Cb -0.43 -3.74 0.03 0.00 0.13 0.00 0.00 42.46 38.45 2gq3 s ILE 76 CO 0.34 0.13 1.25 -0.62 -1.91 0.00 0.00 174.94 174.12 2gq3 s ASP 77 N 0.69 6.17 0.37 4.50 3.68 -1.26 -4.91 116.67 125.91 2gq3 s ASP 77 Ca 0.59 -0.47 0.07 0.00 2.13 0.00 0.00 52.55 54.87 2gq3 s ASP 77 Cb -0.34 -2.55 0.71 0.00 -1.45 0.00 0.00 42.92 39.29 2gq3 s ASP 77 CO 0.33 -1.79 1.89 0.24 0.13 0.00 0.00 175.17 175.98 2gq3 h MET 78 N 9.97 0.34 -0.46 4.34 2.86 -1.98 0.19 114.93 130.19 2gq3 h MET 78 Ca -0.28 -0.08 -0.09 0.00 -2.06 0.00 0.00 59.70 57.19 2gq3 h MET 78 Cb 1.05 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 2gq3 h MET 78 CO 1.27 0.45 -0.08 -0.44 1.06 0.00 0.00 176.91 179.16 2gq3 h ASP 79 N 0.33 0.87 -0.20 1.22 3.32 -1.98 -0.44 116.42 119.53 2gq3 h ASP 79 Ca 0.07 -0.35 -0.03 0.00 0.02 0.00 0.00 57.03 56.74 2gq3 h ASP 79 Cb 0.37 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 2gq3 h ASP 79 CO 0.02 1.01 0.03 0.00 -1.72 0.00 0.00 179.24 178.58 2gq3 h ALA 80 N 0.88 0.27 -0.80 3.45 0.00 -1.84 -1.28 119.26 119.94 2gq3 h ALA 80 Ca 0.12 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2gq3 h ALA 80 Cb 0.62 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 2gq3 h ALA 80 CO 0.04 -0.05 0.53 -0.92 0.00 0.00 0.00 179.25 178.85 2gq3 h TYR 81 N 0.13 0.98 -0.16 0.00 3.20 -0.97 -0.34 116.97 119.82 2gq3 h TYR 81 Ca 0.06 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.80 2gq3 h TYR 81 Cb 0.33 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.28 2gq3 h TYR 81 CO 0.02 0.59 -0.51 -0.09 -1.64 0.00 0.00 178.16 176.54 2gq3 h ARG 82 N 1.03 0.62 -0.60 1.82 2.43 -1.06 -1.39 114.38 117.23 2gq3 h ARG 82 Ca 0.31 -0.46 0.01 0.00 -0.81 0.00 0.00 59.98 59.03 2gq3 h ARG 82 Cb -0.04 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 2gq3 h ARG 82 CO -0.08 1.08 0.40 0.37 -1.51 0.00 0.00 179.97 180.23 2gq3 h GLN 83 N 0.28 0.77 -0.10 0.20 4.15 -0.92 -1.85 115.11 117.64 2gq3 h GLN 83 Ca -0.02 -0.05 -0.08 0.00 0.77 0.00 0.00 58.65 59.28 2gq3 h GLN 83 Cb 1.13 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.65 2gq3 h GLN 83 CO 0.11 0.51 -0.23 0.35 -1.93 0.00 0.00 178.83 177.63 2gq3 h PHE 84 N 0.79 0.43 0.00 3.99 3.57 -0.86 0.28 116.94 125.14 2gq3 h PHE 84 Ca 0.22 -0.16 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2gq3 h PHE 84 Cb -0.05 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.61 2gq3 h PHE 84 CO -0.00 0.85 -0.09 -0.07 -2.23 0.00 0.00 178.31 176.77 2gq3 h LEU 85 N -0.11 0.00 0.04 0.59 3.38 -1.09 0.08 115.31 118.20 2gq3 h LEU 85 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2gq3 h LEU 85 Cb 0.84 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.60 2gq3 h LEU 85 CO 0.05 0.09 -0.40 0.74 0.09 0.00 0.00 178.44 179.01 2gq3 h THR 86 N 0.00 1.58 0.00 0.22 2.02 -1.09 0.16 112.91 115.80 2gq3 h THR 86 Ca -0.00 -2.23 -0.01 0.00 0.77 0.00 0.00 66.41 64.94 2gq3 h THR 86 Cb 0.23 3.02 -0.00 0.00 -1.74 0.00 0.00 68.15 69.66 2gq3 h THR 86 CO 0.01 0.61 -0.05 1.05 0.37 0.00 0.00 175.52 177.52 2gq3 h GLU 87 N -0.53 0.00 -0.01 6.66 4.11 0.39 -2.08 114.58 123.11 2gq3 h GLU 87 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.37 2gq3 h GLU 87 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2gq3 h GLU 87 CO 0.08 0.05 -0.18 0.44 0.07 0.00 0.00 179.01 179.46 2gq3 n ILE 88 N -4.09 0.00 -0.94 -1.06 -5.35 -0.06 -4.94 119.36 102.91 2gq3 n ILE 88 Ca -0.03 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.24 2gq3 n ILE 88 Cb 0.14 0.64 0.00 0.00 -1.74 0.00 0.00 39.64 38.68 2gq3 n ILE 88 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2gq3 n GLY 89 N 1.30 0.51 0.21 3.28 0.00 -0.78 -4.93 105.19 104.78 2gq3 n GLY 89 Ca 0.14 -0.15 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 2gq3 n GLY 89 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2gq3 h TYR 90 N 0.00 1.02 -3.66 1.61 3.20 -1.32 -3.42 116.97 114.41 2gq3 h TYR 90 Ca 0.00 -0.49 -0.68 0.00 3.14 0.00 0.00 58.73 60.71 2gq3 h TYR 90 Cb 0.00 -0.14 -0.22 0.00 1.54 0.00 0.00 36.73 37.90 2gq3 h TYR 90 CO 0.00 1.32 -0.55 -1.17 -1.64 0.00 0.00 178.16 176.11 2gq3 s LEU 91 N -8.35 4.15 0.14 2.82 2.96 0.38 -4.92 118.68 115.86 2gq3 s LEU 91 Ca -0.11 -0.54 0.05 0.00 -0.22 0.00 0.00 54.13 53.31 2gq3 s LEU 91 Cb 0.08 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 2gq3 s LEU 91 CO 0.90 -0.20 0.11 -0.76 -1.32 0.00 0.00 176.35 175.08 2gq3 s LEU 92 N 1.61 3.76 0.32 -0.68 1.43 -1.26 -4.31 118.68 119.55 2gq3 s LEU 92 Ca 0.04 -0.12 -0.28 0.00 -1.03 0.00 0.00 54.13 52.74 2gq3 s LEU 92 Cb -0.17 -2.39 -0.13 0.00 0.03 0.00 0.00 46.19 43.53 2gq3 s LEU 92 CO 0.06 0.10 1.20 -2.65 0.23 0.00 0.00 176.35 175.29 2gq3 n PRO 93 N -0.10 1.86 -2.63 1.29 -0.02 -1.26 -4.94 135.00 129.19 2gq3 n PRO 93 Ca -0.09 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 2gq3 n PRO 93 Cb 0.54 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 2gq3 n PRO 93 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2gq3 s GLU 94 N -1.70 4.49 0.95 -0.52 2.12 -1.26 -4.89 118.70 117.89 2gq3 s GLU 94 Ca 0.57 1.50 -0.13 0.00 0.36 0.00 0.00 54.97 57.28 2gq3 s GLU 94 Cb -0.62 -3.47 0.16 0.00 0.26 0.00 0.00 34.13 30.47 2gq3 s GLU 94 CO 0.61 -0.19 1.13 -1.25 -0.54 0.00 0.00 175.26 175.02 2gq3 s PRO 95 N 1.36 0.79 0.69 4.30 0.04 -1.26 -5.03 135.00 135.89 2gq3 s PRO 95 Ca 0.53 0.33 -0.17 0.00 0.04 0.00 0.00 61.00 61.73 2gq3 s PRO 95 Cb -0.22 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2gq3 s PRO 95 CO 0.25 -2.45 1.10 -0.25 0.04 0.00 0.00 177.00 175.70 2gq3 n ASP 96 N -3.94 1.11 -4.67 6.66 8.00 -1.26 -4.96 116.55 117.49 2gq3 n ASP 96 Ca 0.06 0.73 -0.41 0.00 0.71 0.00 0.00 54.79 55.88 2gq3 n ASP 96 Cb 0.59 -1.47 0.02 0.00 -0.02 0.00 0.00 41.12 40.24 2gq3 n ASP 96 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2gq3 n ASP 97 N -1.85 1.99 -3.80 -2.24 8.00 -1.26 -5.02 116.55 112.37 2gq3 n ASP 97 Ca 0.14 1.06 -0.09 0.00 0.71 0.00 0.00 54.79 56.61 2gq3 n ASP 97 Cb 0.49 -1.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.11 2gq3 n ASP 97 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2gq3 s PHE 98 N -1.25 -0.10 -0.04 1.24 -0.12 -1.26 -5.16 117.98 111.29 2gq3 s PHE 98 Ca 0.63 -0.28 0.06 0.00 -0.05 0.00 0.00 56.93 57.29 2gq3 s PHE 98 Cb -0.52 0.49 -0.01 0.00 -0.63 0.00 0.00 43.02 42.35 2gq3 s PHE 98 CO 0.56 -1.05 -0.24 0.99 -0.05 0.00 0.00 175.22 175.44 2gq3 s THR 99 N -3.91 1.94 0.72 -4.49 2.01 -1.26 -4.37 115.64 106.28 2gq3 s THR 99 Ca 0.12 -1.02 -0.16 0.00 0.31 0.00 0.00 61.69 60.94 2gq3 s THR 99 Cb -0.03 -1.63 0.03 0.00 0.01 0.00 0.00 72.50 70.88 2gq3 s THR 99 CO 0.02 0.54 1.24 0.27 -0.69 0.00 0.00 174.62 176.01 2gq3 s ILE 100 N -0.26 2.10 0.00 1.82 -4.36 -0.38 -4.96 121.20 115.15 2gq3 s ILE 100 Ca 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 60.65 60.44 2gq3 s ILE 100 Cb -0.12 -2.73 0.00 0.00 1.25 0.00 0.00 42.46 40.86 2gq3 s ILE 100 CO 0.02 -0.02 0.95 0.35 0.24 0.00 0.00 174.94 176.48 2gq3 n THR 101 N -2.59 0.90 -1.68 8.37 -2.24 0.31 -5.02 114.28 112.32 2gq3 n THR 101 Ca 0.14 -0.90 -0.45 0.00 -2.27 0.00 0.00 64.05 60.57 2gq3 n THR 101 Cb 0.49 0.55 -0.04 0.00 -2.10 0.00 0.00 70.33 69.24 2gq3 n THR 101 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2gq3 n THR 102 N -0.45 0.20 -4.54 4.28 -1.04 -1.10 -4.88 114.28 106.76 2gq3 n THR 102 Ca 0.00 -0.04 -0.25 0.00 -2.04 0.00 0.00 64.05 61.72 2gq3 n THR 102 Cb 0.27 -1.83 -0.10 0.00 -1.82 0.00 0.00 70.33 66.85 2gq3 n THR 102 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2gq3 s SER 103 N 1.97 2.98 0.00 8.00 1.04 -1.26 -4.80 113.70 121.63 2gq3 s SER 103 Ca 0.81 -1.49 0.00 0.00 0.48 0.00 0.00 55.95 55.76 2gq3 s SER 103 Cb -0.60 0.09 0.00 0.00 0.10 0.00 0.00 66.02 65.61 2gq3 s SER 103 CO 0.39 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.53 2gq3 n GLY 104 N -0.87 0.52 3.68 7.32 0.00 -1.26 -5.02 105.19 109.56 2gq3 n GLY 104 Ca -0.06 -0.87 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 2gq3 n GLY 104 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gq3 s VAL 105 N -2.00 5.27 0.53 1.61 1.01 -1.26 -4.37 120.40 121.19 2gq3 s VAL 105 Ca 0.00 0.51 -0.22 0.00 0.00 0.00 0.00 61.98 62.27 2gq3 s VAL 105 Cb 0.00 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 2gq3 s VAL 105 CO 0.00 0.31 1.38 -1.81 0.00 0.00 0.00 175.10 174.99 2gq3 s ASP 106 N 0.90 5.35 0.44 3.32 1.01 -1.26 -4.77 116.67 121.66 2gq3 s ASP 106 Ca 0.15 2.82 0.19 0.00 0.71 0.00 0.00 52.55 56.42 2gq3 s ASP 106 Cb -0.14 -2.64 1.13 0.00 1.01 0.00 0.00 42.92 42.28 2gq3 s ASP 106 CO 0.06 -1.52 1.88 0.00 0.21 0.00 0.00 175.17 175.80 2gq3 h ALA 107 N 1.61 2.26 -0.47 5.23 0.00 -1.97 -1.73 119.26 124.19 2gq3 h ALA 107 Ca -0.51 0.01 0.14 0.00 0.00 0.00 0.00 54.91 54.54 2gq3 h ALA 107 Cb 1.30 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2gq3 h ALA 107 CO 0.58 -0.51 0.44 0.93 0.00 0.00 0.00 179.25 180.68 2gq3 h GLU 108 N 0.35 0.00 0.00 0.00 3.07 -1.91 0.17 114.58 116.27 2gq3 h GLU 108 Ca 0.43 0.00 -0.27 0.00 -0.50 0.00 0.00 59.36 59.02 2gq3 h GLU 108 Cb 1.14 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 29.01 2gq3 h GLU 108 CO -0.14 0.00 -1.89 -0.89 -1.40 0.00 0.00 179.01 174.69 2gq3 n ILE 109 N -3.90 1.52 0.06 3.13 5.41 -0.67 -4.14 119.36 120.77 2gq3 n ILE 109 Ca 0.09 -0.16 -0.04 0.00 1.00 0.00 0.00 62.75 63.63 2gq3 n ILE 109 Cb 0.63 -2.08 0.17 0.00 -0.71 0.00 0.00 39.64 37.65 2gq3 n ILE 109 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 2gq3 h THR 110 N -1.00 1.32 0.00 1.39 1.35 -1.47 -3.33 112.91 111.16 2gq3 h THR 110 Ca -0.41 -1.60 -0.07 0.00 -0.55 0.00 0.00 66.41 63.78 2gq3 h THR 110 Cb 1.35 1.68 -0.01 0.00 -1.73 0.00 0.00 68.15 69.44 2gq3 h THR 110 CO -0.25 0.49 -1.25 0.41 -0.25 0.00 0.00 175.52 174.67 2gq3 n THR 111 N -4.01 0.25 -2.90 6.82 -1.04 0.54 -3.53 114.28 110.42 2gq3 n THR 111 Ca -0.02 -0.08 -0.41 0.00 -2.04 0.00 0.00 64.05 61.50 2gq3 n THR 111 Cb 0.51 -1.00 -0.04 0.00 -1.82 0.00 0.00 70.33 67.98 2gq3 n THR 111 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2gq3 s THR 112 N -2.08 4.90 -0.31 12.58 2.01 -0.80 -4.99 115.64 126.95 2gq3 s THR 112 Ca -0.06 1.63 -0.20 0.00 0.31 0.00 0.00 61.69 63.38 2gq3 s THR 112 Cb 0.02 -4.14 -0.01 0.00 0.01 0.00 0.00 72.50 68.38 2gq3 s THR 112 CO 0.09 0.06 0.60 0.00 -0.69 0.00 0.00 174.62 174.69 2gq3 s ALA 113 N 1.90 3.53 0.18 7.40 0.00 -1.26 -4.68 121.76 128.83 2gq3 s ALA 113 Ca 0.39 -0.69 -0.16 0.00 0.00 0.00 0.00 51.96 51.50 2gq3 s ALA 113 Cb -0.17 -3.07 0.06 0.00 0.00 0.00 0.00 23.12 19.94 2gq3 s ALA 113 CO 0.14 -1.06 0.80 0.41 0.00 0.00 0.00 175.76 176.05 2gq3 n GLY 114 N 4.47 0.81 3.72 0.00 0.00 -0.67 -4.91 105.19 108.61 2gq3 n GLY 114 Ca -0.02 -1.12 -0.34 0.00 0.00 0.00 0.00 46.02 44.54 2gq3 n GLY 114 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2gq3 s PRO 115 N -2.05 2.22 -0.11 1.61 0.02 -1.25 -4.14 135.00 131.29 2gq3 s PRO 115 Ca 0.18 1.78 0.03 0.00 0.02 0.00 0.00 61.00 63.00 2gq3 s PRO 115 Cb -0.03 -1.84 0.01 0.00 0.02 0.00 0.00 34.50 32.66 2gq3 s PRO 115 CO 0.05 -1.78 -0.19 -1.14 -0.33 0.00 0.00 177.00 173.61 2gq3 s GLN 116 N -3.85 2.54 -0.02 5.54 0.74 -0.86 -1.99 119.66 121.76 2gq3 s GLN 116 Ca 0.75 -0.69 -0.01 0.00 0.05 0.00 0.00 55.36 55.46 2gq3 s GLN 116 Cb -0.30 -2.04 -0.04 0.00 1.10 0.00 0.00 33.01 31.73 2gq3 s GLN 116 CO 0.44 0.03 0.06 -1.17 -0.55 0.00 0.00 175.29 174.11 2gq3 s LEU 117 N 0.72 3.84 0.10 3.68 2.96 -0.87 -2.07 118.68 127.03 2gq3 s LEU 117 Ca -0.11 0.15 0.08 0.00 -0.22 0.00 0.00 54.13 54.02 2gq3 s LEU 117 Cb -0.16 -2.17 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 2gq3 s LEU 117 CO 0.02 0.30 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.45 2gq3 s VAL 118 N -1.13 1.68 -0.28 1.68 1.01 -1.22 -0.32 120.40 121.83 2gq3 s VAL 118 Ca 0.21 -1.51 -0.22 0.00 0.00 0.00 0.00 61.98 60.46 2gq3 s VAL 118 Cb -0.12 -1.53 0.09 0.00 0.00 0.00 0.00 36.38 34.82 2gq3 s VAL 118 CO 0.11 -0.05 0.78 0.54 0.00 0.00 0.00 175.10 176.49 2gq3 s VAL 119 N -1.14 0.00 0.03 2.92 0.11 -0.86 -4.79 120.40 116.66 2gq3 s VAL 119 Ca 0.06 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.81 2gq3 s VAL 119 Cb -0.10 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.69 2gq3 s VAL 119 CO 0.04 0.00 1.50 -2.16 -3.33 0.00 0.00 175.10 171.15 2gq3 s PRO 120 N 0.78 4.25 0.16 1.54 0.04 -1.26 -0.25 135.00 140.26 2gq3 s PRO 120 Ca -0.03 2.11 0.22 0.00 0.04 0.00 0.00 61.00 63.34 2gq3 s PRO 120 Cb -0.05 -3.58 0.88 0.00 0.04 0.00 0.00 34.50 31.79 2gq3 s PRO 120 CO -0.07 -0.64 1.67 1.55 0.04 0.00 0.00 177.00 179.55 2gq3 n VAL 121 N 4.69 0.78 0.40 -0.36 3.14 -0.44 -2.19 118.33 124.36 2gq3 n VAL 121 Ca 0.14 0.15 0.12 0.00 -2.96 0.00 0.00 64.34 61.79 2gq3 n VAL 121 Cb 0.42 -0.99 0.21 0.00 -1.06 0.00 0.00 33.84 32.43 2gq3 n VAL 121 CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 2gq3 h LEU 122 N 0.00 0.00 -8.23 6.55 5.85 -1.89 -3.40 115.31 114.18 2gq3 h LEU 122 Ca 0.00 -0.05 -0.69 0.00 0.84 0.00 0.00 57.88 57.98 2gq3 h LEU 122 Cb 0.40 0.00 -0.19 0.00 0.37 0.00 0.00 40.66 41.23 2gq3 h LEU 122 CO 0.00 0.03 0.11 0.21 -0.34 0.00 0.00 178.44 178.45 2gq3 s ASN 123 N -5.10 6.19 0.22 1.25 3.84 -0.93 -4.95 114.94 115.47 2gq3 s ASN 123 Ca 0.07 -1.26 -0.08 0.00 0.21 0.00 0.00 52.86 51.79 2gq3 s ASN 123 Cb 0.10 -2.30 0.19 0.00 -0.55 0.00 0.00 41.25 38.68 2gq3 s ASN 123 CO 0.68 -1.07 1.87 0.00 -2.79 0.00 0.00 177.10 175.80 2gq3 h ALA 124 N 9.15 1.08 -0.44 1.71 0.00 -1.84 0.20 119.26 129.11 2gq3 h ALA 124 Ca -0.29 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.41 2gq3 h ALA 124 Cb 1.09 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2gq3 h ALA 124 CO 1.07 0.53 -0.20 -0.09 0.00 0.00 0.00 179.25 180.56 2gq3 h ARG 125 N 1.16 0.88 0.03 0.00 1.12 -1.92 -1.72 114.38 113.92 2gq3 h ARG 125 Ca 0.30 -0.35 -0.11 0.00 -1.11 0.00 0.00 59.98 58.72 2gq3 h ARG 125 Cb -0.05 -0.04 0.01 0.00 -0.01 0.00 0.00 29.97 29.87 2gq3 h ARG 125 CO -0.06 1.00 -0.43 0.74 -3.11 0.00 0.00 179.97 178.11 2gq3 h PHE 126 N 0.77 0.37 -0.95 2.20 0.05 -1.84 -1.54 116.94 116.00 2gq3 h PHE 126 Ca 0.11 -0.23 0.08 0.00 3.82 0.00 0.00 57.97 61.75 2gq3 h PHE 126 Cb 0.74 -0.03 -0.07 0.00 2.00 0.00 0.00 35.95 38.58 2gq3 h PHE 126 CO 0.04 1.08 0.61 0.00 -0.18 0.00 0.00 178.31 179.87 2gq3 h ALA 127 N 0.20 1.51 -0.13 2.45 0.00 -0.54 -1.92 119.26 120.83 2gq3 h ALA 127 Ca -0.06 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 2gq3 h ALA 127 Cb 1.22 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2gq3 h ALA 127 CO 0.08 0.32 -0.64 1.25 0.00 0.00 0.00 179.25 180.26 2gq3 h LEU 128 N 1.04 0.55 -0.95 0.00 6.46 -1.32 -2.38 115.31 118.71 2gq3 h LEU 128 Ca 0.43 -0.33 -0.11 0.00 -0.12 0.00 0.00 57.88 57.75 2gq3 h LEU 128 Cb 0.29 -0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.04 2gq3 h LEU 128 CO -0.18 1.05 -0.52 -1.13 -0.62 0.00 0.00 178.44 177.04 2gq3 h ASN 129 N 0.35 0.00 0.17 1.25 -0.00 -0.70 -2.16 115.58 114.49 2gq3 h ASN 129 Ca -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.28 2gq3 h ASN 129 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.52 2gq3 h ASN 129 CO 0.12 0.52 -0.08 0.00 -0.00 0.00 0.00 177.43 177.98 2gq3 h ALA 130 N 1.48 -0.25 -1.36 1.57 0.00 -1.20 -2.19 119.26 117.31 2gq3 h ALA 130 Ca -0.01 -0.05 0.47 0.00 0.00 0.00 0.00 54.91 55.33 2gq3 h ALA 130 Cb 0.93 0.09 -0.14 0.00 0.00 0.00 0.00 17.79 18.67 2gq3 h ALA 130 CO 0.07 -0.23 0.87 0.00 0.00 0.00 0.00 179.25 179.95 2gq3 n ALA 131 N -2.69 1.35 1.52 0.00 0.00 -0.91 0.15 120.51 119.93 2gq3 n ALA 131 Ca -0.03 0.87 0.14 0.00 0.00 0.00 0.00 53.44 54.43 2gq3 n ALA 131 Cb 0.09 -1.06 0.63 0.00 0.00 0.00 0.00 19.45 19.12 2gq3 n ALA 131 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2gq3 n ASN 132 N -4.73 0.67 -0.05 0.00 3.02 -0.81 -0.93 115.26 112.42 2gq3 n ASN 132 Ca 0.40 -0.89 0.15 0.00 -0.03 0.00 0.00 54.58 54.22 2gq3 n ASN 132 Cb 1.55 -0.03 0.82 0.00 -0.61 0.00 0.00 39.78 41.52 2gq3 n ASN 132 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gq3 n ALA 133 N -0.68 2.64 -0.32 5.41 0.00 0.40 -3.41 120.51 124.54 2gq3 n ALA 133 Ca 0.17 -0.21 0.29 0.00 0.00 0.00 0.00 53.44 53.68 2gq3 n ALA 133 Cb 0.27 -1.46 0.63 0.00 0.00 0.00 0.00 19.45 18.89 2gq3 n ALA 133 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2gq3 h ARG 134 N 0.26 0.19 -4.97 0.00 9.65 -1.70 -2.56 114.38 115.24 2gq3 h ARG 134 Ca 0.00 -0.01 -0.62 0.00 -1.10 0.00 0.00 59.98 58.25 2gq3 h ARG 134 Cb 0.17 -0.04 -0.34 0.00 -1.39 0.00 0.00 29.97 28.37 2gq3 h ARG 134 CO 0.00 0.13 -0.85 -1.58 2.80 0.00 0.00 179.97 180.46 2gq3 s TRP 135 N -5.23 2.16 -0.10 2.20 0.52 -1.22 0.22 118.94 117.49 2gq3 s TRP 135 Ca -0.07 -0.94 -0.11 0.00 0.02 0.00 0.00 56.10 55.01 2gq3 s TRP 135 Cb 0.24 -1.50 0.03 0.00 -1.15 0.00 0.00 33.47 31.09 2gq3 s TRP 135 CO 0.80 -0.43 0.30 0.20 0.02 0.00 0.00 176.95 177.84 2gq3 s GLY 136 N 0.66 -0.21 -0.11 0.98 0.00 0.48 -4.97 107.32 104.15 2gq3 s GLY 136 Ca -0.13 0.79 -0.30 0.00 0.00 0.00 0.00 44.72 45.09 2gq3 s GLY 136 CO 0.03 0.67 1.19 -0.45 0.00 0.00 0.00 173.10 174.54 2gq3 s SER 137 N 0.03 7.04 0.22 1.64 0.15 -1.26 0.12 113.70 121.63 2gq3 s SER 137 Ca -0.01 1.72 -0.07 0.00 0.70 0.00 0.00 55.95 58.29 2gq3 s SER 137 Cb -0.02 -2.55 0.18 0.00 -1.71 0.00 0.00 66.02 61.92 2gq3 s SER 137 CO 0.01 -0.64 1.75 0.25 1.20 0.00 0.00 173.24 175.82 2gq3 h LEU 138 N 8.77 1.04 0.05 3.45 5.85 -0.69 -2.42 115.31 131.35 2gq3 h LEU 138 Ca -0.30 -0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.25 2gq3 h LEU 138 Cb 1.13 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.84 2gq3 h LEU 138 CO 0.91 0.97 -0.36 1.88 -0.34 0.00 0.00 178.44 181.51 2gq3 h TYR 139 N 1.06 -0.99 -0.07 1.25 -1.99 -1.92 -1.66 116.97 112.65 2gq3 h TYR 139 Ca 0.23 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.99 2gq3 h TYR 139 Cb 0.31 0.43 -0.00 0.00 2.00 0.00 0.00 36.73 39.47 2gq3 h TYR 139 CO 0.02 -0.45 0.04 -0.44 -0.00 0.00 0.00 178.16 177.33 2gq3 h ASP 140 N -0.54 0.09 -0.84 3.88 3.32 -1.92 -0.51 116.42 119.89 2gq3 h ASP 140 Ca 0.04 -0.09 0.11 0.00 0.02 0.00 0.00 57.03 57.11 2gq3 h ASP 140 Cb 0.61 -0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.07 2gq3 h ASP 140 CO -0.25 0.15 0.55 0.00 -1.72 0.00 0.00 179.24 177.96 2gq3 h ALA 141 N 0.94 1.74 0.19 3.45 0.00 -1.45 -0.24 119.26 123.90 2gq3 h ALA 141 Ca 0.02 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.63 2gq3 h ALA 141 Cb 0.08 -0.17 0.03 0.00 0.00 0.00 0.00 17.79 17.74 2gq3 h ALA 141 CO -0.00 0.07 -1.31 -0.07 0.00 0.00 0.00 179.25 177.94 2gq3 h LEU 142 N 0.77 0.82 -0.27 0.00 4.07 -0.83 -3.24 115.31 116.63 2gq3 h LEU 142 Ca 0.40 -0.89 -0.04 0.00 0.08 0.00 0.00 57.88 57.43 2gq3 h LEU 142 Cb 0.49 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.96 2gq3 h LEU 142 CO -0.16 1.64 0.01 0.22 -1.08 0.00 0.00 178.44 179.06 2gq3 h TYR 143 N 0.13 0.51 0.00 1.13 3.20 -0.92 -2.80 116.97 118.22 2gq3 h TYR 143 Ca -0.22 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.57 2gq3 h TYR 143 Cb 2.01 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 40.14 2gq3 h TYR 143 CO 0.13 0.61 0.00 0.41 -1.64 0.00 0.00 178.16 177.67 2gq3 n GLY 144 N -0.35 -0.64 3.09 1.82 0.00 -0.12 -4.88 105.19 104.12 2gq3 n GLY 144 Ca -0.03 -0.02 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 2gq3 n GLY 144 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gq3 s THR 145 N -2.00 0.18 -2.03 2.61 2.01 -1.06 -5.05 115.64 110.31 2gq3 s THR 145 Ca 0.04 -1.48 0.10 0.00 0.31 0.00 0.00 61.69 60.66 2gq3 s THR 145 Cb 0.02 -1.20 0.27 0.00 0.01 0.00 0.00 72.50 71.60 2gq3 s THR 145 CO 0.03 -0.82 1.25 -0.90 -0.69 0.00 0.00 174.62 173.50 2gq3 n ASP 146 N 0.42 1.43 -0.36 3.53 5.75 -1.26 -3.47 116.55 122.59 2gq3 n ASP 146 Ca -0.16 -1.95 0.06 0.00 -0.01 0.00 0.00 54.79 52.73 2gq3 n ASP 146 Cb 0.60 -0.17 0.23 0.00 -1.03 0.00 0.00 41.12 40.75 2gq3 n ASP 146 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 2gq3 h VAL 147 N 1.60 0.94 -3.13 2.12 2.07 -1.88 -3.29 116.25 114.69 2gq3 h VAL 147 Ca 0.00 -0.35 -0.73 0.00 0.82 0.00 0.00 66.70 66.44 2gq3 h VAL 147 Cb 0.36 -0.16 -0.22 0.00 -1.52 0.00 0.00 31.29 29.76 2gq3 h VAL 147 CO 0.00 0.18 -0.15 -0.63 0.02 0.00 0.00 177.57 177.00 2gq3 s ILE 148 N -5.97 5.10 0.58 4.57 -1.09 -1.23 -4.96 121.20 118.19 2gq3 s ILE 148 Ca -0.12 -1.14 -0.10 0.00 -2.23 0.00 0.00 60.65 57.06 2gq3 s ILE 148 Cb 0.22 -4.30 0.14 0.00 -1.58 0.00 0.00 42.46 36.94 2gq3 s ILE 148 CO 0.81 -0.83 0.54 -0.81 -1.23 0.00 0.00 174.94 173.42 2gq3 n PRO 149 N 5.57 -1.83 -4.22 2.79 -0.04 -1.24 -4.90 135.00 131.13 2gq3 n PRO 149 Ca -0.12 -0.87 -0.15 0.00 -0.04 0.00 0.00 63.50 62.33 2gq3 n PRO 149 Cb 0.42 -0.77 -0.10 0.00 -0.04 0.00 0.00 33.50 33.01 2gq3 n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2gq3 s GLU 150 N -4.23 0.98 -0.22 0.54 2.02 -1.26 -4.91 118.70 111.63 2gq3 s GLU 150 Ca 0.35 -1.33 0.00 0.00 0.02 0.00 0.00 54.97 54.01 2gq3 s GLU 150 Cb -0.03 -0.63 0.00 0.00 0.10 0.00 0.00 34.13 33.57 2gq3 s GLU 150 CO 0.26 0.09 0.00 0.00 0.02 0.00 0.00 175.26 175.63 2gq3 n ALA 154 N 0.15 -0.05 -2.24 5.21 0.00 -1.26 -5.25 120.51 117.07 2gq3 n ALA 154 Ca -0.13 0.03 -0.42 0.00 0.00 0.00 0.00 53.44 52.92 2gq3 n ALA 154 Cb 0.59 -0.68 -0.03 0.00 0.00 0.00 0.00 19.45 19.34 2gq3 n ALA 154 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2gq3 s GLU 155 N -3.17 4.35 0.28 0.00 1.03 -1.26 -4.72 118.70 115.21 2gq3 s GLU 155 Ca 0.00 1.98 -0.29 0.00 0.03 0.00 0.00 54.97 56.69 2gq3 s GLU 155 Cb 0.00 -3.30 -0.10 0.00 -0.80 0.00 0.00 34.13 29.93 2gq3 s GLU 155 CO 0.00 -0.40 1.42 -1.59 -1.33 0.00 0.00 175.26 173.36 2gq3 s LYS 156 N 1.19 4.26 0.00 -4.83 -2.85 -1.26 -4.83 119.74 111.42 2gq3 s LYS 156 Ca 0.63 2.33 0.00 0.00 -1.00 0.00 0.00 55.97 57.93 2gq3 s LYS 156 Cb -0.34 -3.08 0.00 0.00 -2.06 0.00 0.00 37.83 32.35 2gq3 s LYS 156 CO 0.30 -0.39 0.00 0.41 0.10 0.00 0.00 175.35 175.76 2gq3 n GLY 157 N 1.70 6.12 0.00 0.59 0.00 -1.26 -5.01 105.19 107.33 2gq3 n GLY 157 Ca 0.05 -1.67 0.06 0.00 0.00 0.00 0.00 46.02 44.46 2gq3 n GLY 157 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2gq3 n PRO 158 N 0.00 0.06 -3.91 1.61 -0.02 -1.26 -4.82 135.00 126.65 2gq3 n PRO 158 Ca 0.00 0.24 -0.12 0.00 -2.02 0.00 0.00 63.50 61.59 2gq3 n PRO 158 Cb 0.00 -1.50 -0.14 0.00 -0.02 0.00 0.00 33.50 31.84 2gq3 n PRO 158 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2gq3 s THR 159 N -2.88 0.06 0.20 3.45 2.01 -1.26 -5.12 115.64 112.10 2gq3 s THR 159 Ca 0.08 -0.07 -0.31 0.00 0.31 0.00 0.00 61.69 61.71 2gq3 s THR 159 Cb 0.09 -0.06 -0.16 0.00 0.01 0.00 0.00 72.50 72.37 2gq3 s THR 159 CO 0.23 -0.01 0.92 0.00 -0.69 0.00 0.00 174.62 175.07 2gq3 n TYR 160 N 3.00 0.70 -4.17 4.92 9.36 -1.26 -4.98 117.16 124.73 2gq3 n TYR 160 Ca -0.13 0.81 -0.32 0.00 3.32 0.00 0.00 57.90 61.58 2gq3 n TYR 160 Cb 0.60 -2.16 -0.16 0.00 -0.63 0.00 0.00 39.34 36.98 2gq3 n TYR 160 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 2gq3 s ASN 161 N -0.47 2.96 0.23 2.98 3.84 -1.26 -5.02 114.94 118.20 2gq3 s ASN 161 Ca 0.68 -0.58 0.26 0.00 0.21 0.00 0.00 52.86 53.42 2gq3 s ASN 161 Cb -0.87 -1.36 0.80 0.00 -0.55 0.00 0.00 41.25 39.27 2gq3 s ASN 161 CO 0.56 -0.01 1.76 0.11 -2.79 0.00 0.00 177.10 176.74 2gq3 h LYS 162 N 7.87 0.00 0.29 0.43 1.57 -1.97 0.60 116.57 125.36 2gq3 h LYS 162 Ca -0.41 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.36 2gq3 h LYS 162 Cb 1.15 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 2gq3 h LYS 162 CO 0.59 0.00 -0.24 0.28 -0.57 0.00 0.00 179.45 179.51 2gq3 h VAL 163 N 0.00 0.49 -0.01 0.50 2.07 -1.98 -2.08 116.25 115.24 2gq3 h VAL 163 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2gq3 h VAL 163 Cb 0.73 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2gq3 h VAL 163 CO 0.00 0.00 -0.07 -0.09 0.02 0.00 0.00 177.57 177.43 2gq3 h ARG 164 N -0.54 0.06 -0.86 1.57 2.43 -1.66 -2.73 114.38 112.66 2gq3 h ARG 164 Ca -0.02 -0.05 0.11 0.00 -0.81 0.00 0.00 59.98 59.21 2gq3 h ARG 164 Cb 0.48 0.01 -0.13 0.00 -0.42 0.00 0.00 29.97 29.91 2gq3 h ARG 164 CO -0.02 0.74 -0.47 0.78 -1.51 0.00 0.00 179.97 179.49 2gq3 h GLY 165 N -0.59 -0.38 2.00 2.80 0.00 0.07 -2.37 103.07 104.59 2gq3 h GLY 165 Ca -0.01 0.62 -0.05 0.00 0.00 0.00 0.00 47.33 47.90 2gq3 h GLY 165 CO 0.01 -0.11 -0.24 -0.55 0.00 0.00 0.00 176.54 175.65 2gq3 h ASP 166 N -0.08 0.00 -0.26 0.19 3.32 -1.37 -2.52 116.42 115.71 2gq3 h ASP 166 Ca 0.23 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.16 2gq3 h ASP 166 Cb 0.53 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 2gq3 h ASP 166 CO -0.88 0.24 -0.31 0.11 -1.72 0.00 0.00 179.24 176.69 2gq3 h LYS 167 N 0.00 0.67 -0.92 3.56 1.57 -1.11 -2.72 116.57 117.61 2gq3 h LYS 167 Ca -0.00 -0.37 0.05 0.00 -1.87 0.00 0.00 60.65 58.45 2gq3 h LYS 167 Cb 0.49 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.76 2gq3 h LYS 167 CO 0.03 0.98 0.59 0.28 -0.57 0.00 0.00 179.45 180.77 2gq3 h VAL 168 N 0.39 1.11 0.17 0.50 2.07 -1.32 -2.84 116.25 116.33 2gq3 h VAL 168 Ca 0.03 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 2gq3 h VAL 168 Cb 0.89 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2gq3 h VAL 168 CO 0.07 0.20 -0.08 0.40 0.02 0.00 0.00 177.57 178.19 2gq3 h ILE 169 N 1.11 0.92 0.00 4.57 2.04 -1.42 -2.83 117.51 121.91 2gq3 h ILE 169 Ca 0.38 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.81 2gq3 h ILE 169 Cb 0.08 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 2gq3 h ILE 169 CO -0.15 0.10 0.00 0.00 0.00 0.00 0.00 178.15 178.11 2gq3 n ALA 170 N -2.30 1.53 -0.05 1.87 0.00 -1.03 -2.01 120.51 118.52 2gq3 n ALA 170 Ca -0.09 0.10 -0.07 0.00 0.00 0.00 0.00 53.44 53.38 2gq3 n ALA 170 Cb 0.19 -1.37 -0.06 0.00 0.00 0.00 0.00 19.45 18.21 2gq3 n ALA 170 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2gq3 h TYR 171 N 0.00 -0.02 -1.17 0.00 3.20 -1.46 -2.91 116.97 114.60 2gq3 h TYR 171 Ca 0.00 -0.00 0.39 0.00 3.14 0.00 0.00 58.73 62.26 2gq3 h TYR 171 Cb 0.29 0.01 -0.14 0.00 1.54 0.00 0.00 36.73 38.43 2gq3 h TYR 171 CO 0.00 0.46 0.73 0.00 -1.64 0.00 0.00 178.16 177.71 2gq3 h ALA 172 N -0.50 2.43 0.04 1.82 0.00 -1.24 -1.60 119.26 120.21 2gq3 h ALA 172 Ca -0.00 0.14 -0.23 0.00 0.00 0.00 0.00 54.91 54.82 2gq3 h ALA 172 Cb 0.49 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2gq3 h ALA 172 CO 0.00 -1.05 -1.06 0.00 0.00 0.00 0.00 179.25 177.15 2gq3 h ARG 173 N 0.17 0.09 -0.19 0.00 2.47 -1.38 -1.02 114.38 114.52 2gq3 h ARG 173 Ca 0.78 -0.15 -0.18 0.00 -1.26 0.00 0.00 59.98 59.17 2gq3 h ARG 173 Cb 2.20 0.06 0.01 0.00 -1.65 0.00 0.00 29.97 30.58 2gq3 h ARG 173 CO -0.49 1.06 -0.59 -0.22 0.56 0.00 0.00 179.97 180.29 2gq3 h LYS 174 N 0.03 0.73 -0.52 0.04 3.64 -1.18 -2.82 116.57 116.49 2gq3 h LYS 174 Ca -0.05 -0.54 0.10 0.00 -1.27 0.00 0.00 60.65 58.90 2gq3 h LYS 174 Cb 1.81 0.09 -0.10 0.00 -0.41 0.00 0.00 32.23 33.62 2gq3 h LYS 174 CO 0.15 1.16 -0.16 0.35 -2.27 0.00 0.00 179.45 178.67 2gq3 h PHE 175 N 0.45 -0.38 -0.44 1.91 3.57 -1.16 0.18 116.94 121.07 2gq3 h PHE 175 Ca -0.02 0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.56 2gq3 h PHE 175 Cb 1.21 0.25 -0.03 0.00 2.79 0.00 0.00 35.95 40.16 2gq3 h PHE 175 CO 0.09 -0.26 0.24 -0.07 -2.23 0.00 0.00 178.31 176.08 2gq3 h LEU 176 N -0.04 0.36 -2.02 0.59 3.38 -1.21 0.38 115.31 116.76 2gq3 h LEU 176 Ca 0.25 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.24 2gq3 h LEU 176 Cb 0.42 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2gq3 h LEU 176 CO -0.56 0.26 0.02 0.44 0.09 0.00 0.00 178.44 178.69 2gq3 h ASP 177 N 0.47 0.00 0.36 -0.43 3.32 -1.17 0.58 116.42 119.56 2gq3 h ASP 177 Ca 0.19 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.91 2gq3 h ASP 177 Cb 0.07 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.63 2gq3 h ASP 177 CO -0.12 0.00 -1.55 0.44 -1.72 0.00 0.00 179.24 176.29 2gq3 h ASP 178 N 0.00 0.56 0.33 6.45 3.32 0.13 -3.33 116.42 123.88 2gq3 h ASP 178 Ca 0.01 -0.72 0.00 0.00 0.02 0.00 0.00 57.03 56.34 2gq3 h ASP 178 Cb 0.05 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.42 2gq3 h ASP 178 CO -0.00 1.59 -1.49 -1.20 -1.72 0.00 0.00 179.24 176.42 2gq3 n SER 179 N -3.56 0.40 -2.97 6.45 7.64 0.12 -4.63 113.62 117.07 2gq3 n SER 179 Ca -0.18 -0.03 -0.15 0.00 1.01 0.00 0.00 58.87 59.52 2gq3 n SER 179 Cb 1.06 1.31 0.01 0.00 -1.01 0.00 0.00 64.21 65.58 2gq3 n SER 179 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2gq3 n VAL 180 N -2.25 -0.23 -1.73 0.44 0.31 0.20 -4.81 118.33 110.26 2gq3 n VAL 180 Ca -0.01 -2.93 -0.30 0.00 -0.01 0.00 0.00 64.34 61.09 2gq3 n VAL 180 Cb 0.52 0.15 0.06 0.00 -0.91 0.00 0.00 33.84 33.65 2gq3 n VAL 180 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2gq3 s PRO 181 N -0.67 2.73 0.16 5.55 0.05 -1.25 -4.56 135.00 137.00 2gq3 s PRO 181 Ca 0.32 0.64 0.04 0.00 0.05 0.00 0.00 61.00 62.05 2gq3 s PRO 181 Cb 0.26 -1.99 -0.04 0.00 0.05 0.00 0.00 34.50 32.78 2gq3 s PRO 181 CO -0.12 -1.17 0.18 -0.51 0.05 0.00 0.00 177.00 175.43 2gq3 s LEU 182 N -5.50 3.98 0.25 -3.56 1.43 -1.26 -1.71 118.68 112.30 2gq3 s LEU 182 Ca 0.59 -0.03 -0.04 0.00 -1.03 0.00 0.00 54.13 53.61 2gq3 s LEU 182 Cb -0.13 -2.57 0.49 0.00 0.03 0.00 0.00 46.19 44.01 2gq3 s LEU 182 CO 0.53 0.07 1.67 0.28 0.23 0.00 0.00 176.35 179.13 2gq3 h SER 183 N 2.36 -0.06 -4.66 2.29 0.02 -1.63 -3.42 113.55 108.45 2gq3 h SER 183 Ca -0.48 0.16 0.08 0.00 -0.84 0.00 0.00 61.79 60.72 2gq3 h SER 183 Cb 1.20 0.23 -0.16 0.00 0.14 0.00 0.00 62.40 63.81 2gq3 h SER 183 CO 0.65 -0.08 0.45 -0.94 -1.14 0.00 0.00 176.83 175.77 2gq3 s SER 184 N -5.21 -0.40 0.00 3.07 1.04 -1.26 -4.98 113.70 105.95 2gq3 s SER 184 Ca -0.13 0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2gq3 s SER 184 Cb 0.22 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.75 2gq3 s SER 184 CO 0.76 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.94 2gq3 n GLY 185 N -0.14 0.47 3.82 7.32 0.00 -1.26 -4.84 105.19 110.55 2gq3 n GLY 185 Ca -0.10 -1.54 -0.26 0.00 0.00 0.00 0.00 46.02 44.11 2gq3 n GLY 185 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2gq3 s SER 186 N -0.91 5.65 0.50 1.61 0.15 -1.26 -4.48 113.70 114.95 2gq3 s SER 186 Ca 0.00 -0.09 0.22 0.00 0.70 0.00 0.00 55.95 56.78 2gq3 s SER 186 Cb 0.00 -1.51 1.29 0.00 -1.71 0.00 0.00 66.02 64.09 2gq3 s SER 186 CO 0.00 0.06 2.05 -0.26 1.20 0.00 0.00 173.24 176.29 2gq3 h PHE 187 N 2.33 0.00 0.00 3.44 -1.00 -1.97 -2.55 116.94 117.19 2gq3 h PHE 187 Ca -0.48 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.30 2gq3 h PHE 187 Cb 1.20 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.76 2gq3 h PHE 187 CO 0.57 0.14 -0.00 0.78 -1.61 0.00 0.00 178.31 178.19 2gq3 h GLY 188 N 0.66 0.00 -3.55 -1.45 0.00 -1.96 -2.70 103.07 94.07 2gq3 h GLY 188 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.02 2gq3 h GLY 188 CO 0.02 0.00 0.39 1.22 0.00 0.00 0.00 176.54 178.17 2gq3 n ASP 189 N -4.02 4.06 -4.72 0.19 8.00 -0.96 -4.96 116.55 114.14 2gq3 n ASP 189 Ca -0.03 -3.20 -0.42 0.00 0.71 0.00 0.00 54.79 51.86 2gq3 n ASP 189 Cb 0.09 -0.75 -0.04 0.00 -0.02 0.00 0.00 41.12 40.40 2gq3 n ASP 189 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2gq3 s ALA 190 N -2.71 3.20 -0.37 2.24 0.00 -1.02 -3.84 121.76 119.26 2gq3 s ALA 190 Ca 0.48 0.54 0.09 0.00 0.00 0.00 0.00 51.96 53.07 2gq3 s ALA 190 Cb 0.39 -3.30 0.44 0.00 0.00 0.00 0.00 23.12 20.65 2gq3 s ALA 190 CO 0.11 -0.14 1.11 0.25 0.00 0.00 0.00 175.76 177.09 2gq3 n THR 191 N 3.42 2.14 0.00 0.00 -2.24 0.69 -2.41 114.28 115.89 2gq3 n THR 191 Ca 0.04 -4.32 0.00 0.00 -2.27 0.00 0.00 64.05 57.50 2gq3 n THR 191 Cb 0.50 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 2gq3 n THR 191 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gq3 n GLY 192 N -0.50 3.43 3.18 3.38 0.00 -1.26 -4.82 105.19 108.60 2gq3 n GLY 192 Ca 0.34 -1.81 -0.22 0.00 0.00 0.00 0.00 46.02 44.33 2gq3 n GLY 192 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gq3 s PHE 193 N -2.39 1.45 0.29 1.61 0.40 -1.26 -1.85 117.98 116.21 2gq3 s PHE 193 Ca 0.00 -0.35 0.04 0.00 -0.60 0.00 0.00 56.93 56.02 2gq3 s PHE 193 Cb 0.00 -0.87 -0.01 0.00 0.51 0.00 0.00 43.02 42.65 2gq3 s PHE 193 CO 0.00 0.05 0.14 0.25 0.70 0.00 0.00 175.22 176.36 2gq3 n THR 194 N 2.00 0.00 -3.58 0.64 -2.24 -0.63 -4.39 114.28 106.07 2gq3 n THR 194 Ca -0.17 -1.79 -0.27 0.00 -2.27 0.00 0.00 64.05 59.54 2gq3 n THR 194 Cb 0.54 0.73 -0.16 0.00 -2.10 0.00 0.00 70.33 69.34 2gq3 n THR 194 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2gq3 s VAL 195 N -2.80 -0.06 -0.23 2.28 1.01 0.78 -2.27 120.40 119.11 2gq3 s VAL 195 Ca 0.20 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.74 2gq3 s VAL 195 Cb 0.01 -0.78 0.05 0.00 0.00 0.00 0.00 36.38 35.65 2gq3 s VAL 195 CO 0.14 -0.49 -0.14 -1.10 0.00 0.00 0.00 175.10 173.51 2gq3 s GLN 196 N 2.11 2.47 -0.43 2.72 -0.21 -1.04 -4.57 119.66 120.71 2gq3 s GLN 196 Ca 0.05 -1.17 -0.02 0.00 0.02 0.00 0.00 55.36 54.24 2gq3 s GLN 196 Cb -0.16 -2.77 0.00 0.00 1.00 0.00 0.00 33.01 31.08 2gq3 s GLN 196 CO -0.22 -0.45 0.37 -3.47 -2.12 0.00 0.00 175.29 169.40 2gq3 n ASP 197 N 4.50 -3.12 0.00 5.90 2.03 -1.26 -2.62 116.55 121.98 2gq3 n ASP 197 Ca -0.16 -0.18 0.00 0.00 0.52 0.00 0.00 54.79 54.97 2gq3 n ASP 197 Cb 0.45 -1.98 0.00 0.00 -0.72 0.00 0.00 41.12 38.87 2gq3 n ASP 197 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2gq3 n GLY 198 N -1.00 0.56 3.96 0.27 0.00 -1.25 -5.00 105.19 102.72 2gq3 n GLY 198 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 2gq3 n GLY 198 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2gq3 s GLN 199 N -0.45 3.46 0.14 1.61 -1.52 -1.08 -4.69 119.66 117.13 2gq3 s GLN 199 Ca 0.00 -0.62 -0.26 0.00 -1.95 0.00 0.00 55.36 52.53 2gq3 s GLN 199 Cb 0.00 -2.85 -0.07 0.00 -0.22 0.00 0.00 33.01 29.86 2gq3 s GLN 199 CO 0.00 0.39 0.81 -1.17 -0.25 0.00 0.00 175.29 175.07 2gq3 s LEU 200 N -3.88 4.56 -0.21 2.90 0.20 -1.26 -2.49 118.68 118.50 2gq3 s LEU 200 Ca 0.36 1.65 0.01 0.00 0.69 0.00 0.00 54.13 56.83 2gq3 s LEU 200 Cb -0.10 -3.34 0.05 0.00 -0.43 0.00 0.00 46.19 42.37 2gq3 s LEU 200 CO 0.30 0.14 -0.08 -0.69 -0.29 0.00 0.00 176.35 175.73 2gq3 s VAL 201 N -0.80 1.59 -0.31 1.68 1.01 -0.96 -4.48 120.40 118.12 2gq3 s VAL 201 Ca 0.38 -1.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.14 2gq3 s VAL 201 Cb -0.23 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2gq3 s VAL 201 CO 0.26 0.06 0.29 -0.69 0.00 0.00 0.00 175.10 175.03 2gq3 s VAL 202 N 1.40 5.23 -0.19 2.92 1.01 0.17 -1.61 120.40 129.34 2gq3 s VAL 202 Ca -0.03 0.09 -0.21 0.00 0.00 0.00 0.00 61.98 61.83 2gq3 s VAL 202 Cb -0.17 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 2gq3 s VAL 202 CO -0.07 0.05 0.64 0.00 0.00 0.00 0.00 175.10 175.72 2gq3 s ALA 203 N 1.89 3.54 0.00 5.51 0.00 -0.77 -0.65 121.76 131.27 2gq3 s ALA 203 Ca 0.10 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.81 2gq3 s ALA 203 Cb -0.17 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 19.98 2gq3 s ALA 203 CO 0.11 -0.54 0.00 1.28 0.00 0.00 0.00 175.76 176.61 2gq3 n LEU 204 N 4.99 0.00 0.16 0.00 4.77 -1.24 -0.22 117.00 125.46 2gq3 n LEU 204 Ca -0.01 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.10 2gq3 n LEU 204 Cb 0.50 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 42.06 2gq3 n LEU 204 CO 0.44 -0.22 0.89 1.55 -1.33 0.00 0.00 177.39 178.72 2gq3 h PRO 205 N 0.00 0.00 0.00 3.23 0.13 -1.96 -3.41 132.00 129.99 2gq3 h PRO 205 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2gq3 h PRO 205 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2gq3 h PRO 205 CO 0.00 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 174.30 2gq3 n ASP 206 N -2.48 0.00 -3.07 1.44 4.64 -1.26 -5.12 116.55 110.69 2gq3 n ASP 206 Ca 0.03 0.00 -0.30 0.00 -1.38 0.00 0.00 54.79 53.14 2gq3 n ASP 206 Cb 0.33 0.00 -0.00 0.00 -1.04 0.00 0.00 41.12 40.40 2gq3 n ASP 206 CO 0.00 0.00 0.00 1.17 -0.82 0.00 0.00 177.20 177.55 2gq3 n LYS 207 N 0.00 0.00 -2.99 -0.67 3.00 -1.26 -4.85 118.16 111.38 2gq3 n LYS 207 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 58.31 58.03 2gq3 n LYS 207 Cb 0.00 -0.71 -0.04 0.00 0.00 0.00 0.00 35.03 34.27 2gq3 n LYS 207 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2gq3 n SER 208 N 1.65 4.60 -4.71 3.14 2.88 -1.26 -3.65 113.62 116.27 2gq3 n SER 208 Ca 0.08 -3.65 -0.29 0.00 -1.33 0.00 0.00 58.87 53.68 2gq3 n SER 208 Cb 0.28 -0.62 0.15 0.00 -0.75 0.00 0.00 64.21 63.27 2gq3 n SER 208 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2gq3 s THR 209 N -4.17 1.98 0.38 2.46 -1.32 0.18 -4.08 115.64 111.08 2gq3 s THR 209 Ca 0.47 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 61.03 2gq3 s THR 209 Cb 0.25 -2.69 -0.06 0.00 -1.51 0.00 0.00 72.50 68.49 2gq3 s THR 209 CO -0.12 0.00 0.04 -0.83 -2.21 0.00 0.00 174.62 171.50 2gq3 s GLY 210 N -3.93 2.28 0.70 6.08 0.00 -1.26 0.45 107.32 111.64 2gq3 s GLY 210 Ca 0.65 -2.11 -0.16 0.00 0.00 0.00 0.00 44.72 43.09 2gq3 s GLY 210 CO 0.54 -1.98 1.25 1.08 0.00 0.00 0.00 173.10 174.00 2gq3 s LEU 211 N -3.75 3.43 0.25 0.66 1.43 -1.26 -2.00 118.68 117.43 2gq3 s LEU 211 Ca 0.36 2.50 0.25 0.00 -1.03 0.00 0.00 54.13 56.21 2gq3 s LEU 211 Cb 0.04 -4.61 0.54 0.00 0.03 0.00 0.00 46.19 42.19 2gq3 s LEU 211 CO 0.19 -2.19 1.58 0.00 0.23 0.00 0.00 176.35 176.17 2gq3 h ALA 212 N 0.06 0.87 -3.46 4.21 0.00 -1.58 -3.34 119.26 116.03 2gq3 h ALA 212 Ca -0.49 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 53.78 2gq3 h ALA 212 Cb 1.32 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.71 2gq3 h ALA 212 CO 0.51 0.00 -0.71 1.21 0.00 0.00 0.00 179.25 180.26 2gq3 s ASN 213 N -4.94 4.43 0.58 0.00 3.84 -1.26 -4.97 114.94 112.63 2gq3 s ASN 213 Ca 0.08 -2.32 0.34 0.00 0.21 0.00 0.00 52.86 51.17 2gq3 s ASN 213 Cb 0.11 -1.45 1.79 0.00 -0.55 0.00 0.00 41.25 41.15 2gq3 s ASN 213 CO 0.66 -0.34 2.18 -0.65 -2.79 0.00 0.00 177.10 176.15 2gq3 h PRO 214 N 7.34 0.00 -1.27 0.43 0.11 -1.96 0.49 132.00 137.14 2gq3 h PRO 214 Ca -0.06 0.00 0.40 0.00 0.11 0.00 0.00 66.00 66.45 2gq3 h PRO 214 Cb 0.98 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 31.97 2gq3 h PRO 214 CO 0.55 0.05 0.83 0.78 -0.21 0.00 0.00 178.00 179.99 2gq3 h GLY 215 N 0.66 1.19 1.16 -0.55 0.00 -1.94 -0.16 103.07 103.42 2gq3 h GLY 215 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.20 2gq3 h GLY 215 CO 0.01 -0.31 0.00 -1.06 0.00 0.00 0.00 176.54 175.17 2gq3 n GLN 216 N -4.63 0.76 -2.91 4.80 6.02 0.16 -4.60 117.38 116.98 2gq3 n GLN 216 Ca 0.34 0.01 -0.43 0.00 -0.01 0.00 0.00 57.00 56.91 2gq3 n GLN 216 Cb 1.32 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 31.03 2gq3 n GLN 216 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 2gq3 s PHE 217 N -2.16 2.93 -0.47 1.08 5.36 -0.08 -2.06 117.98 122.59 2gq3 s PHE 217 Ca 0.38 0.15 0.17 0.00 -0.96 0.00 0.00 56.93 56.68 2gq3 s PHE 217 Cb 0.19 -3.83 -0.23 0.00 -0.34 0.00 0.00 43.02 38.82 2gq3 s PHE 217 CO 0.35 -1.10 0.58 0.00 -1.46 0.00 0.00 175.22 173.59 2gq3 n ALA 218 N 6.98 3.56 0.00 11.12 0.00 -0.63 -4.80 120.51 136.74 2gq3 n ALA 218 Ca 0.03 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.01 2gq3 n ALA 218 Cb 0.48 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 19.31 2gq3 n ALA 218 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gq3 n GLY 219 N 1.44 -0.18 3.63 0.00 0.00 -1.04 -4.46 105.19 104.58 2gq3 n GLY 219 Ca 0.00 -1.39 -0.03 0.00 0.00 0.00 0.00 46.02 44.61 2gq3 n GLY 219 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2gq3 s TYR 220 N -2.91 -0.06 0.29 1.61 -0.85 -0.77 -1.60 117.35 113.06 2gq3 s TYR 220 Ca 0.00 0.06 0.10 0.00 -0.52 0.00 0.00 57.07 56.71 2gq3 s TYR 220 Cb 0.00 0.50 -0.05 0.00 0.38 0.00 0.00 41.96 42.79 2gq3 s TYR 220 CO 0.00 -0.08 -0.07 0.95 -1.52 0.00 0.00 175.55 174.84 2gq3 s THR 221 N -1.76 2.89 0.00 -3.49 -4.23 -0.39 -0.59 115.64 108.06 2gq3 s THR 221 Ca 0.10 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2gq3 s THR 221 Cb -0.01 -2.65 0.00 0.00 1.34 0.00 0.00 72.50 71.18 2gq3 s THR 221 CO -0.05 -0.33 0.00 0.61 -0.54 0.00 0.00 174.62 174.31 2gq3 n GLY 222 N -0.82 -0.26 3.84 3.99 0.00 -1.26 -1.16 105.19 109.51 2gq3 n GLY 222 Ca -0.05 -1.06 -0.33 0.00 0.00 0.00 0.00 46.02 44.58 2gq3 n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gq3 s ALA 223 N -1.48 3.31 0.37 4.61 0.00 -1.26 -4.82 121.76 122.49 2gq3 s ALA 223 Ca 0.00 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.11 2gq3 s ALA 223 Cb 0.00 -2.82 0.71 0.00 0.00 0.00 0.00 23.12 21.01 2gq3 s ALA 223 CO 0.00 0.31 1.99 0.00 0.00 0.00 0.00 175.76 178.06 2gq3 h ALA 224 N 2.50 1.56 0.00 0.00 0.00 -1.91 0.32 119.26 121.73 2gq3 h ALA 224 Ca -0.48 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.26 2gq3 h ALA 224 Cb 1.18 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2gq3 h ALA 224 CO 0.65 0.37 -0.44 0.93 0.00 0.00 0.00 179.25 180.76 2gq3 h GLU 225 N 0.65 0.00 -1.10 0.00 3.07 -1.93 0.22 114.58 115.50 2gq3 h GLU 225 Ca 0.17 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.94 2gq3 h GLU 225 Cb 0.03 0.00 -0.21 0.00 -0.84 0.00 0.00 28.75 27.73 2gq3 h GLU 225 CO -0.03 0.44 -0.47 -1.54 -1.40 0.00 0.00 179.01 176.01 2gq3 s SER 226 N -6.71 -1.25 0.48 1.42 1.04 -0.98 -4.79 113.70 102.91 2gq3 s SER 226 Ca -0.01 -0.77 -0.24 0.00 0.48 0.00 0.00 55.95 55.41 2gq3 s SER 226 Cb 0.13 1.82 -0.07 0.00 0.10 0.00 0.00 66.02 68.00 2gq3 s SER 226 CO 0.72 -0.19 1.39 -2.16 0.98 0.00 0.00 173.24 173.98 2gq3 s PRO 227 N 1.90 3.51 0.13 4.02 0.04 0.07 -4.17 135.00 140.50 2gq3 s PRO 227 Ca 0.15 2.33 0.26 0.00 0.04 0.00 0.00 61.00 63.78 2gq3 s PRO 227 Cb -0.06 -2.51 0.96 0.00 0.04 0.00 0.00 34.50 32.93 2gq3 s PRO 227 CO -0.09 -0.93 1.79 0.25 0.04 0.00 0.00 177.00 178.07 2gq3 n THR 228 N -0.48 0.46 -3.59 1.26 -2.24 -0.31 -4.62 114.28 104.76 2gq3 n THR 228 Ca 0.07 -0.08 -0.04 0.00 -2.27 0.00 0.00 64.05 61.73 2gq3 n THR 228 Cb 0.43 -0.66 -0.02 0.00 -2.10 0.00 0.00 70.33 67.98 2gq3 n THR 228 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2gq3 s SER 229 N -3.86 -0.15 -0.08 3.42 1.04 -1.22 -2.33 113.70 110.53 2gq3 s SER 229 Ca 0.11 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.52 2gq3 s SER 229 Cb 0.14 0.17 0.02 0.00 0.10 0.00 0.00 66.02 66.45 2gq3 s SER 229 CO 0.52 -0.28 -0.06 -0.69 0.98 0.00 0.00 173.24 173.71 2gq3 s VAL 230 N -2.49 0.78 -0.20 5.02 1.01 0.67 -1.26 120.40 123.93 2gq3 s VAL 230 Ca 0.09 -0.19 -0.09 0.00 0.00 0.00 0.00 61.98 61.79 2gq3 s VAL 230 Cb -0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 2gq3 s VAL 230 CO -0.05 0.31 0.11 -0.22 0.00 0.00 0.00 175.10 175.25 2gq3 s LEU 231 N 1.36 4.09 0.39 3.92 2.96 -0.63 0.09 118.68 130.87 2gq3 s LEU 231 Ca -0.03 0.18 0.04 0.00 -0.22 0.00 0.00 54.13 54.10 2gq3 s LEU 231 Cb -0.14 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 2gq3 s LEU 231 CO -0.03 0.17 0.09 -0.76 -1.32 0.00 0.00 176.35 174.50 2gq3 s LEU 232 N 0.41 2.10 -0.10 -0.68 1.43 0.34 -1.61 118.68 120.58 2gq3 s LEU 232 Ca 0.07 -1.56 -0.27 0.00 -1.03 0.00 0.00 54.13 51.34 2gq3 s LEU 232 Cb -0.12 -0.28 0.06 0.00 0.03 0.00 0.00 46.19 45.89 2gq3 s LEU 232 CO -0.01 -0.80 0.64 -0.51 0.23 0.00 0.00 176.35 175.90 2gq3 s ILE 233 N -3.21 0.01 -0.28 -0.59 2.07 -0.88 -1.08 121.20 117.24 2gq3 s ILE 233 Ca 0.27 -0.05 -0.19 0.00 -1.41 0.00 0.00 60.65 59.27 2gq3 s ILE 233 Cb 0.05 -0.94 0.09 0.00 0.13 0.00 0.00 42.46 41.79 2gq3 s ILE 233 CO 0.14 -0.03 0.79 0.21 -1.91 0.00 0.00 174.94 174.14 2gq3 s ASN 234 N -0.76 -0.76 -1.17 4.50 2.47 -0.82 -4.61 114.94 113.79 2gq3 s ASN 234 Ca -0.08 1.30 -0.05 0.00 0.42 0.00 0.00 52.86 54.45 2gq3 s ASN 234 Cb -0.02 1.32 0.04 0.00 -1.45 0.00 0.00 41.25 41.14 2gq3 s ASN 234 CO 0.07 -0.21 0.30 1.41 -3.72 0.00 0.00 177.10 174.94 2gq3 n HIS 235 N 3.59 -1.67 -0.78 0.43 8.25 -1.26 -0.52 115.22 123.26 2gq3 n HIS 235 Ca -0.18 0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2gq3 n HIS 235 Cb 0.57 -2.90 0.00 0.00 1.12 0.00 0.00 29.99 28.78 2gq3 n HIS 235 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gq3 n GLY 236 N -1.03 0.84 3.36 -1.41 0.00 -1.26 -4.62 105.19 101.06 2gq3 n GLY 236 Ca -0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 2gq3 n GLY 236 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gq3 s LEU 237 N 0.00 2.25 0.18 0.99 1.43 0.32 -4.95 118.68 118.90 2gq3 s LEU 237 Ca 0.00 -0.39 -0.22 0.00 -1.03 0.00 0.00 54.13 52.49 2gq3 s LEU 237 Cb 0.00 -1.40 -0.08 0.00 0.03 0.00 0.00 46.19 44.74 2gq3 s LEU 237 CO 0.00 0.33 0.73 -1.00 0.23 0.00 0.00 176.35 176.63 2gq3 s HIS 238 N -0.65 3.77 -0.15 0.29 3.76 -1.26 -1.94 115.29 119.11 2gq3 s HIS 238 Ca 0.10 1.48 -0.01 0.00 -0.15 0.00 0.00 55.06 56.48 2gq3 s HIS 238 Cb -0.10 -2.67 0.04 0.00 1.11 0.00 0.00 32.58 30.96 2gq3 s HIS 238 CO -0.00 0.44 -0.04 0.42 -0.85 0.00 0.00 174.74 174.71 2gq3 s ILE 239 N -1.32 0.94 -0.21 0.60 1.01 -0.24 -2.01 121.20 119.97 2gq3 s ILE 239 Ca 0.38 -0.50 -0.02 0.00 0.00 0.00 0.00 60.65 60.51 2gq3 s ILE 239 Cb -0.20 -1.14 0.00 0.00 0.01 0.00 0.00 42.46 41.13 2gq3 s ILE 239 CO 0.23 0.12 -0.09 -0.70 0.00 0.00 0.00 174.94 174.49 2gq3 s GLU 240 N 1.71 3.26 -0.32 2.79 2.12 -0.40 0.13 118.70 127.98 2gq3 s GLU 240 Ca 0.01 -0.69 -0.19 0.00 0.36 0.00 0.00 54.97 54.47 2gq3 s GLU 240 Cb -0.15 -2.86 -0.01 0.00 0.26 0.00 0.00 34.13 31.37 2gq3 s GLU 240 CO -0.07 -0.19 0.55 0.42 -0.54 0.00 0.00 175.26 175.42 2gq3 s ILE 241 N 1.39 5.00 -0.28 -3.70 1.01 0.11 -0.12 121.20 124.61 2gq3 s ILE 241 Ca 0.05 0.59 -0.25 0.00 0.00 0.00 0.00 60.65 61.04 2gq3 s ILE 241 Cb -0.14 -3.95 0.00 0.00 0.01 0.00 0.00 42.46 38.38 2gq3 s ILE 241 CO -0.06 -0.15 0.85 -0.76 0.00 0.00 0.00 174.94 174.82 2gq3 s LEU 242 N 2.46 4.06 -0.24 2.97 1.43 -0.76 -0.24 118.68 128.36 2gq3 s LEU 242 Ca 0.21 0.88 -0.08 0.00 -1.03 0.00 0.00 54.13 54.11 2gq3 s LEU 242 Cb -0.15 -3.20 -0.03 0.00 0.03 0.00 0.00 46.19 42.84 2gq3 s LEU 242 CO 0.12 -0.61 0.09 -0.63 0.23 0.00 0.00 176.35 175.55 2gq3 s ILE 243 N 3.01 4.57 -0.41 -0.59 1.01 -0.98 0.36 121.20 128.18 2gq3 s ILE 243 Ca 0.35 -0.09 0.06 0.00 0.00 0.00 0.00 60.65 60.98 2gq3 s ILE 243 Cb -0.14 -3.13 0.17 0.00 0.01 0.00 0.00 42.46 39.37 2gq3 s ILE 243 CO 0.11 0.35 0.55 -0.62 0.00 0.00 0.00 174.94 175.33 2gq3 s ASP 244 N 1.35 -0.64 0.46 3.58 -1.08 0.22 -4.59 116.67 115.97 2gq3 s ASP 244 Ca 0.05 -1.15 0.26 0.00 -0.52 0.00 0.00 52.55 51.20 2gq3 s ASP 244 Cb -0.15 1.48 0.96 0.00 -1.46 0.00 0.00 42.92 43.75 2gq3 s ASP 244 CO 0.04 -0.19 1.84 -0.65 0.52 0.00 0.00 175.17 176.73 2gq3 h PRO 245 N 6.84 0.00 -2.51 4.34 0.11 -1.80 -3.14 132.00 135.84 2gq3 h PRO 245 Ca 0.06 0.00 -0.74 0.00 0.11 0.00 0.00 66.00 65.42 2gq3 h PRO 245 Cb 1.13 0.00 -0.32 0.00 0.11 0.00 0.00 31.00 31.92 2gq3 h PRO 245 CO 0.13 0.16 0.42 0.39 -0.21 0.00 0.00 178.00 178.88 2gq3 n GLU 246 N -3.28 4.24 -3.91 1.05 4.71 -1.26 -2.22 120.64 119.97 2gq3 n GLU 246 Ca 0.01 -4.65 -0.10 0.00 -0.01 0.00 0.00 57.16 52.40 2gq3 n GLU 246 Cb 0.42 -2.42 -0.09 0.00 -1.01 0.00 0.00 31.44 28.34 2gq3 n GLU 246 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2gq3 s SER 247 N -2.03 0.13 0.17 1.62 0.15 -1.19 -4.88 113.70 107.67 2gq3 s SER 247 Ca 0.37 -0.44 -0.17 0.00 0.70 0.00 0.00 55.95 56.41 2gq3 s SER 247 Cb 0.14 0.22 0.09 0.00 -1.71 0.00 0.00 66.02 64.76 2gq3 s SER 247 CO -0.01 -0.47 1.67 -0.61 1.20 0.00 0.00 173.24 175.02 2gq3 h GLN 248 N 3.84 -0.01 0.17 5.44 5.75 -1.94 1.23 115.11 129.59 2gq3 h GLN 248 Ca -0.32 0.00 -0.30 0.00 -0.15 0.00 0.00 58.65 57.88 2gq3 h GLN 248 Cb 1.19 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.76 2gq3 h GLN 248 CO 0.47 -0.01 -1.38 0.28 -2.65 0.00 0.00 178.83 175.55 2gq3 h VAL 249 N -0.01 1.37 0.06 2.39 2.07 -1.91 -3.38 116.25 116.84 2gq3 h VAL 249 Ca 0.19 -2.89 0.02 0.00 0.82 0.00 0.00 66.70 64.84 2gq3 h VAL 249 Cb 0.30 2.95 -0.05 0.00 -1.52 0.00 0.00 31.29 32.97 2gq3 h VAL 249 CO -0.41 0.86 -0.42 1.23 0.02 0.00 0.00 177.57 178.84 2gq3 h GLY 250 N 1.10 -0.83 -0.05 2.17 0.00 -1.36 -2.74 103.07 101.36 2gq3 h GLY 250 Ca -0.20 0.51 0.18 0.00 0.00 0.00 0.00 47.33 47.82 2gq3 h GLY 250 CO 0.22 -0.26 0.85 -0.84 0.00 0.00 0.00 176.54 176.52 2gq3 h THR 251 N -0.62 0.12 0.00 4.70 2.02 0.20 0.35 112.91 119.68 2gq3 h THR 251 Ca 0.03 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 2gq3 h THR 251 Cb 0.67 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 67.36 2gq3 h THR 251 CO -0.28 0.00 -1.41 0.35 0.37 0.00 0.00 175.52 174.55 2gq3 n THR 252 N -3.27 0.49 -3.04 3.16 -2.24 -1.04 -4.95 114.28 103.38 2gq3 n THR 252 Ca 0.13 -0.55 -0.40 0.00 -2.27 0.00 0.00 64.05 60.96 2gq3 n THR 252 Cb 1.06 -0.26 -0.05 0.00 -2.10 0.00 0.00 70.33 68.98 2gq3 n THR 252 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2gq3 s ASP 253 N -5.12 7.02 0.14 3.42 -1.08 0.12 -4.98 116.67 116.20 2gq3 s ASP 253 Ca -0.04 1.22 -0.31 0.00 -0.52 0.00 0.00 52.55 52.91 2gq3 s ASP 253 Cb 0.11 -2.42 -0.08 0.00 -1.46 0.00 0.00 42.92 39.07 2gq3 s ASP 253 CO 0.83 -0.09 1.53 -0.09 0.52 0.00 0.00 175.17 177.87 2gq3 h ARG 254 N 6.58 -0.16 -0.00 4.34 9.65 -1.86 -2.18 114.38 130.75 2gq3 h ARG 254 Ca -0.42 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.48 2gq3 h ARG 254 Cb 1.20 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.81 2gq3 h ARG 254 CO 0.75 -0.10 -0.26 0.00 2.80 0.00 0.00 179.97 183.15 2gq3 n ALA 255 N -3.17 3.03 0.00 2.80 0.00 -1.01 -4.76 120.51 117.40 2gq3 n ALA 255 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.15 2gq3 n ALA 255 Cb 0.28 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.49 2gq3 n ALA 255 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gq3 n GLY 256 N 1.42 1.05 3.66 0.00 0.00 -0.82 -4.01 105.19 106.49 2gq3 n GLY 256 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2gq3 n GLY 256 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gq3 s VAL 257 N -2.00 3.45 0.08 1.61 1.01 -1.26 0.68 120.40 123.98 2gq3 s VAL 257 Ca 0.00 0.54 -0.05 0.00 0.00 0.00 0.00 61.98 62.47 2gq3 s VAL 257 Cb 0.00 -3.36 -0.27 0.00 0.00 0.00 0.00 36.38 32.75 2gq3 s VAL 257 CO 0.00 -0.07 1.17 0.50 0.00 0.00 0.00 175.10 176.70 2gq3 h LYS 258 N 10.05 0.32 -2.31 2.72 3.64 -0.31 -3.34 116.57 127.34 2gq3 h LYS 258 Ca -0.41 -0.49 0.13 0.00 -1.27 0.00 0.00 60.65 58.61 2gq3 h LYS 258 Cb 1.19 0.17 -0.12 0.00 -0.41 0.00 0.00 32.23 33.06 2gq3 h LYS 258 CO 0.96 1.21 0.49 0.34 -2.27 0.00 0.00 179.45 180.17 2gq3 s ASP 259 N -7.17 -0.30 -0.12 4.20 -1.08 -1.22 -4.60 116.67 106.39 2gq3 s ASP 259 Ca -0.05 -0.15 0.00 0.00 -0.52 0.00 0.00 52.55 51.83 2gq3 s ASP 259 Cb 0.07 0.43 0.02 0.00 -1.46 0.00 0.00 42.92 41.98 2gq3 s ASP 259 CO 0.88 -0.73 -0.11 -0.69 0.52 0.00 0.00 175.17 175.05 2gq3 s VAL 260 N -3.19 1.25 -0.17 1.11 1.01 -1.26 -1.83 120.40 117.31 2gq3 s VAL 260 Ca 0.08 -0.45 -0.05 0.00 0.00 0.00 0.00 61.98 61.56 2gq3 s VAL 260 Cb -0.01 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 2gq3 s VAL 260 CO -0.05 0.40 0.00 -0.63 0.00 0.00 0.00 175.10 174.82 2gq3 s ILE 261 N 1.48 4.17 -0.08 2.22 -1.09 0.82 0.11 121.20 128.83 2gq3 s ILE 261 Ca 0.02 -0.25 0.01 0.00 -2.23 0.00 0.00 60.65 58.20 2gq3 s ILE 261 Cb -0.13 -2.86 -0.03 0.00 -1.58 0.00 0.00 42.46 37.87 2gq3 s ILE 261 CO -0.07 0.47 -0.10 -0.76 -1.23 0.00 0.00 174.94 173.25 2gq3 s LEU 262 N 0.52 2.99 0.15 2.97 1.43 0.12 -1.28 118.68 125.57 2gq3 s LEU 262 Ca -0.01 -0.13 -0.31 0.00 -1.03 0.00 0.00 54.13 52.65 2gq3 s LEU 262 Cb -0.14 -1.65 -0.10 0.00 0.03 0.00 0.00 46.19 44.33 2gq3 s LEU 262 CO 0.02 0.31 1.72 -0.70 0.23 0.00 0.00 176.35 177.93 2gq3 s GLU 263 N -0.50 4.16 0.00 1.70 2.12 -0.85 -0.39 118.70 124.94 2gq3 s GLU 263 Ca 0.07 2.52 0.00 0.00 0.36 0.00 0.00 54.97 57.92 2gq3 s GLU 263 Cb -0.12 -3.36 0.00 0.00 0.26 0.00 0.00 34.13 30.92 2gq3 s GLU 263 CO 0.02 -0.76 0.00 0.43 -0.54 0.00 0.00 175.26 174.41 2gq3 n SER 264 N 4.84 0.00 -4.55 -1.70 7.64 0.13 -4.73 113.62 115.25 2gq3 n SER 264 Ca 0.16 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.69 2gq3 n SER 264 Cb 0.38 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.54 2gq3 n SER 264 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2gq3 s ALA 265 N -2.00 1.96 0.10 -0.43 0.00 -0.96 -3.97 121.76 116.46 2gq3 s ALA 265 Ca 0.00 -0.70 -0.13 0.00 0.00 0.00 0.00 51.96 51.13 2gq3 s ALA 265 Cb 0.00 -4.36 -0.15 0.00 0.00 0.00 0.00 23.12 18.61 2gq3 s ALA 265 CO 0.00 -4.19 1.31 0.82 0.00 0.00 0.00 175.76 173.70 2gq3 h ILE 266 N 7.08 1.28 -3.29 0.00 5.03 -1.72 -3.18 117.51 122.72 2gq3 h ILE 266 Ca -0.19 -1.92 -0.47 0.00 -0.12 0.00 0.00 64.86 62.15 2gq3 h ILE 266 Cb 1.15 1.94 -0.17 0.00 -3.03 0.00 0.00 36.82 36.71 2gq3 h ILE 266 CO 1.20 0.61 -0.76 0.42 -0.68 0.00 0.00 178.15 178.94 2gq3 s THR 267 N -3.81 1.65 0.01 -0.27 -4.23 -1.25 -1.74 115.64 106.00 2gq3 s THR 267 Ca -0.11 -1.93 -0.01 0.00 -1.18 0.00 0.00 61.69 58.47 2gq3 s THR 267 Cb 0.09 -1.80 -0.01 0.00 1.34 0.00 0.00 72.50 72.12 2gq3 s THR 267 CO 0.90 -0.41 0.01 -0.89 -0.54 0.00 0.00 174.62 173.69 2gq3 s THR 268 N -2.29 0.06 -0.26 3.99 2.01 -0.45 -2.04 115.64 116.66 2gq3 s THR 268 Ca 0.15 -0.49 -0.02 0.00 0.31 0.00 0.00 61.69 61.64 2gq3 s THR 268 Cb -0.04 -0.18 0.03 0.00 0.01 0.00 0.00 72.50 72.32 2gq3 s THR 268 CO 0.05 -0.27 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.04 2gq3 s ILE 269 N -0.81 2.92 -0.40 1.82 1.01 0.57 -0.60 121.20 125.70 2gq3 s ILE 269 Ca -0.09 -1.07 -0.23 0.00 0.00 0.00 0.00 60.65 59.26 2gq3 s ILE 269 Cb -0.05 -2.51 0.02 0.00 0.01 0.00 0.00 42.46 39.92 2gq3 s ILE 269 CO -0.00 0.15 0.79 -0.04 0.00 0.00 0.00 174.94 175.84 2gq3 s MET 270 N 1.32 3.61 -0.19 2.79 -1.94 0.83 -2.04 119.30 123.68 2gq3 s MET 270 Ca -0.01 0.15 -0.13 0.00 -1.71 0.00 0.00 55.69 53.99 2gq3 s MET 270 Cb -0.17 -3.87 -0.05 0.00 2.01 0.00 0.00 34.83 32.76 2gq3 s MET 270 CO -0.04 -0.98 0.27 0.34 -0.01 0.00 0.00 175.02 174.61 2gq3 s ASP 271 N 1.98 6.36 0.00 3.03 2.15 0.66 -1.07 116.67 129.78 2gq3 s ASP 271 Ca 0.31 0.42 0.16 0.00 0.43 0.00 0.00 52.55 53.86 2gq3 s ASP 271 Cb -0.13 -2.17 -0.15 0.00 -0.30 0.00 0.00 42.92 40.18 2gq3 s ASP 271 CO 0.20 0.07 0.69 0.49 -0.17 0.00 0.00 175.17 176.45 2gq3 n PHE 272 N 3.85 0.00 0.00 -5.34 3.01 -0.53 -1.32 117.46 117.13 2gq3 n PHE 272 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.34 2gq3 n PHE 272 Cb 0.52 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 2gq3 n PHE 272 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2gq3 n GLU 273 N -1.18 0.00 0.18 -1.08 2.13 -1.25 -4.69 120.64 114.74 2gq3 n GLU 273 Ca 0.04 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.98 2gq3 n GLU 273 Cb 0.26 0.00 0.64 0.00 0.27 0.00 0.00 31.44 32.61 2gq3 n GLU 273 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 2gq3 h ASP 274 N 0.00 0.00 0.26 4.31 3.45 -1.94 -0.99 116.42 121.51 2gq3 h ASP 274 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2gq3 h ASP 274 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 2gq3 h ASP 274 CO 0.00 0.00 -0.59 -1.54 -1.57 0.00 0.00 179.24 175.54 2gq3 n SER 275 N -2.33 0.90 -4.44 6.45 3.41 -1.26 -2.59 113.62 113.75 2gq3 n SER 275 Ca -0.01 -0.71 -0.25 0.00 -0.26 0.00 0.00 58.87 57.63 2gq3 n SER 275 Cb 0.05 0.46 -0.11 0.00 -0.26 0.00 0.00 64.21 64.35 2gq3 n SER 275 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2gq3 s VAL 276 N -2.85 2.40 -0.15 -3.33 -7.23 -0.38 -3.11 120.40 105.75 2gq3 s VAL 276 Ca 0.13 -2.22 -0.03 0.00 -1.81 0.00 0.00 61.98 58.06 2gq3 s VAL 276 Cb 0.17 -2.21 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 2gq3 s VAL 276 CO 0.70 -0.26 -0.05 0.00 -0.31 0.00 0.00 175.10 175.17 2gq3 s ALA 277 N -2.10 2.93 -0.32 1.32 0.00 -1.26 -4.69 121.76 117.64 2gq3 s ALA 277 Ca 0.25 -0.83 -0.04 0.00 0.00 0.00 0.00 51.96 51.34 2gq3 s ALA 277 Cb -0.06 -1.49 0.19 0.00 0.00 0.00 0.00 23.12 21.75 2gq3 s ALA 277 CO 0.12 0.23 0.90 0.00 0.00 0.00 0.00 175.76 177.01 2gq3 s ALA 278 N 0.33 -3.60 -0.80 0.00 0.00 -1.26 -4.91 121.76 111.53 2gq3 s ALA 278 Ca -0.05 1.08 0.08 0.00 0.00 0.00 0.00 51.96 53.07 2gq3 s ALA 278 Cb -0.14 -2.83 0.01 0.00 0.00 0.00 0.00 23.12 20.16 2gq3 s ALA 278 CO 0.03 -2.20 0.60 1.33 0.00 0.00 0.00 175.76 175.53 2gq3 n VAL 279 N 4.59 0.00 -3.98 0.00 0.24 -1.26 -4.76 118.33 113.16 2gq3 n VAL 279 Ca 0.08 -0.44 -0.12 0.00 -2.04 0.00 0.00 64.34 61.82 2gq3 n VAL 279 Cb 0.59 1.11 -0.02 0.00 -1.47 0.00 0.00 33.84 34.05 2gq3 n VAL 279 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 2gq3 s ASP 280 N -1.04 0.46 0.29 -1.34 1.47 -1.26 -4.62 116.67 110.63 2gq3 s ASP 280 Ca 0.07 -1.28 -0.00 0.00 1.18 0.00 0.00 52.55 52.52 2gq3 s ASP 280 Cb 0.06 0.72 0.43 0.00 -0.34 0.00 0.00 42.92 43.79 2gq3 s ASP 280 CO 0.17 -1.41 1.84 0.00 0.68 0.00 0.00 175.17 176.45 2gq3 h ALA 281 N 2.09 1.24 -0.51 2.11 0.00 -1.91 -1.96 119.26 120.32 2gq3 h ALA 281 Ca -0.29 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.45 2gq3 h ALA 281 Cb 1.24 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2gq3 h ALA 281 CO 0.38 0.53 0.31 0.00 0.00 0.00 0.00 179.25 180.47 2gq3 h ALA 282 N 1.37 0.66 0.18 0.00 0.00 -1.98 0.40 119.26 119.89 2gq3 h ALA 282 Ca 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2gq3 h ALA 282 Cb 0.28 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2gq3 h ALA 282 CO -0.00 0.02 -0.08 -0.44 0.00 0.00 0.00 179.25 178.74 2gq3 h ASP 283 N 0.62 -0.20 -0.82 0.00 3.32 -1.89 -0.80 116.42 116.64 2gq3 h ASP 283 Ca 0.21 -0.12 0.07 0.00 0.02 0.00 0.00 57.03 57.21 2gq3 h ASP 283 Cb 0.02 0.05 -0.06 0.00 0.22 0.00 0.00 39.33 39.55 2gq3 h ASP 283 CO -0.09 -0.00 0.49 0.11 -1.72 0.00 0.00 179.24 178.03 2gq3 h LYS 284 N -0.40 0.85 -0.54 3.56 1.79 -1.14 -0.85 116.57 119.84 2gq3 h LYS 284 Ca -0.02 -0.05 -0.08 0.00 -2.18 0.00 0.00 60.65 58.31 2gq3 h LYS 284 Cb 0.31 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 2gq3 h LYS 284 CO 0.04 0.56 0.01 0.28 -1.08 0.00 0.00 179.45 179.26 2gq3 h VAL 285 N 0.88 1.25 -0.47 0.50 2.07 -0.13 0.52 116.25 120.86 2gq3 h VAL 285 Ca 0.37 -1.06 0.05 0.00 0.82 0.00 0.00 66.70 66.88 2gq3 h VAL 285 Cb 0.23 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 2gq3 h VAL 285 CO -0.19 0.38 0.22 0.25 0.02 0.00 0.00 177.57 178.24 2gq3 h LEU 286 N 0.84 0.29 -0.18 2.57 6.46 -0.35 0.78 115.31 125.72 2gq3 h LEU 286 Ca 0.16 0.03 -0.05 0.00 -0.12 0.00 0.00 57.88 57.91 2gq3 h LEU 286 Cb 0.48 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.39 2gq3 h LEU 286 CO 0.02 0.21 -0.07 1.23 -0.62 0.00 0.00 178.44 179.21 2gq3 h GLY 287 N 0.43 0.40 1.02 3.75 0.00 -0.68 -3.02 103.07 104.97 2gq3 h GLY 287 Ca 0.21 -0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.22 2gq3 h GLY 287 CO -0.17 0.32 0.61 -0.97 0.00 0.00 0.00 176.54 176.33 2gq3 h TYR 288 N 0.07 1.14 -0.59 5.60 0.05 -0.71 -2.07 116.97 120.45 2gq3 h TYR 288 Ca 0.04 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.86 2gq3 h TYR 288 Cb 0.53 -0.38 -0.03 0.00 1.01 0.00 0.00 36.73 37.86 2gq3 h TYR 288 CO 0.06 0.68 0.39 -0.09 -1.05 0.00 0.00 178.16 178.15 2gq3 h ARG 289 N 1.20 0.78 -0.33 4.88 2.43 -0.75 1.00 114.38 123.58 2gq3 h ARG 289 Ca 0.36 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.48 2gq3 h ARG 289 Cb -0.05 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 2gq3 h ARG 289 CO -0.10 0.51 0.20 -0.91 -1.51 0.00 0.00 179.97 178.17 2gq3 h ASN 290 N 0.80 0.40 -0.66 -3.80 2.35 -1.38 0.88 115.58 114.17 2gq3 h ASN 290 Ca 0.22 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.91 2gq3 h ASN 290 Cb -0.09 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.15 2gq3 h ASN 290 CO -0.05 0.34 0.39 -0.25 -1.65 0.00 0.00 177.43 176.20 2gq3 h TRP 291 N 0.43 0.89 -0.25 1.19 -0.00 -0.90 -0.71 115.95 116.60 2gq3 h TRP 291 Ca 0.12 -0.00 -0.03 0.00 -0.00 0.00 0.00 58.89 58.98 2gq3 h TRP 291 Cb 0.01 -0.29 -0.01 0.00 -0.00 0.00 0.00 29.16 28.87 2gq3 h TRP 291 CO -0.04 0.60 0.05 1.25 -0.00 0.00 0.00 178.44 180.30 2gq3 h LEU 292 N 0.93 0.38 -1.52 0.65 5.85 -0.53 -1.08 115.31 119.99 2gq3 h LEU 292 Ca 0.24 -0.25 0.15 0.00 0.84 0.00 0.00 57.88 58.86 2gq3 h LEU 292 Cb -0.01 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.86 2gq3 h LEU 292 CO -0.04 0.53 0.52 1.23 -0.34 0.00 0.00 178.44 180.35 2gq3 h GLY 293 N 0.22 0.81 1.71 3.75 0.00 -0.64 0.10 103.07 109.03 2gq3 h GLY 293 Ca 0.08 -0.20 -0.20 0.00 0.00 0.00 0.00 47.33 47.00 2gq3 h GLY 293 CO 0.00 0.06 -0.89 1.41 0.00 0.00 0.00 176.54 177.13 2gq3 h LEU 294 N 0.47 0.33 0.00 3.11 3.38 -0.49 -0.60 115.31 121.51 2gq3 h LEU 294 Ca 0.39 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 2gq3 h LEU 294 Cb 0.84 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 2gq3 h LEU 294 CO -0.14 1.07 -1.03 0.78 0.09 0.00 0.00 178.44 179.21 2gq3 h ASN 295 N 0.14 0.00 1.69 -0.43 2.35 -0.61 -3.18 115.58 115.56 2gq3 h ASN 295 Ca -0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 2gq3 h ASN 295 Cb 1.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.89 2gq3 h ASN 295 CO 0.14 0.15 -0.30 0.11 -1.65 0.00 0.00 177.43 175.88 2gq3 h LYS 296 N 0.00 0.00 0.00 0.81 1.57 -0.90 -2.98 116.57 115.07 2gq3 h LYS 296 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2gq3 h LYS 296 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2gq3 h LYS 296 CO 0.01 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.30 2gq3 n GLY 297 N 1.13 0.66 0.88 3.86 0.00 -0.87 -3.25 105.19 107.60 2gq3 n GLY 297 Ca 0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 2gq3 n GLY 297 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2gq3 n ASP 298 N 0.00 3.08 -4.70 1.61 3.85 -0.46 -4.73 116.55 115.20 2gq3 n ASP 298 Ca 0.00 -1.90 -0.43 0.00 -0.71 0.00 0.00 54.79 51.75 2gq3 n ASP 298 Cb 0.00 -0.23 -0.03 0.00 -1.35 0.00 0.00 41.12 39.51 2gq3 n ASP 298 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 2gq3 n LEU 299 N 1.04 3.77 -4.22 -2.12 7.94 -0.36 -4.98 117.00 118.06 2gq3 n LEU 299 Ca 0.15 1.05 -0.16 0.00 -1.11 0.00 0.00 56.01 55.95 2gq3 n LEU 299 Cb 0.49 -1.53 -0.11 0.00 0.53 0.00 0.00 43.42 42.80 2gq3 n LEU 299 CO 0.12 0.06 -0.43 0.00 -1.11 0.00 0.00 177.39 176.03 2gq3 s ALA 300 N 1.38 1.37 -0.27 1.96 0.00 -1.26 -4.07 121.76 120.87 2gq3 s ALA 300 Ca 0.77 -1.31 -0.24 0.00 0.00 0.00 0.00 51.96 51.18 2gq3 s ALA 300 Cb -0.55 -0.01 0.08 0.00 0.00 0.00 0.00 23.12 22.64 2gq3 s ALA 300 CO 0.35 0.01 0.79 0.00 0.00 0.00 0.00 175.76 176.90 2gq3 s ALA 301 N -2.54 -1.84 -0.28 0.00 0.00 -0.51 -4.89 121.76 111.70 2gq3 s ALA 301 Ca 0.10 2.04 -0.29 0.00 0.00 0.00 0.00 51.96 53.82 2gq3 s ALA 301 Cb -0.02 -1.27 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 2gq3 s ALA 301 CO 0.02 -0.32 1.80 0.00 0.00 0.00 0.00 175.76 177.25 2gq3 s ALA 302 N 0.50 2.99 -0.83 0.00 0.00 -1.26 -1.15 121.76 122.01 2gq3 s ALA 302 Ca -0.01 0.41 -0.09 0.00 0.00 0.00 0.00 51.96 52.27 2gq3 s ALA 302 Cb -0.05 -3.97 0.22 0.00 0.00 0.00 0.00 23.12 19.32 2gq3 s ALA 302 CO -0.03 -2.42 0.75 -1.17 0.00 0.00 0.00 175.76 172.88 2gq3 s LEU 311 N 6.48 6.19 0.35 0.00 2.96 -1.26 -5.09 118.68 128.31 2gq3 s LEU 311 Ca 0.80 -3.00 -0.27 0.00 -0.22 0.00 0.00 54.13 51.44 2gq3 s LEU 311 Cb -0.25 -2.09 -0.12 0.00 0.50 0.00 0.00 46.19 44.23 2gq3 s LEU 311 CO 0.33 -0.43 1.16 -2.11 -1.32 0.00 0.00 176.35 173.98 2gq3 n ARG 312 N 3.45 1.75 -4.39 1.98 1.85 -0.30 -5.05 116.66 115.96 2gq3 n ARG 312 Ca 0.15 0.62 -0.20 0.00 -1.00 0.00 0.00 57.85 57.42 2gq3 n ARG 312 Cb 0.42 -2.14 -0.10 0.00 -1.05 0.00 0.00 32.46 29.60 2gq3 n ARG 312 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 2gq3 s VAL 313 N -1.12 0.76 0.29 8.89 -7.23 -1.26 -1.42 120.40 119.30 2gq3 s VAL 313 Ca 0.58 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.45 2gq3 s VAL 313 Cb -0.60 -2.65 -0.12 0.00 0.56 0.00 0.00 36.38 33.57 2gq3 s VAL 313 CO 0.60 0.00 1.53 0.18 -0.31 0.00 0.00 175.10 177.10 2gq3 n LEU 314 N -0.61 4.04 -4.77 1.32 4.77 -1.26 -4.94 117.00 115.56 2gq3 n LEU 314 Ca -0.01 1.15 -0.40 0.00 -0.03 0.00 0.00 56.01 56.72 2gq3 n LEU 314 Cb 0.66 -1.55 -0.03 0.00 -2.33 0.00 0.00 43.42 40.17 2gq3 n LEU 314 CO 0.39 -0.04 0.89 0.20 -1.33 0.00 0.00 177.39 177.50 2gq3 s ASN 315 N 0.36 6.94 0.85 -1.43 0.01 -1.26 -5.04 114.94 115.37 2gq3 s ASN 315 Ca 0.64 2.48 -0.11 0.00 -0.71 0.00 0.00 52.86 55.16 2gq3 s ASN 315 Cb -0.53 -2.64 0.10 0.00 0.41 0.00 0.00 41.25 38.59 2gq3 s ASN 315 CO 0.51 -0.40 1.10 -0.13 -1.51 0.00 0.00 177.10 176.66 2gq3 s ARG 316 N -1.72 1.59 0.97 -0.60 0.52 -1.26 -4.60 118.95 113.85 2gq3 s ARG 316 Ca 0.48 1.09 -0.12 0.00 -0.52 0.00 0.00 55.73 56.66 2gq3 s ARG 316 Cb -0.36 -1.83 0.17 0.00 0.52 0.00 0.00 34.95 33.46 2gq3 s ARG 316 CO 0.46 -2.09 1.09 -0.51 0.02 0.00 0.00 175.30 174.28 2gq3 s ASP 317 N -3.26 2.78 -0.19 0.23 1.01 -1.26 -4.30 116.67 111.68 2gq3 s ASP 317 Ca 0.63 1.36 -0.01 0.00 0.71 0.00 0.00 52.55 55.24 2gq3 s ASP 317 Cb -0.19 -2.03 0.01 0.00 1.01 0.00 0.00 42.92 41.72 2gq3 s ASP 317 CO 0.57 -3.05 -0.14 -0.13 0.21 0.00 0.00 175.17 172.63 2gq3 s ARG 318 N -4.90 3.16 -0.05 8.23 0.52 -0.48 -4.83 118.95 120.59 2gq3 s ARG 318 Ca 0.65 -0.75 -0.15 0.00 -0.52 0.00 0.00 55.73 54.96 2gq3 s ARG 318 Cb -0.19 -2.74 -0.05 0.00 0.52 0.00 0.00 34.95 32.49 2gq3 s ARG 318 CO 0.58 -0.18 0.40 -0.80 0.02 0.00 0.00 175.30 175.32 2gq3 s ASN 319 N 1.31 6.73 0.23 0.23 0.01 -1.26 -0.90 114.94 121.28 2gq3 s ASN 319 Ca 0.04 0.86 0.02 0.00 -0.71 0.00 0.00 52.86 53.08 2gq3 s ASN 319 Cb -0.14 -2.25 -0.05 0.00 0.41 0.00 0.00 41.25 39.23 2gq3 s ASN 319 CO -0.08 0.23 0.04 -0.31 -1.51 0.00 0.00 177.10 175.47 2gq3 s TYR 320 N -0.51 1.50 -0.14 2.20 1.51 0.38 -4.89 117.35 117.39 2gq3 s TYR 320 Ca 0.23 -1.04 -0.08 0.00 -1.01 0.00 0.00 57.07 55.17 2gq3 s TYR 320 Cb -0.16 -0.88 -0.04 0.00 -0.11 0.00 0.00 41.96 40.77 2gq3 s TYR 320 CO 0.11 -0.18 0.14 0.99 -1.11 0.00 0.00 175.55 175.50 2gq3 s THR 321 N -3.59 5.48 0.43 -0.71 2.01 0.24 -1.70 115.64 117.79 2gq3 s THR 321 Ca 0.31 0.21 -0.12 0.00 0.31 0.00 0.00 61.69 62.39 2gq3 s THR 321 Cb 0.07 -3.42 -0.07 0.00 0.01 0.00 0.00 72.50 69.08 2gq3 s THR 321 CO 0.10 0.56 0.83 0.00 -0.69 0.00 0.00 174.62 175.42 2gq3 s ALA 322 N -0.60 3.27 0.32 7.40 0.00 0.16 -1.85 121.76 130.46 2gq3 s ALA 322 Ca 0.13 -0.08 0.09 0.00 0.00 0.00 0.00 51.96 52.10 2gq3 s ALA 322 Cb -0.12 -2.82 0.92 0.00 0.00 0.00 0.00 23.12 21.10 2gq3 s ALA 322 CO 0.02 -0.05 1.67 -1.35 0.00 0.00 0.00 175.76 176.06 2gq3 h PRO 323 N 1.24 0.33 0.00 0.00 0.11 -1.84 -2.36 132.00 129.47 2gq3 h PRO 323 Ca -0.47 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.45 2gq3 h PRO 323 Cb 1.19 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2gq3 h PRO 323 CO 0.63 0.22 -0.82 0.78 -0.21 0.00 0.00 178.00 178.60 2gq3 h GLY 324 N 0.34 0.00 0.00 -0.55 0.00 -1.93 -3.34 103.07 97.60 2gq3 h GLY 324 Ca 0.66 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.99 2gq3 h GLY 324 CO -0.59 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.56 2gq3 n GLY 325 N 0.84 0.09 0.00 4.60 0.00 -0.89 -5.00 105.19 104.84 2gq3 n GLY 325 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2gq3 n GLY 325 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gq3 n GLY 326 N 0.00 2.29 3.90 -0.02 0.00 -1.26 -4.66 105.19 105.44 2gq3 n GLY 326 Ca 0.00 -2.13 -0.32 0.00 0.00 0.00 0.00 46.02 43.57 2gq3 n GLY 326 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2gq3 s GLN 327 N -1.45 3.54 0.25 1.61 -1.52 -1.26 0.40 119.66 121.23 2gq3 s GLN 327 Ca 0.00 -0.23 -0.03 0.00 -1.95 0.00 0.00 55.36 53.15 2gq3 s GLN 327 Cb 0.00 -2.97 -0.02 0.00 -0.22 0.00 0.00 33.01 29.80 2gq3 s GLN 327 CO 0.00 0.56 0.29 -0.59 -0.25 0.00 0.00 175.29 175.30 2gq3 s PHE 328 N -1.53 1.03 -0.03 0.91 -0.12 -0.69 -4.91 117.98 112.63 2gq3 s PHE 328 Ca 0.36 -1.24 -0.01 0.00 -0.05 0.00 0.00 56.93 55.98 2gq3 s PHE 328 Cb -0.13 -0.32 0.03 0.00 -0.63 0.00 0.00 43.02 41.97 2gq3 s PHE 328 CO 0.24 -0.84 0.04 0.99 -0.05 0.00 0.00 175.22 175.61 2gq3 s THR 329 N -3.86 -0.04 0.20 -4.49 2.01 -1.26 -0.47 115.64 107.74 2gq3 s THR 329 Ca 0.34 0.31 -0.07 0.00 0.31 0.00 0.00 61.69 62.58 2gq3 s THR 329 Cb 0.03 -0.16 -0.06 0.00 0.01 0.00 0.00 72.50 72.31 2gq3 s THR 329 CO 0.15 0.15 0.48 -0.76 -0.69 0.00 0.00 174.62 173.95 2gq3 s LEU 330 N 1.72 4.20 0.43 4.42 1.43 -0.08 -4.94 118.68 125.86 2gq3 s LEU 330 Ca -0.01 0.78 -0.25 0.00 -1.03 0.00 0.00 54.13 53.62 2gq3 s LEU 330 Cb -0.12 -3.53 -0.08 0.00 0.03 0.00 0.00 46.19 42.49 2gq3 s LEU 330 CO -0.03 -0.03 1.27 -2.84 0.23 0.00 0.00 176.35 174.95 2gq3 s PRO 331 N -2.78 3.86 0.02 1.29 0.02 -1.26 -1.39 135.00 134.77 2gq3 s PRO 331 Ca 0.45 2.06 0.22 0.00 0.02 0.00 0.00 61.00 63.75 2gq3 s PRO 331 Cb -0.12 -2.64 -0.10 0.00 0.02 0.00 0.00 34.50 31.66 2gq3 s PRO 331 CO 0.23 -0.55 0.88 0.41 -0.33 0.00 0.00 177.00 177.64 2gq3 n GLY 332 N 0.64 -1.12 3.35 0.52 0.00 -1.26 -4.65 105.19 102.68 2gq3 n GLY 332 Ca 0.05 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.32 2gq3 n GLY 332 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gq3 s ARG 333 N -3.22 1.32 0.58 1.61 0.52 -1.26 -4.59 118.95 113.91 2gq3 s ARG 333 Ca 0.02 -1.28 -0.20 0.00 -0.52 0.00 0.00 55.73 53.76 2gq3 s ARG 333 Cb 0.15 -1.73 -0.04 0.00 0.52 0.00 0.00 34.95 33.85 2gq3 s ARG 333 CO 0.84 0.41 1.27 -1.12 0.02 0.00 0.00 175.30 176.72 2gq3 s SER 334 N -1.97 5.13 0.21 0.23 0.01 -0.11 -4.88 113.70 112.33 2gq3 s SER 334 Ca 0.11 2.54 -0.30 0.00 1.31 0.00 0.00 55.95 59.62 2gq3 s SER 334 Cb -0.10 -2.61 -0.08 0.00 0.21 0.00 0.00 66.02 63.43 2gq3 s SER 334 CO 0.05 -1.64 1.10 -0.22 0.41 0.00 0.00 173.24 172.94 2gq3 s LEU 335 N -3.92 4.51 -0.20 2.44 1.98 -0.71 -4.84 118.68 117.94 2gq3 s LEU 335 Ca 0.76 2.14 -0.05 0.00 -2.89 0.00 0.00 54.13 54.09 2gq3 s LEU 335 Cb -0.35 -3.61 -0.02 0.00 0.66 0.00 0.00 46.19 42.87 2gq3 s LEU 335 CO 0.39 -0.19 -0.00 -0.04 -1.89 0.00 0.00 176.35 174.61 2gq3 s MET 336 N -0.69 3.60 0.36 1.98 -1.94 -1.26 -1.34 119.30 120.02 2gq3 s MET 336 Ca 0.48 -0.53 -0.06 0.00 -1.71 0.00 0.00 55.69 53.87 2gq3 s MET 336 Cb -0.30 -3.07 -0.05 0.00 2.01 0.00 0.00 34.83 33.42 2gq3 s MET 336 CO 0.36 0.01 0.66 -0.06 -0.01 0.00 0.00 175.02 175.99 2gq3 s PHE 337 N 1.00 3.49 -0.12 -0.03 0.40 0.23 -4.58 117.98 118.37 2gq3 s PHE 337 Ca 0.02 0.78 0.00 0.00 -0.60 0.00 0.00 56.93 57.13 2gq3 s PHE 337 Cb -0.14 -2.23 -0.02 0.00 0.51 0.00 0.00 43.02 41.14 2gq3 s PHE 337 CO 0.02 -0.00 -0.13 0.54 0.70 0.00 0.00 175.22 176.34 2gq3 s VAL 338 N -2.31 3.07 -0.52 -0.44 0.11 -0.47 -0.12 120.40 119.71 2gq3 s VAL 338 Ca 0.47 -0.67 -0.21 0.00 -2.93 0.00 0.00 61.98 58.64 2gq3 s VAL 338 Cb -0.10 -2.27 0.05 0.00 -1.53 0.00 0.00 36.38 32.52 2gq3 s VAL 338 CO 0.33 0.54 0.74 -0.60 -3.33 0.00 0.00 175.10 172.78 2gq3 s ARG 339 N 0.14 3.20 0.78 1.54 3.52 -0.23 -0.21 118.95 127.70 2gq3 s ARG 339 Ca -0.07 -0.64 -0.12 0.00 -0.13 0.00 0.00 55.73 54.78 2gq3 s ARG 339 Cb -0.15 -4.07 0.06 0.00 -1.56 0.00 0.00 34.95 29.23 2gq3 s ARG 339 CO 0.05 -1.30 1.11 -0.80 -0.81 0.00 0.00 175.30 173.55 2gq3 s ASN 340 N 2.71 4.71 0.74 -2.12 0.02 -0.73 -1.45 114.94 118.82 2gq3 s ASN 340 Ca 0.21 1.14 -0.11 0.00 -1.02 0.00 0.00 52.86 53.08 2gq3 s ASN 340 Cb -0.17 -1.84 0.04 0.00 0.02 0.00 0.00 41.25 39.30 2gq3 s ASN 340 CO 0.15 -1.81 1.08 0.68 0.02 0.00 0.00 177.10 177.21 2gq3 s VAL 341 N -3.30 3.62 0.00 1.60 -7.23 -1.26 -4.23 120.40 109.61 2gq3 s VAL 341 Ca 0.60 0.53 0.00 0.00 -1.81 0.00 0.00 61.98 61.30 2gq3 s VAL 341 Cb -0.13 -3.22 0.00 0.00 0.56 0.00 0.00 36.38 33.59 2gq3 s VAL 341 CO 0.53 -0.69 0.00 0.61 -0.31 0.00 0.00 175.10 175.24 2gq3 n GLY 342 N -1.85 -0.40 0.06 2.32 0.00 -1.26 -4.56 105.19 99.49 2gq3 n GLY 342 Ca 0.08 -1.71 0.13 0.00 0.00 0.00 0.00 46.02 44.52 2gq3 n GLY 342 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2gq3 n HIS 343 N -0.42 0.53 0.09 1.61 8.25 -1.26 -4.14 115.22 119.87 2gq3 n HIS 343 Ca 0.00 0.15 -0.05 0.00 -0.26 0.00 0.00 57.72 57.57 2gq3 n HIS 343 Cb 0.00 -0.74 -0.02 0.00 1.12 0.00 0.00 29.99 30.34 2gq3 n HIS 343 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2gq3 h LEU 344 N 0.00 -0.27 -9.97 2.41 5.85 -1.94 -3.47 115.31 107.93 2gq3 h LEU 344 Ca 0.00 0.01 -0.48 0.00 0.84 0.00 0.00 57.88 58.24 2gq3 h LEU 344 Cb 0.64 0.07 0.02 0.00 0.37 0.00 0.00 40.66 41.76 2gq3 h LEU 344 CO 0.00 0.18 0.42 -0.04 -0.34 0.00 0.00 178.44 178.66 2gq3 s MET 345 N -2.56 4.12 0.38 1.25 -1.94 -1.26 -4.95 119.30 114.34 2gq3 s MET 345 Ca -0.05 1.54 0.07 0.00 -1.71 0.00 0.00 55.69 55.55 2gq3 s MET 345 Cb 0.00 -2.53 0.00 0.00 2.01 0.00 0.00 34.83 34.32 2gq3 s MET 345 CO 0.14 -0.19 0.53 0.95 -0.01 0.00 0.00 175.02 176.44 2gq3 s THR 346 N -1.64 3.53 -0.13 2.05 -4.23 -1.26 -1.60 115.64 112.35 2gq3 s THR 346 Ca 0.58 -0.98 -0.12 0.00 -1.18 0.00 0.00 61.69 60.00 2gq3 s THR 346 Cb -0.23 -3.21 0.03 0.00 1.34 0.00 0.00 72.50 70.44 2gq3 s THR 346 CO 0.28 -0.08 0.35 0.21 -0.54 0.00 0.00 174.62 174.84 2gq3 s ASN 347 N -4.27 -0.36 -0.03 3.99 3.84 -0.33 -4.71 114.94 113.07 2gq3 s ASN 347 Ca 0.50 0.70 0.04 0.00 0.21 0.00 0.00 52.86 54.31 2gq3 s ASN 347 Cb -0.10 0.71 0.19 0.00 -0.55 0.00 0.00 41.25 41.50 2gq3 s ASN 347 CO 0.32 -0.12 0.95 -0.90 -2.79 0.00 0.00 177.10 174.56 2gq3 n ASP 348 N 2.91 1.66 0.04 -4.21 3.85 -1.26 -3.17 116.55 116.37 2gq3 n ASP 348 Ca -0.13 -2.13 0.02 0.00 -0.71 0.00 0.00 54.79 51.84 2gq3 n ASP 348 Cb 0.58 -0.36 0.38 0.00 -1.35 0.00 0.00 41.12 40.37 2gq3 n ASP 348 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2gq3 h ALA 349 N 2.86 1.56 -3.30 2.12 0.00 -1.92 -3.42 119.26 117.16 2gq3 h ALA 349 Ca 0.00 -0.13 -0.39 0.00 0.00 0.00 0.00 54.91 54.39 2gq3 h ALA 349 Cb 0.60 -0.13 -0.21 0.00 0.00 0.00 0.00 17.79 18.05 2gq3 h ALA 349 CO 0.07 0.33 -0.77 0.42 0.00 0.00 0.00 179.25 179.30 2gq3 s ILE 350 N -5.10 1.03 0.17 0.00 1.01 -1.24 -1.72 121.20 115.35 2gq3 s ILE 350 Ca -0.07 -1.32 -0.01 0.00 0.00 0.00 0.00 60.65 59.25 2gq3 s ILE 350 Cb 0.16 -1.05 -0.04 0.00 0.01 0.00 0.00 42.46 41.54 2gq3 s ILE 350 CO 0.74 -0.28 0.10 0.68 0.00 0.00 0.00 174.94 176.18 2gq3 s VAL 351 N -1.42 0.05 0.61 2.92 -7.23 -0.79 -2.64 120.40 111.91 2gq3 s VAL 351 Ca -0.02 -1.94 0.08 0.00 -1.81 0.00 0.00 61.98 58.29 2gq3 s VAL 351 Cb -0.09 -2.27 0.10 0.00 0.56 0.00 0.00 36.38 34.68 2gq3 s VAL 351 CO 0.02 -0.23 0.85 1.51 -0.31 0.00 0.00 175.10 176.94 2gq3 s ASP 352 N -3.10 4.92 0.58 4.85 -4.77 -0.74 0.97 116.67 119.37 2gq3 s ASP 352 Ca 0.31 -0.83 0.28 0.00 -3.30 0.00 0.00 52.55 49.01 2gq3 s ASP 352 Cb 0.07 0.36 1.54 0.00 -1.09 0.00 0.00 42.92 43.80 2gq3 s ASP 352 CO 0.07 -1.49 2.00 0.71 0.70 0.00 0.00 175.17 177.17 2gq3 h THR 353 N 0.02 0.48 -0.62 2.11 1.35 -1.81 0.30 112.91 114.75 2gq3 h THR 353 Ca -0.30 0.00 -0.41 0.00 -0.55 0.00 0.00 66.41 65.16 2gq3 h THR 353 Cb 1.29 0.74 -0.25 0.00 -1.73 0.00 0.00 68.15 68.19 2gq3 h THR 353 CO 0.40 0.00 -0.14 -0.90 -0.25 0.00 0.00 175.52 174.63 2gq3 n ASP 354 N -3.88 4.31 0.00 5.36 5.68 -1.26 -4.99 116.55 121.76 2gq3 n ASP 354 Ca 0.06 -3.78 0.00 0.00 -0.50 0.00 0.00 54.79 50.56 2gq3 n ASP 354 Cb 0.50 -0.61 0.00 0.00 -1.14 0.00 0.00 41.12 39.88 2gq3 n ASP 354 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2gq3 n GLY 355 N -0.95 1.85 3.75 6.12 0.00 0.11 -4.99 105.19 111.08 2gq3 n GLY 355 Ca 0.43 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.04 2gq3 n GLY 355 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gq3 s SER 356 N -3.42 6.65 0.55 1.61 0.01 -1.26 -4.62 113.70 113.22 2gq3 s SER 356 Ca 0.00 2.71 -0.19 0.00 1.31 0.00 0.00 55.95 59.78 2gq3 s SER 356 Cb 0.00 -2.63 -0.05 0.00 0.21 0.00 0.00 66.02 63.54 2gq3 s SER 356 CO 0.00 -0.68 1.15 -1.61 0.41 0.00 0.00 173.24 172.51 2gq3 s GLU 357 N -0.89 3.28 0.07 12.44 2.02 -1.26 -1.80 118.70 132.56 2gq3 s GLU 357 Ca 0.56 1.66 -0.07 0.00 0.02 0.00 0.00 54.97 57.14 2gq3 s GLU 357 Cb -0.42 -2.00 -0.05 0.00 0.10 0.00 0.00 34.13 31.76 2gq3 s GLU 357 CO 0.48 -0.92 0.35 0.08 0.02 0.00 0.00 175.26 175.27 2gq3 s VAL 358 N -1.72 5.18 0.18 2.63 1.01 -1.08 -4.76 120.40 121.83 2gq3 s VAL 358 Ca 0.74 0.26 -0.33 0.00 0.00 0.00 0.00 61.98 62.64 2gq3 s VAL 358 Cb -0.25 -3.62 -0.14 0.00 0.00 0.00 0.00 36.38 32.37 2gq3 s VAL 358 CO 0.28 0.25 1.51 0.49 0.00 0.00 0.00 175.10 177.63 2gq3 n PHE 359 N 0.76 2.19 0.08 5.22 3.01 -1.26 -1.19 117.46 126.26 2gq3 n PHE 359 Ca -0.07 0.35 -0.11 0.00 1.01 0.00 0.00 57.45 58.62 2gq3 n PHE 359 Cb 0.52 -2.50 -0.04 0.00 -0.01 0.00 0.00 39.48 37.45 2gq3 n PHE 359 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 2gq3 h GLU 360 N 5.29 0.29 -0.55 -1.08 4.81 -1.58 -3.07 114.58 118.70 2gq3 h GLU 360 Ca -0.45 -0.33 -0.10 0.00 -0.13 0.00 0.00 59.36 58.34 2gq3 h GLU 360 Cb 1.27 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.72 2gq3 h GLU 360 CO 0.84 1.04 -0.07 0.78 -0.73 0.00 0.00 179.01 180.87 2gq3 h GLY 361 N 1.58 1.08 1.30 1.92 0.00 -1.75 0.88 103.07 108.09 2gq3 h GLY 361 Ca -0.07 -0.83 -0.00 0.00 0.00 0.00 0.00 47.33 46.42 2gq3 h GLY 361 CO 0.15 0.77 0.41 -2.22 0.00 0.00 0.00 176.54 175.65 2gq3 h ILE 362 N 0.90 1.19 -0.07 2.60 2.04 -1.90 -2.22 117.51 120.07 2gq3 h ILE 362 Ca 0.15 -0.42 -0.13 0.00 1.00 0.00 0.00 64.86 65.46 2gq3 h ILE 362 Cb 0.62 0.23 0.01 0.00 -0.74 0.00 0.00 36.82 36.93 2gq3 h ILE 362 CO 0.04 0.20 -0.46 0.24 0.00 0.00 0.00 178.15 178.17 2gq3 h MET 363 N 0.94 0.43 -0.89 2.37 2.86 -1.26 -2.78 114.93 116.59 2gq3 h MET 363 Ca 0.25 -0.37 0.14 0.00 -2.06 0.00 0.00 59.70 57.65 2gq3 h MET 363 Cb -0.04 0.09 -0.09 0.00 0.06 0.00 0.00 31.60 31.62 2gq3 h MET 363 CO -0.05 1.02 0.50 -0.44 1.06 0.00 0.00 176.91 179.00 2gq3 h ASP 364 N -0.04 0.65 0.40 1.22 5.19 -0.75 0.55 116.42 123.64 2gq3 h ASP 364 Ca -0.04 0.08 -0.02 0.00 -0.62 0.00 0.00 57.03 56.43 2gq3 h ASP 364 Cb 1.13 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.61 2gq3 h ASP 364 CO 0.09 0.29 -0.19 0.00 -3.12 0.00 0.00 179.24 176.32 2gq3 h ALA 365 N 1.55 -0.54 -0.50 3.45 0.00 -1.34 0.24 119.26 122.12 2gq3 h ALA 365 Ca 0.47 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 55.29 2gq3 h ALA 365 Cb 0.62 0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.52 2gq3 h ALA 365 CO -0.33 -0.70 -0.47 -0.07 0.00 0.00 0.00 179.25 177.68 2gq3 h LEU 366 N -0.74 -1.60 0.12 0.00 3.38 -1.22 0.62 115.31 115.87 2gq3 h LEU 366 Ca -0.05 0.24 -0.24 0.00 0.09 0.00 0.00 57.88 57.92 2gq3 h LEU 366 Cb 0.52 0.70 0.01 0.00 0.09 0.00 0.00 40.66 41.97 2gq3 h LEU 366 CO 0.09 -0.36 -1.15 -0.26 0.09 0.00 0.00 178.44 176.85 2gq3 h PHE 367 N -0.29 0.48 -0.73 1.13 0.05 -0.83 -1.60 116.94 115.16 2gq3 h PHE 367 Ca 0.14 -0.35 0.06 0.00 3.82 0.00 0.00 57.97 61.64 2gq3 h PHE 367 Cb 0.57 -0.02 -0.05 0.00 2.00 0.00 0.00 35.95 38.46 2gq3 h PHE 367 CO -0.70 1.45 0.48 1.79 -0.18 0.00 0.00 178.31 181.14 2gq3 h THR 368 N -0.35 1.02 -0.34 -1.55 1.35 -0.61 -0.73 112.91 111.71 2gq3 h THR 368 Ca -0.23 -0.26 -0.06 0.00 -0.55 0.00 0.00 66.41 65.30 2gq3 h THR 368 Cb 1.70 0.20 -0.01 0.00 -1.73 0.00 0.00 68.15 68.31 2gq3 h THR 368 CO 0.09 0.14 -0.03 1.23 -0.25 0.00 0.00 175.52 176.70 2gq3 h GLY 369 N 0.76 0.67 0.49 5.82 0.00 -0.90 -1.82 103.07 108.09 2gq3 h GLY 369 Ca 0.31 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 2gq3 h GLY 369 CO -0.10 0.48 -0.49 -2.00 0.00 0.00 0.00 176.54 174.42 2gq3 h LEU 370 N 0.42 -1.34 -1.40 3.11 5.85 -0.67 -2.95 115.31 118.33 2gq3 h LEU 370 Ca 0.09 0.11 0.10 0.00 0.84 0.00 0.00 57.88 59.02 2gq3 h LEU 370 Cb 0.50 0.44 -0.05 0.00 0.37 0.00 0.00 40.66 41.92 2gq3 h LEU 370 CO 0.02 -0.65 0.50 0.40 -0.34 0.00 0.00 178.44 178.38 2gq3 h ILE 371 N -0.98 0.93 0.00 4.05 2.04 -1.10 -1.45 117.51 121.00 2gq3 h ILE 371 Ca -0.06 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 2gq3 h ILE 371 Cb 0.85 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2gq3 h ILE 371 CO -0.06 0.12 -0.01 0.00 0.00 0.00 0.00 178.15 178.20 2gq3 h ALA 372 N 1.62 1.62 -0.76 1.87 0.00 -1.15 -2.67 119.26 119.79 2gq3 h ALA 372 Ca 0.36 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.35 2gq3 h ALA 372 Cb 0.50 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 2gq3 h ALA 372 CO -0.13 0.02 0.40 0.82 0.00 0.00 0.00 179.25 180.35 2gq3 h ILE 373 N 0.00 0.86 0.00 0.00 2.04 -1.23 -1.43 117.51 117.75 2gq3 h ILE 373 Ca -0.00 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 2gq3 h ILE 373 Cb 0.03 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.25 2gq3 h ILE 373 CO 0.00 0.12 -0.00 0.45 0.00 0.00 0.00 178.15 178.72 2gq3 h HIS 374 N 0.66 0.00 0.00 1.37 3.86 -1.66 -1.30 115.15 118.08 2gq3 h HIS 374 Ca 0.37 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.58 2gq3 h HIS 374 Cb 0.38 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.85 2gq3 h HIS 374 CO -0.09 0.00 -0.16 0.41 0.86 0.00 0.00 177.93 178.95 2gq3 n GLY 375 N -1.20 -1.47 0.03 2.45 0.00 -0.54 -3.61 105.19 100.85 2gq3 n GLY 375 Ca -0.03 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 45.96 2gq3 n GLY 375 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gq3 n LEU 376 N -1.65 0.42 -3.95 0.99 4.77 -0.49 0.11 117.00 117.20 2gq3 n LEU 376 Ca 0.06 0.31 -0.09 0.00 -0.03 0.00 0.00 56.01 56.26 2gq3 n LEU 376 Cb 0.36 -0.33 -0.08 0.00 -2.33 0.00 0.00 43.42 41.04 2gq3 n LEU 376 CO 0.30 -0.00 -0.14 -1.59 -1.33 0.00 0.00 177.39 174.63 2gq3 s LYS 377 N -3.05 0.89 -0.25 3.23 0.00 -1.24 -4.82 119.74 114.50 2gq3 s LYS 377 Ca 0.11 -1.10 0.01 0.00 0.00 0.00 0.00 55.97 54.99 2gq3 s LYS 377 Cb 0.16 0.32 0.04 0.00 0.00 0.00 0.00 37.83 38.36 2gq3 s LYS 377 CO 0.63 -0.28 -0.09 0.00 0.00 0.00 0.00 175.35 175.61 2gq3 s ALA 378 N -3.91 2.62 0.18 0.59 0.00 -1.26 -4.64 121.76 115.33 2gq3 s ALA 378 Ca 0.10 -1.61 -0.04 0.00 0.00 0.00 0.00 51.96 50.41 2gq3 s ALA 378 Cb 0.05 -1.62 0.02 0.00 0.00 0.00 0.00 23.12 21.56 2gq3 s ALA 378 CO -0.07 -0.99 0.30 -1.13 0.00 0.00 0.00 175.76 173.87 2gq3 n SER 379 N 4.56 -0.86 0.03 0.00 3.41 -0.61 -4.96 113.62 115.19 2gq3 n SER 379 Ca -0.15 -1.84 -0.16 0.00 -0.26 0.00 0.00 58.87 56.45 2gq3 n SER 379 Cb 0.45 1.51 -0.06 0.00 -0.26 0.00 0.00 64.21 65.84 2gq3 n SER 379 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2gq3 h ASP 380 N 0.95 0.76 0.38 4.04 5.19 -1.98 -2.25 116.42 123.50 2gq3 h ASP 380 Ca -0.14 -0.57 -0.02 0.00 -0.62 0.00 0.00 57.03 55.68 2gq3 h ASP 380 Cb 0.58 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 39.86 2gq3 h ASP 380 CO 0.19 1.36 -0.18 0.58 -3.12 0.00 0.00 179.24 178.07 2gq3 h VAL 381 N 0.37 0.54 0.00 -1.35 2.07 -1.96 -3.23 116.25 112.68 2gq3 h VAL 381 Ca -0.08 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.87 2gq3 h VAL 381 Cb 1.54 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 2gq3 h VAL 381 CO 0.17 0.09 0.00 0.59 0.02 0.00 0.00 177.57 178.45 2gq3 n ASN 382 N -5.17 0.00 -0.44 0.57 3.02 -1.25 -4.95 115.26 107.04 2gq3 n ASN 382 Ca -0.10 -0.59 0.06 0.00 -0.03 0.00 0.00 54.58 53.92 2gq3 n ASN 382 Cb 0.28 -0.06 -0.02 0.00 -0.61 0.00 0.00 39.78 39.37 2gq3 n ASN 382 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gq3 n GLY 383 N 0.54 -2.03 0.13 7.41 0.00 -0.85 -4.23 105.19 106.16 2gq3 n GLY 383 Ca 0.16 -1.39 0.12 0.00 0.00 0.00 0.00 46.02 44.92 2gq3 n GLY 383 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gq3 h PRO 384 N -0.42 0.00 -6.80 1.61 0.13 -1.59 -1.61 132.00 123.32 2gq3 h PRO 384 Ca -0.02 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.57 2gq3 h PRO 384 Cb 0.41 0.00 0.09 0.00 0.13 0.00 0.00 31.00 31.63 2gq3 h PRO 384 CO 0.01 0.00 0.80 -0.11 -0.23 0.00 0.00 178.00 178.47 2gq3 n LEU 385 N -2.64 4.26 -4.32 1.56 0.00 -1.24 -4.58 117.00 110.04 2gq3 n LEU 385 Ca 0.02 1.17 -0.31 0.00 0.00 0.00 0.00 56.01 56.88 2gq3 n LEU 385 Cb 0.52 -1.57 -0.16 0.00 0.00 0.00 0.00 43.42 42.21 2gq3 n LEU 385 CO 0.38 0.03 -0.55 -0.63 0.00 0.00 0.00 177.39 176.62 2gq3 s ILE 386 N -0.36 2.24 -0.11 1.96 1.01 -1.26 -4.48 121.20 120.20 2gq3 s ILE 386 Ca 0.61 -1.02 0.09 0.00 0.00 0.00 0.00 60.65 60.32 2gq3 s ILE 386 Cb -0.51 -1.81 -0.13 0.00 0.01 0.00 0.00 42.46 40.02 2gq3 s ILE 386 CO 0.53 0.58 0.02 -3.20 0.00 0.00 0.00 174.94 172.87 2gq3 n ASN 387 N 2.62 2.47 -3.89 3.58 5.15 0.30 -4.98 115.26 120.50 2gq3 n ASN 387 Ca -0.17 -0.01 -0.26 0.00 -0.60 0.00 0.00 54.58 53.54 2gq3 n ASN 387 Cb 0.52 0.68 -0.17 0.00 -0.53 0.00 0.00 39.78 40.27 2gq3 n ASN 387 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2gq3 s SER 388 N -4.37 2.11 0.55 1.20 0.15 -1.25 -4.66 113.70 107.43 2gq3 s SER 388 Ca -0.06 -0.28 0.24 0.00 0.70 0.00 0.00 55.95 56.55 2gq3 s SER 388 Cb 0.03 -0.80 1.48 0.00 -1.71 0.00 0.00 66.02 65.02 2gq3 s SER 388 CO 0.42 -0.13 2.09 0.03 1.20 0.00 0.00 173.24 176.85 2gq3 h ARG 389 N 8.18 0.00 -0.20 5.44 3.08 -1.93 -3.02 114.38 125.92 2gq3 h ARG 389 Ca -0.29 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.74 2gq3 h ARG 389 Cb 1.13 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.17 2gq3 h ARG 389 CO 0.39 0.00 -0.02 2.41 -1.07 0.00 0.00 179.97 181.68 2gq3 n THR 390 N -4.19 2.23 -1.83 2.04 -1.04 -1.26 -4.96 114.28 105.27 2gq3 n THR 390 Ca 0.03 -2.13 -0.19 0.00 -2.04 0.00 0.00 64.05 59.72 2gq3 n THR 390 Cb 0.34 -0.26 -0.06 0.00 -1.82 0.00 0.00 70.33 68.53 2gq3 n THR 390 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2gq3 n GLY 391 N -0.84 1.11 3.83 3.41 0.00 -1.14 -4.93 105.19 106.63 2gq3 n GLY 391 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 2gq3 n GLY 391 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gq3 s SER 392 N -2.46 6.87 -0.07 1.61 0.01 -1.26 -4.91 113.70 113.48 2gq3 s SER 392 Ca 0.00 1.47 0.03 0.00 1.31 0.00 0.00 55.95 58.76 2gq3 s SER 392 Cb 0.00 -2.45 -0.02 0.00 0.21 0.00 0.00 66.02 63.76 2gq3 s SER 392 CO 0.00 -0.26 -0.18 -0.63 0.41 0.00 0.00 173.24 172.58 2gq3 s ILE 393 N -2.04 2.71 -0.27 1.44 1.01 -0.01 -4.66 121.20 119.38 2gq3 s ILE 393 Ca 0.57 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 60.39 2gq3 s ILE 393 Cb -0.10 -2.06 0.05 0.00 0.01 0.00 0.00 42.46 40.35 2gq3 s ILE 393 CO 0.16 0.57 -0.07 -0.31 0.00 0.00 0.00 174.94 175.29 2gq3 s TYR 394 N -0.23 3.19 -0.18 3.97 1.51 -1.26 -0.21 117.35 124.13 2gq3 s TYR 394 Ca -0.00 -1.95 -0.01 0.00 -1.01 0.00 0.00 57.07 54.09 2gq3 s TYR 394 Cb -0.13 -2.02 0.00 0.00 -0.11 0.00 0.00 41.96 39.70 2gq3 s TYR 394 CO 0.03 -0.82 -0.12 0.42 -1.11 0.00 0.00 175.55 173.95 2gq3 s ILE 395 N 1.22 2.79 -0.09 2.71 1.01 0.27 -1.37 121.20 127.73 2gq3 s ILE 395 Ca -0.05 -0.71 -0.24 0.00 0.00 0.00 0.00 60.65 59.66 2gq3 s ILE 395 Cb -0.19 -2.22 -0.03 0.00 0.01 0.00 0.00 42.46 40.04 2gq3 s ILE 395 CO -0.04 0.49 0.73 -0.69 0.00 0.00 0.00 174.94 175.43 2gq3 s VAL 396 N 1.16 5.01 -0.28 2.92 1.01 0.71 -0.63 120.40 130.30 2gq3 s VAL 396 Ca 0.01 1.49 0.02 0.00 0.00 0.00 0.00 61.98 63.50 2gq3 s VAL 396 Cb -0.14 -4.06 0.06 0.00 0.00 0.00 0.00 36.38 32.24 2gq3 s VAL 396 CO -0.04 0.20 -0.07 -0.75 0.00 0.00 0.00 175.10 174.44 2gq3 s LYS 397 N 1.11 2.24 0.45 2.72 2.47 -0.36 -1.78 119.74 126.60 2gq3 s LYS 397 Ca 0.38 -1.37 0.00 0.00 -1.56 0.00 0.00 55.97 53.42 2gq3 s LYS 397 Cb -0.18 -2.99 -0.00 0.00 -1.46 0.00 0.00 37.83 33.20 2gq3 s LYS 397 CO 0.17 -0.61 0.68 -1.25 0.16 0.00 0.00 175.35 174.49 2gq3 s PRO 398 N 1.13 3.08 -1.90 4.03 0.04 -1.26 -3.10 135.00 137.01 2gq3 s PRO 398 Ca -0.07 -0.46 0.00 0.00 0.04 0.00 0.00 61.00 60.51 2gq3 s PRO 398 Cb -0.20 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.79 2gq3 s PRO 398 CO -0.04 -0.27 0.00 1.63 0.04 0.00 0.00 177.00 178.36 2gq3 n LYS 399 N -2.09 -1.35 -2.51 4.56 5.02 -1.26 -4.22 118.16 116.32 2gq3 n LYS 399 Ca 0.01 1.10 -0.37 0.00 -2.02 0.00 0.00 58.31 57.03 2gq3 n LYS 399 Cb 0.58 -5.45 -0.04 0.00 -0.02 0.00 0.00 35.03 30.09 2gq3 n LYS 399 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2gq3 s MET 400 N -3.90 4.25 -0.46 1.97 -1.94 -1.26 -4.78 119.30 113.19 2gq3 s MET 400 Ca 0.00 1.59 -0.01 0.00 -1.71 0.00 0.00 55.69 55.56 2gq3 s MET 400 Cb 0.00 -2.68 0.12 0.00 2.01 0.00 0.00 34.83 34.28 2gq3 s MET 400 CO 0.00 -0.08 0.24 -1.01 -0.01 0.00 0.00 175.02 174.16 2gq3 s HIS 401 N -1.54 3.54 0.04 -0.03 3.76 -1.26 -4.44 115.29 115.36 2gq3 s HIS 401 Ca 0.55 -2.65 0.00 0.00 -0.15 0.00 0.00 55.06 52.81 2gq3 s HIS 401 Cb -0.25 -3.14 0.00 0.00 1.11 0.00 0.00 32.58 30.31 2gq3 s HIS 401 CO 0.31 -0.92 0.00 0.41 -0.85 0.00 0.00 174.74 173.69 2gq3 n GLY 402 N 4.15 -1.57 0.16 -2.22 0.00 -1.18 -4.27 105.19 100.26 2gq3 n GLY 402 Ca 0.02 -1.48 0.03 0.00 0.00 0.00 0.00 46.02 44.59 2gq3 n GLY 402 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gq3 h PRO 403 N -0.15 0.00 -0.48 1.61 0.13 -1.84 -2.90 132.00 128.37 2gq3 h PRO 403 Ca -0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 2gq3 h PRO 403 Cb 0.15 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.26 2gq3 h PRO 403 CO 0.00 0.48 0.15 0.00 -0.23 0.00 0.00 178.00 178.41 2gq3 h ALA 404 N 1.52 1.37 0.00 -0.56 0.00 -1.95 -0.98 119.26 118.65 2gq3 h ALA 404 Ca -0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 2gq3 h ALA 404 Cb 1.17 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2gq3 h ALA 404 CO 0.06 0.46 -0.48 0.93 0.00 0.00 0.00 179.25 180.22 2gq3 h GLU 405 N 0.69 0.00 -0.04 0.00 5.08 -1.69 -1.80 114.58 116.82 2gq3 h GLU 405 Ca 0.16 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2gq3 h GLU 405 Cb 0.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 2gq3 h GLU 405 CO -0.01 0.48 -0.02 0.28 -1.00 0.00 0.00 179.01 178.75 2gq3 h VAL 406 N 0.00 1.33 -1.00 3.13 2.07 -1.36 -2.32 116.25 118.10 2gq3 h VAL 406 Ca -0.00 -1.01 0.23 0.00 0.82 0.00 0.00 66.70 66.74 2gq3 h VAL 406 Cb 0.96 1.92 -0.12 0.00 -1.52 0.00 0.00 31.29 32.53 2gq3 h VAL 406 CO 0.06 0.27 0.60 0.00 0.02 0.00 0.00 177.57 178.52 2gq3 h ALA 407 N 0.61 1.76 -0.13 1.67 0.00 -1.01 0.18 119.26 122.33 2gq3 h ALA 407 Ca 0.01 0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 2gq3 h ALA 407 Cb 0.45 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.23 2gq3 h ALA 407 CO 0.01 -0.21 -0.55 0.35 0.00 0.00 0.00 179.25 178.84 2gq3 h PHE 408 N 0.63 0.81 -0.80 0.00 3.57 -1.29 0.43 116.94 120.29 2gq3 h PHE 408 Ca 0.63 -0.35 0.06 0.00 3.53 0.00 0.00 57.97 61.85 2gq3 h PHE 408 Cb 1.14 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 39.69 2gq3 h PHE 408 CO -0.01 1.14 0.49 1.15 -2.23 0.00 0.00 178.31 178.85 2gq3 h THR 409 N 0.25 1.01 0.02 4.41 2.02 -0.70 0.78 112.91 120.70 2gq3 h THR 409 Ca -0.03 -0.30 -0.00 0.00 0.77 0.00 0.00 66.41 66.85 2gq3 h THR 409 Cb 1.19 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2gq3 h THR 409 CO 0.12 0.16 -0.01 0.00 0.37 0.00 0.00 175.52 176.16 2gq3 h GLU 411 N -0.20 0.26 0.16 0.00 4.57 -0.64 -2.27 114.58 116.46 2gq3 h GLU 411 Ca -0.00 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.15 2gq3 h GLU 411 Cb 0.19 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 2gq3 h GLU 411 CO 0.00 0.17 -0.08 1.25 -1.18 0.00 0.00 179.01 179.18 2gq3 h LEU 412 N 0.27 -0.18 -0.86 1.64 5.85 -0.37 -1.10 115.31 120.56 2gq3 h LEU 412 Ca 0.47 -0.04 0.21 0.00 0.84 0.00 0.00 57.88 59.35 2gq3 h LEU 412 Cb 0.84 0.05 -0.12 0.00 0.37 0.00 0.00 40.66 41.80 2gq3 h LEU 412 CO -0.56 -0.08 0.32 -0.26 -0.34 0.00 0.00 178.44 177.53 2gq3 h PHE 413 N -0.27 0.52 -0.41 1.25 -1.00 -1.34 0.64 116.94 116.32 2gq3 h PHE 413 Ca -0.02 0.04 -0.14 0.00 2.81 0.00 0.00 57.97 60.66 2gq3 h PHE 413 Cb 0.21 -0.09 -0.01 0.00 3.61 0.00 0.00 35.95 39.67 2gq3 h PHE 413 CO -0.05 -0.09 -0.28 1.03 -1.61 0.00 0.00 178.31 177.31 2gq3 h SER 414 N 0.34 0.96 -0.46 2.17 0.87 -1.01 -0.53 113.55 115.88 2gq3 h SER 414 Ca 0.53 -0.43 -0.05 0.00 -1.23 0.00 0.00 61.79 60.61 2gq3 h SER 414 Cb 1.00 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.67 2gq3 h SER 414 CO -0.55 1.19 0.11 0.03 -0.53 0.00 0.00 176.83 177.07 2gq3 h ARG 415 N 0.74 0.75 -0.02 2.24 2.47 -0.62 -2.63 114.38 117.32 2gq3 h ARG 415 Ca 0.08 -0.18 -0.07 0.00 -1.26 0.00 0.00 59.98 58.55 2gq3 h ARG 415 Cb 0.87 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 29.08 2gq3 h ARG 415 CO 0.08 0.74 -0.32 0.28 0.56 0.00 0.00 179.97 181.31 2gq3 h VAL 416 N 0.62 1.24 -0.34 2.04 2.07 -0.72 -2.70 116.25 118.46 2gq3 h VAL 416 Ca 0.14 -1.13 -0.11 0.00 0.82 0.00 0.00 66.70 66.43 2gq3 h VAL 416 Cb 0.33 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 2gq3 h VAL 416 CO 0.00 0.32 -0.22 -0.33 0.02 0.00 0.00 177.57 177.37 2gq3 h GLU 417 N 0.03 0.75 -0.27 1.57 5.08 -0.85 -0.61 114.58 120.27 2gq3 h GLU 417 Ca 0.00 -0.35 0.05 0.00 -1.00 0.00 0.00 59.36 58.06 2gq3 h GLU 417 Cb 0.58 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.78 2gq3 h GLU 417 CO 0.04 0.97 -0.03 -0.44 -1.00 0.00 0.00 179.01 178.56 2gq3 h ASP 418 N 0.53 -0.16 -0.73 1.42 3.45 -1.17 0.32 116.42 120.08 2gq3 h ASP 418 Ca 0.07 0.07 -0.02 0.00 0.43 0.00 0.00 57.03 57.57 2gq3 h ASP 418 Cb 0.78 0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 39.64 2gq3 h ASP 418 CO 0.06 -0.05 0.37 0.58 -1.57 0.00 0.00 179.24 178.63 2gq3 h VAL 419 N 0.05 1.23 0.00 -1.35 2.07 -1.29 0.05 116.25 117.01 2gq3 h VAL 419 Ca 0.13 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 67.01 2gq3 h VAL 419 Cb 0.18 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 2gq3 h VAL 419 CO -0.24 0.27 0.00 -0.07 0.02 0.00 0.00 177.57 177.55 2gq3 h LEU 420 N 1.06 0.00 -0.64 2.57 3.38 -0.76 -3.45 115.31 117.47 2gq3 h LEU 420 Ca 0.26 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.03 2gq3 h LEU 420 Cb 0.09 0.00 0.06 0.00 0.09 0.00 0.00 40.66 40.90 2gq3 h LEU 420 CO -0.04 0.00 -0.34 0.61 0.09 0.00 0.00 178.44 178.77 2gq3 n GLY 421 N 0.92 0.16 3.88 0.83 0.00 0.85 -4.84 105.19 107.00 2gq3 n GLY 421 Ca 0.04 -0.23 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 2gq3 n GLY 421 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gq3 s LEU 422 N -4.07 4.29 0.42 0.99 1.43 0.43 -5.03 118.68 117.14 2gq3 s LEU 422 Ca 0.26 0.31 -0.25 0.00 -1.03 0.00 0.00 54.13 53.42 2gq3 s LEU 422 Cb -0.12 -2.57 -0.10 0.00 0.03 0.00 0.00 46.19 43.44 2gq3 s LEU 422 CO 0.33 0.26 1.12 -2.65 0.23 0.00 0.00 176.35 175.64 2gq3 n PRO 423 N 0.96 1.58 -1.96 1.29 -0.02 -1.26 -4.54 135.00 131.04 2gq3 n PRO 423 Ca -0.11 0.57 -0.40 0.00 -2.02 0.00 0.00 63.50 61.54 2gq3 n PRO 423 Cb 0.53 -2.19 -0.00 0.00 -0.02 0.00 0.00 33.50 31.81 2gq3 n PRO 423 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2gq3 s GLN 424 N -2.12 3.96 0.00 -0.52 -1.52 -1.26 -2.43 119.66 115.77 2gq3 s GLN 424 Ca 0.63 2.29 0.00 0.00 -1.95 0.00 0.00 55.36 56.32 2gq3 s GLN 424 Cb -0.53 -2.79 0.00 0.00 -0.22 0.00 0.00 33.01 29.46 2gq3 s GLN 424 CO 0.57 -0.55 0.00 0.09 -0.25 0.00 0.00 175.29 175.15 2gq3 n ASN 425 N 0.16 -1.66 -0.27 5.90 3.02 -1.26 -4.91 115.26 116.25 2gq3 n ASN 425 Ca 0.03 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.69 2gq3 n ASN 425 Cb 0.42 -0.31 0.37 0.00 -0.61 0.00 0.00 39.78 39.65 2gq3 n ASN 425 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2gq3 h THR 426 N 0.00 0.86 -2.83 3.41 2.02 -1.83 -3.39 112.91 111.16 2gq3 h THR 426 Ca 0.00 -0.25 -0.60 0.00 0.77 0.00 0.00 66.41 66.33 2gq3 h THR 426 Cb 0.01 0.07 -0.12 0.00 -1.74 0.00 0.00 68.15 66.37 2gq3 h THR 426 CO 0.00 0.13 0.66 -0.04 0.37 0.00 0.00 175.52 176.64 2gq3 s MET 427 N -5.70 3.22 0.30 6.66 -1.94 -1.26 -0.83 119.30 119.75 2gq3 s MET 427 Ca -0.10 -0.47 -0.10 0.00 -1.71 0.00 0.00 55.69 53.30 2gq3 s MET 427 Cb 0.22 -4.15 -0.07 0.00 2.01 0.00 0.00 34.83 32.84 2gq3 s MET 427 CO 0.79 -1.75 0.64 0.15 -0.01 0.00 0.00 175.02 174.84 2gq3 s LYS 428 N 4.36 3.82 -0.16 2.03 -0.14 0.71 -4.90 119.74 125.45 2gq3 s LYS 428 Ca 0.28 0.37 0.01 0.00 -1.36 0.00 0.00 55.97 55.27 2gq3 s LYS 428 Cb -0.13 -2.54 0.02 0.00 -1.68 0.00 0.00 37.83 33.49 2gq3 s LYS 428 CO 0.15 0.19 -0.18 -1.50 -0.76 0.00 0.00 175.35 173.26 2gq3 s ILE 429 N -2.01 1.84 -0.32 2.17 2.07 -0.10 -0.56 121.20 124.28 2gq3 s ILE 429 Ca 0.49 -0.81 -0.20 0.00 -1.41 0.00 0.00 60.65 58.73 2gq3 s ILE 429 Cb -0.11 -1.68 -0.01 0.00 0.13 0.00 0.00 42.46 40.79 2gq3 s ILE 429 CO 0.24 0.50 0.60 -0.83 -1.91 0.00 0.00 174.94 173.54 2gq3 s GLY 430 N 1.32 1.78 -0.41 1.50 0.00 0.20 -0.92 107.32 110.79 2gq3 s GLY 430 Ca 0.04 -0.76 -0.19 0.00 0.00 0.00 0.00 44.72 43.80 2gq3 s GLY 430 CO -0.11 1.41 0.55 -0.42 0.00 0.00 0.00 173.10 174.53 2gq3 s ILE 431 N 2.57 4.95 0.06 0.90 1.01 -0.38 -1.22 121.20 129.09 2gq3 s ILE 431 Ca 0.23 0.05 -0.31 0.00 0.00 0.00 0.00 60.65 60.63 2gq3 s ILE 431 Cb -0.15 -4.09 -0.07 0.00 0.01 0.00 0.00 42.46 38.16 2gq3 s ILE 431 CO 0.13 -0.45 1.39 -0.04 0.00 0.00 0.00 174.94 175.97 2gq3 s MET 432 N 2.52 4.31 -0.72 2.79 -1.94 -1.18 -1.72 119.30 123.36 2gq3 s MET 432 Ca 0.19 2.01 -0.16 0.00 -1.71 0.00 0.00 55.69 56.01 2gq3 s MET 432 Cb -0.15 -3.40 0.16 0.00 2.01 0.00 0.00 34.83 33.44 2gq3 s MET 432 CO 0.16 -0.49 0.74 0.34 -0.01 0.00 0.00 175.02 175.77 2gq3 s ASP 433 N 1.46 6.47 0.00 3.03 3.68 0.17 -4.67 116.67 126.82 2gq3 s ASP 433 Ca 0.64 -2.08 0.00 0.00 2.13 0.00 0.00 52.55 53.24 2gq3 s ASP 433 Cb -0.34 -2.26 0.00 0.00 -1.45 0.00 0.00 42.92 38.87 2gq3 s ASP 433 CO 0.29 -0.84 0.36 -1.84 0.13 0.00 0.00 175.17 173.27 2gq3 n GLU 434 N 5.22 0.00 -4.66 4.34 0.28 -1.26 -2.17 120.64 122.38 2gq3 n GLU 434 Ca 0.03 -0.24 -0.23 0.00 -0.16 0.00 0.00 57.16 56.57 2gq3 n GLU 434 Cb 0.45 -0.17 -0.15 0.00 1.43 0.00 0.00 31.44 32.99 2gq3 n GLU 434 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2gq3 s GLU 435 N 0.00 1.19 0.44 3.44 0.41 -1.26 -2.09 118.70 120.83 2gq3 s GLU 435 Ca 0.00 -0.51 0.12 0.00 -0.41 0.00 0.00 54.97 54.16 2gq3 s GLU 435 Cb 0.00 -1.14 1.01 0.00 -1.78 0.00 0.00 34.13 32.22 2gq3 s GLU 435 CO 0.00 0.30 2.05 -0.09 -0.49 0.00 0.00 175.26 177.03 2gq3 h ARG 436 N 5.83 0.37 0.00 1.61 2.43 -1.89 -1.19 114.38 121.53 2gq3 h ARG 436 Ca -0.34 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 2gq3 h ARG 436 Cb 1.16 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2gq3 h ARG 436 CO 0.49 0.24 0.00 -0.09 -1.51 0.00 0.00 179.97 179.10 2gq3 h ARG 437 N 0.38 0.00 0.08 0.20 2.43 -1.93 -0.88 114.38 114.65 2gq3 h ARG 437 Ca 0.16 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 59.14 2gq3 h ARG 437 Cb 0.16 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.71 2gq3 h ARG 437 CO -0.04 0.00 -0.94 1.15 -1.51 0.00 0.00 179.97 178.64 2gq3 h THR 438 N 0.00 1.29 -0.66 0.20 2.02 -1.63 -3.13 112.91 111.00 2gq3 h THR 438 Ca 0.00 -2.38 0.09 0.00 0.77 0.00 0.00 66.41 64.89 2gq3 h THR 438 Cb 0.72 2.89 -0.07 0.00 -1.74 0.00 0.00 68.15 69.96 2gq3 h THR 438 CO 0.00 0.62 0.31 0.74 0.37 0.00 0.00 175.52 177.56 2gq3 h THR 439 N -0.59 0.84 -0.00 3.16 2.02 -0.82 0.62 112.91 118.14 2gq3 h THR 439 Ca -0.21 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.79 2gq3 h THR 439 Cb 1.49 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 68.15 2gq3 h THR 439 CO 0.02 0.10 -0.01 1.33 0.37 0.00 0.00 175.52 177.33 2gq3 n VAL 440 N -4.90 0.00 -2.02 3.16 0.24 -0.37 -3.12 118.33 111.31 2gq3 n VAL 440 Ca 0.10 -0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.44 2gq3 n VAL 440 Cb 0.26 -0.47 0.11 0.00 -1.47 0.00 0.00 33.84 32.27 2gq3 n VAL 440 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2gq3 n ASN 441 N -1.34 1.32 -0.06 -1.34 3.02 -0.47 -4.82 115.26 111.56 2gq3 n ASN 441 Ca 0.12 -2.87 -0.10 0.00 -0.03 0.00 0.00 54.58 51.69 2gq3 n ASN 441 Cb 0.28 -0.40 -0.04 0.00 -0.61 0.00 0.00 39.78 39.01 2gq3 n ASN 441 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2gq3 h LEU 442 N 0.91 0.30 -0.42 3.41 5.85 -0.87 -1.31 115.31 123.18 2gq3 h LEU 442 Ca -0.11 -0.15 0.09 0.00 0.84 0.00 0.00 57.88 58.55 2gq3 h LEU 442 Cb 1.45 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 42.31 2gq3 h LEU 442 CO 0.05 0.37 -0.23 0.50 -0.34 0.00 0.00 178.44 178.78 2gq3 h LYS 443 N 0.21 -0.15 -0.69 1.25 3.64 -1.88 0.25 116.57 119.21 2gq3 h LYS 443 Ca 0.07 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 2gq3 h LYS 443 Cb 0.16 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.97 2gq3 h LYS 443 CO -0.01 -0.10 0.45 0.00 -2.27 0.00 0.00 179.45 177.53 2gq3 h ALA 444 N 1.08 1.67 -0.06 5.00 0.00 -1.72 0.30 119.26 125.53 2gq3 h ALA 444 Ca 0.20 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2gq3 h ALA 444 Cb 0.46 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2gq3 h ALA 444 CO -0.51 0.24 -0.02 0.00 0.00 0.00 0.00 179.25 178.96 2gq3 h ILE 446 N -0.25 0.70 -0.54 0.00 2.04 -0.45 -2.08 117.51 116.93 2gq3 h ILE 446 Ca 0.01 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.96 2gq3 h ILE 446 Cb 0.44 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2gq3 h ILE 446 CO 0.01 0.00 0.36 0.50 0.00 0.00 0.00 178.15 179.02 2gq3 h LYS 447 N -0.06 0.35 0.00 2.37 3.64 -0.67 -1.44 116.57 120.76 2gq3 h LYS 447 Ca 0.11 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 2gq3 h LYS 447 Cb 0.23 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2gq3 h LYS 447 CO -0.25 0.23 -0.16 0.00 -2.27 0.00 0.00 179.45 177.00 2gq3 h ALA 448 N 1.72 1.13 -0.07 5.00 0.00 -0.45 -2.82 119.26 123.77 2gq3 h ALA 448 Ca 0.25 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2gq3 h ALA 448 Cb 0.49 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2gq3 h ALA 448 CO -0.06 0.20 -0.38 0.00 0.00 0.00 0.00 179.25 179.01 2gq3 n ALA 449 N -2.24 3.71 0.26 0.00 0.00 -0.59 -4.60 120.51 117.06 2gq3 n ALA 449 Ca -0.01 -3.23 0.14 0.00 0.00 0.00 0.00 53.44 50.34 2gq3 n ALA 449 Cb 0.33 -0.43 0.68 0.00 0.00 0.00 0.00 19.45 20.02 2gq3 n ALA 449 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gq3 h ALA 450 N 0.95 1.00 -0.01 0.00 0.00 -1.15 0.89 119.26 120.93 2gq3 h ALA 450 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2gq3 h ALA 450 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2gq3 h ALA 450 CO 0.08 0.00 -0.03 -0.40 0.00 0.00 0.00 179.25 178.90 2gq3 n ASP 451 N -2.46 1.79 0.00 0.00 5.75 -1.26 -0.53 116.55 119.83 2gq3 n ASP 451 Ca -0.01 -1.39 0.00 0.00 -0.01 0.00 0.00 54.79 53.38 2gq3 n ASP 451 Cb 0.11 0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 2gq3 n ASP 451 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2gq3 n ARG 452 N 0.48 1.92 -2.46 0.11 1.74 -0.58 -4.27 116.66 113.60 2gq3 n ARG 452 Ca 0.06 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.72 2gq3 n ARG 452 Cb 0.26 -0.83 -0.03 0.00 -1.02 0.00 0.00 32.46 30.84 2gq3 n ARG 452 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2gq3 s VAL 453 N -1.38 4.01 0.00 1.55 0.11 0.20 -0.93 120.40 123.96 2gq3 s VAL 453 Ca 0.00 1.53 0.00 0.00 -2.93 0.00 0.00 61.98 60.58 2gq3 s VAL 453 Cb 0.00 -3.98 0.00 0.00 -1.53 0.00 0.00 36.38 30.87 2gq3 s VAL 453 CO 0.00 0.17 0.16 1.33 -3.33 0.00 0.00 175.10 173.43 2gq3 n VAL 454 N 3.41 0.00 -3.49 2.04 0.24 -0.10 -4.78 118.33 115.65 2gq3 n VAL 454 Ca 0.07 -0.47 -0.11 0.00 -2.04 0.00 0.00 64.34 61.78 2gq3 n VAL 454 Cb 0.46 1.02 -0.02 0.00 -1.47 0.00 0.00 33.84 33.83 2gq3 n VAL 454 CO 0.00 0.00 0.00 0.72 -2.14 0.00 0.00 176.83 175.41 2gq3 s PHE 455 N -0.61 -0.48 0.18 6.34 -0.12 -1.23 -0.95 117.98 121.11 2gq3 s PHE 455 Ca 0.00 0.23 0.08 0.00 -0.05 0.00 0.00 56.93 57.19 2gq3 s PHE 455 Cb 0.00 0.58 -0.04 0.00 -0.63 0.00 0.00 43.02 42.92 2gq3 s PHE 455 CO 0.00 -0.91 -0.15 0.96 -0.05 0.00 0.00 175.22 175.07 2gq3 s ILE 456 N -3.78 1.71 -0.19 -4.49 -4.36 -0.97 -1.25 121.20 107.87 2gq3 s ILE 456 Ca 0.03 -2.07 -0.16 0.00 -0.26 0.00 0.00 60.65 58.18 2gq3 s ILE 456 Cb -0.02 -1.93 0.05 0.00 1.25 0.00 0.00 42.46 41.82 2gq3 s ILE 456 CO -0.10 -0.50 0.49 0.21 0.24 0.00 0.00 174.94 175.28 2gq3 s ASN 457 N -3.03 -0.53 -0.80 4.36 3.84 -0.70 -0.55 114.94 117.53 2gq3 s ASN 457 Ca 0.19 1.00 -0.20 0.00 0.21 0.00 0.00 52.86 54.07 2gq3 s ASN 457 Cb -0.03 0.99 0.12 0.00 -0.55 0.00 0.00 41.25 41.78 2gq3 s ASN 457 CO 0.06 -0.18 1.00 0.42 -2.79 0.00 0.00 177.10 175.62 2gq3 s THR 458 N 0.45 4.68 -1.22 -5.21 -4.23 -0.86 0.42 115.64 109.67 2gq3 s THR 458 Ca -0.02 -1.21 -0.20 0.00 -1.18 0.00 0.00 61.69 59.09 2gq3 s THR 458 Cb -0.04 -4.70 -0.02 0.00 1.34 0.00 0.00 72.50 69.08 2gq3 s THR 458 CO -0.02 -1.41 1.88 0.61 -0.54 0.00 0.00 174.62 175.14 2gq3 n GLY 459 N 5.34 2.10 0.33 3.99 0.00 -0.92 -3.72 105.19 112.31 2gq3 n GLY 459 Ca 0.11 -1.13 0.18 0.00 0.00 0.00 0.00 46.02 45.17 2gq3 n GLY 459 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2gq3 h PHE 460 N 8.34 0.00 0.03 1.61 -5.15 -1.91 -2.03 116.94 117.83 2gq3 h PHE 460 Ca 0.36 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 58.13 2gq3 h PHE 460 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.03 2gq3 h PHE 460 CO 1.32 0.00 -0.01 -0.07 -2.00 0.00 0.00 178.31 177.55 2gq3 h LEU 461 N 0.00 -0.03 -0.89 2.10 3.38 -1.93 -0.72 115.31 117.21 2gq3 h LEU 461 Ca 0.03 -0.40 0.18 0.00 0.09 0.00 0.00 57.88 57.78 2gq3 h LEU 461 Cb 0.27 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 40.92 2gq3 h LEU 461 CO -0.00 0.65 0.46 0.44 0.09 0.00 0.00 178.44 180.08 2gq3 h ASP 462 N -0.99 0.53 -0.28 -0.43 3.45 -1.78 -1.95 116.42 114.96 2gq3 h ASP 462 Ca -0.00 0.11 0.04 0.00 0.43 0.00 0.00 57.03 57.61 2gq3 h ASP 462 Cb 0.43 0.03 -0.04 0.00 -0.56 0.00 0.00 39.33 39.19 2gq3 h ASP 462 CO 0.01 0.17 0.05 -0.09 -1.57 0.00 0.00 179.24 177.81 2gq3 h ARG 463 N 0.59 0.15 -0.64 3.56 9.65 -0.80 0.31 114.38 127.20 2gq3 h ARG 463 Ca 0.51 -0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.44 2gq3 h ARG 463 Cb 0.82 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 29.31 2gq3 h ARG 463 CO -0.41 0.10 0.35 1.15 2.80 0.00 0.00 179.97 183.96 2gq3 h THR 464 N 0.15 0.97 -0.49 0.20 2.02 -0.72 -0.64 112.91 114.40 2gq3 h THR 464 Ca 0.13 -0.23 -0.04 0.00 0.77 0.00 0.00 66.41 67.04 2gq3 h THR 464 Cb 0.14 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 2gq3 h THR 464 CO -0.18 0.12 0.14 1.23 0.37 0.00 0.00 175.52 177.20 2gq3 h GLY 465 N 0.66 0.83 1.53 2.16 0.00 -0.52 -1.36 103.07 106.37 2gq3 h GLY 465 Ca 0.29 -0.51 0.02 0.00 0.00 0.00 0.00 47.33 47.13 2gq3 h GLY 465 CO -0.18 0.48 0.27 -1.80 0.00 0.00 0.00 176.54 175.31 2gq3 h ASP 466 N 0.67 0.41 -0.62 0.19 -0.00 -0.91 -0.98 116.42 115.18 2gq3 h ASP 466 Ca 0.16 -0.01 -0.09 0.00 -0.00 0.00 0.00 57.03 57.09 2gq3 h ASP 466 Cb 0.30 -0.10 -0.02 0.00 -0.00 0.00 0.00 39.33 39.51 2gq3 h ASP 466 CO -0.00 0.29 0.04 -0.08 -0.00 0.00 0.00 179.24 179.49 2gq3 h GLU 467 N 0.48 1.08 -0.03 0.28 4.57 -0.55 0.96 114.58 121.37 2gq3 h GLU 467 Ca 0.16 -0.32 -0.03 0.00 -1.18 0.00 0.00 59.36 58.00 2gq3 h GLU 467 Cb 0.05 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.53 2gq3 h GLU 467 CO -0.04 1.02 -0.08 0.82 -1.18 0.00 0.00 179.01 179.55 2gq3 h ILE 468 N 0.99 1.45 -0.29 2.32 2.04 -0.98 -3.11 117.51 119.93 2gq3 h ILE 468 Ca 0.18 -1.45 -0.01 0.00 1.00 0.00 0.00 64.86 64.59 2gq3 h ILE 468 Cb 0.51 2.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.91 2gq3 h ILE 468 CO 0.02 0.39 0.15 -0.74 0.00 0.00 0.00 178.15 177.98 2gq3 h HIS 469 N -0.43 0.40 -1.00 1.37 2.76 -1.13 -1.26 115.15 115.85 2gq3 h HIS 469 Ca -0.00 -0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.23 2gq3 h HIS 469 Cb 0.68 -0.13 -0.07 0.00 1.55 0.00 0.00 27.41 29.44 2gq3 h HIS 469 CO 0.13 0.34 0.65 1.15 -1.30 0.00 0.00 177.93 178.89 2gq3 h THR 470 N 0.34 1.06 -0.31 6.26 2.02 -0.85 -2.32 112.91 119.11 2gq3 h THR 470 Ca 0.10 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.89 2gq3 h THR 470 Cb 0.08 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.30 2gq3 h THR 470 CO -0.02 0.21 0.00 -1.20 0.37 0.00 0.00 175.52 174.88 2gq3 n SER 471 N -4.52 3.92 -0.20 4.18 7.64 -1.16 -4.70 113.62 118.78 2gq3 n SER 471 Ca 0.16 -2.83 0.05 0.00 1.01 0.00 0.00 58.87 57.26 2gq3 n SER 471 Cb 0.21 -0.51 0.11 0.00 -1.01 0.00 0.00 64.21 63.01 2gq3 n SER 471 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 2gq3 n MET 472 N -0.20 -0.05 0.00 1.43 1.56 -0.49 -0.90 117.12 118.47 2gq3 n MET 472 Ca 0.20 0.85 0.13 0.00 -0.27 0.00 0.00 57.70 58.62 2gq3 n MET 472 Cb 0.85 -1.30 0.42 0.00 2.15 0.00 0.00 33.22 35.33 2gq3 n MET 472 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 2gq3 n GLU 473 N -4.83 0.48 0.27 2.12 -0.58 -1.26 -3.99 120.64 112.84 2gq3 n GLU 473 Ca 0.10 -0.24 0.14 0.00 -0.42 0.00 0.00 57.16 56.75 2gq3 n GLU 473 Cb 0.33 -1.50 0.72 0.00 -0.57 0.00 0.00 31.44 30.43 2gq3 n GLU 473 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2gq3 h ALA 474 N 3.40 1.15 0.00 0.62 0.00 -1.35 -3.40 119.26 119.69 2gq3 h ALA 474 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2gq3 h ALA 474 Cb 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2gq3 h ALA 474 CO 0.00 0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.79 2gq3 n GLY 475 N -0.44 1.09 3.73 0.00 0.00 -1.26 -4.55 105.19 103.76 2gq3 n GLY 475 Ca -0.01 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.61 2gq3 n GLY 475 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gq3 s PRO 476 N -1.04 4.53 0.72 1.61 0.04 -1.26 -4.85 135.00 134.75 2gq3 s PRO 476 Ca 0.00 1.76 -0.11 0.00 0.04 0.00 0.00 61.00 62.69 2gq3 s PRO 476 Cb 0.00 -3.29 0.02 0.00 0.04 0.00 0.00 34.50 31.27 2gq3 s PRO 476 CO 0.00 -0.05 1.09 -1.64 0.04 0.00 0.00 177.00 176.44 2gq3 s MET 477 N 0.06 2.77 0.76 4.56 -1.94 -1.26 -0.74 119.30 123.50 2gq3 s MET 477 Ca 0.53 0.54 -0.15 0.00 -1.71 0.00 0.00 55.69 54.90 2gq3 s MET 477 Cb -0.30 -2.00 0.04 0.00 2.01 0.00 0.00 34.83 34.57 2gq3 s MET 477 CO 0.34 -1.12 1.10 1.33 -0.01 0.00 0.00 175.02 176.66 2gq3 n VAL 478 N -3.08 2.69 -0.88 -6.03 0.24 -0.65 -4.29 118.33 106.33 2gq3 n VAL 478 Ca 0.07 -0.31 -0.33 0.00 -2.04 0.00 0.00 64.34 61.73 2gq3 n VAL 478 Cb 0.57 -1.18 0.12 0.00 -1.47 0.00 0.00 33.84 31.88 2gq3 n VAL 478 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2gq3 n ARG 479 N -2.49 -0.18 0.13 7.34 1.74 -1.26 -4.87 116.66 117.07 2gq3 n ARG 479 Ca 0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 2gq3 n ARG 479 Cb 0.50 -2.05 0.05 0.00 -1.02 0.00 0.00 32.46 29.94 2gq3 n ARG 479 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 2gq3 h LYS 480 N -1.38 0.00 0.00 5.56 2.10 -1.98 -2.05 116.57 118.82 2gq3 h LYS 480 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 2gq3 h LYS 480 Cb 1.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 2gq3 h LYS 480 CO 0.38 0.62 0.00 0.41 -2.00 0.00 0.00 179.45 178.87 2gq3 n GLY 481 N 1.04 -1.34 0.02 0.07 0.00 -1.26 -3.20 105.19 100.53 2gq3 n GLY 481 Ca 0.01 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.08 2gq3 n GLY 481 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2gq3 n THR 482 N -1.63 0.09 0.20 2.61 -1.04 -0.78 -4.19 114.28 109.54 2gq3 n THR 482 Ca 0.05 -0.20 0.10 0.00 -2.04 0.00 0.00 64.05 61.96 2gq3 n THR 482 Cb 0.28 0.38 0.64 0.00 -1.82 0.00 0.00 70.33 69.81 2gq3 n THR 482 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 2gq3 h MET 483 N 0.00 0.03 -0.16 -2.82 2.86 -1.50 -2.91 114.93 110.43 2gq3 h MET 483 Ca 0.00 -0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.68 2gq3 h MET 483 Cb 0.70 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 2gq3 h MET 483 CO 0.00 0.02 0.15 1.57 1.06 0.00 0.00 176.91 179.71 2gq3 h LYS 484 N 0.03 0.00 -0.63 1.72 2.10 -1.80 -1.16 116.57 116.83 2gq3 h LYS 484 Ca 0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.70 2gq3 h LYS 484 Cb 0.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.49 2gq3 h LYS 484 CO -0.00 0.00 0.00 -1.13 -2.00 0.00 0.00 179.45 176.32 2gq3 n SER 485 N -4.01 4.14 -4.81 7.07 3.41 -1.10 -4.77 113.62 113.57 2gq3 n SER 485 Ca 0.01 -2.22 -0.35 0.00 -0.26 0.00 0.00 58.87 56.05 2gq3 n SER 485 Cb 0.27 -0.49 -0.07 0.00 -0.26 0.00 0.00 64.21 63.66 2gq3 n SER 485 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2gq3 s GLN 486 N -1.40 4.35 0.42 4.33 -1.52 -0.44 -4.96 119.66 120.44 2gq3 s GLN 486 Ca 0.46 1.11 0.14 0.00 -1.95 0.00 0.00 55.36 55.13 2gq3 s GLN 486 Cb 0.27 -2.56 1.01 0.00 -0.22 0.00 0.00 33.01 31.51 2gq3 s GLN 486 CO 0.27 0.18 1.92 -1.35 -0.25 0.00 0.00 175.29 176.06 2gq3 h PRO 487 N 2.68 0.44 -0.35 2.91 0.11 -1.89 -2.85 132.00 133.04 2gq3 h PRO 487 Ca -0.48 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 2gq3 h PRO 487 Cb 1.19 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2gq3 h PRO 487 CO 0.64 0.29 -0.05 0.11 -0.21 0.00 0.00 178.00 178.78 2gq3 h TRP 488 N 0.46 0.61 0.03 0.65 5.08 -1.71 -1.45 115.95 119.61 2gq3 h TRP 488 Ca 0.37 -0.08 -0.23 0.00 1.08 0.00 0.00 58.89 60.02 2gq3 h TRP 488 Cb 0.79 -0.17 -0.03 0.00 -3.00 0.00 0.00 29.16 26.75 2gq3 h TRP 488 CO -0.00 0.62 -1.14 0.97 -1.28 0.00 0.00 178.44 177.62 2gq3 h ILE 489 N 0.54 1.57 -0.06 0.12 2.10 -1.81 -0.29 117.51 119.67 2gq3 h ILE 489 Ca 0.11 -3.27 -0.02 0.00 1.08 0.00 0.00 64.86 62.76 2gq3 h ILE 489 Cb 0.43 2.82 -0.00 0.00 -1.09 0.00 0.00 36.82 38.98 2gq3 h ILE 489 CO 0.02 0.91 -0.03 -0.07 -1.08 0.00 0.00 178.15 177.90 2gq3 h LEU 490 N 0.02 0.14 0.51 2.19 3.38 -1.46 -1.79 115.31 118.29 2gq3 h LEU 490 Ca -0.07 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.47 2gq3 h LEU 490 Cb 1.84 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.54 2gq3 h LEU 490 CO 0.14 0.53 -0.34 0.00 0.09 0.00 0.00 178.44 178.86 2gq3 h ALA 491 N 0.62 -0.83 -0.82 1.53 0.00 -1.31 -2.59 119.26 115.86 2gq3 h ALA 491 Ca 0.01 -0.16 0.12 0.00 0.00 0.00 0.00 54.91 54.89 2gq3 h ALA 491 Cb 0.47 0.43 -0.14 0.00 0.00 0.00 0.00 17.79 18.55 2gq3 h ALA 491 CO 0.01 -0.99 -0.40 -0.92 0.00 0.00 0.00 179.25 176.95 2gq3 h TYR 492 N -0.82 -1.16 -0.31 0.00 3.20 -1.03 0.27 116.97 117.12 2gq3 h TYR 492 Ca -0.06 0.10 0.03 0.00 3.14 0.00 0.00 58.73 61.94 2gq3 h TYR 492 Cb 0.68 0.63 -0.03 0.00 1.54 0.00 0.00 36.73 39.54 2gq3 h TYR 492 CO -0.11 -0.40 0.12 0.93 -1.64 0.00 0.00 178.16 177.05 2gq3 h GLU 493 N -0.08 0.25 -0.50 1.82 4.39 -1.24 -2.29 114.58 116.94 2gq3 h GLU 493 Ca 0.27 -0.02 -0.11 0.00 0.34 0.00 0.00 59.36 59.84 2gq3 h GLU 493 Cb 0.56 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.14 2gq3 h GLU 493 CO -0.85 0.17 -0.13 -0.44 -1.16 0.00 0.00 179.01 176.59 2gq3 h ASP 494 N 0.26 0.95 -0.02 1.42 3.32 -1.08 -2.98 116.42 118.30 2gq3 h ASP 494 Ca 0.14 -0.32 -0.05 0.00 0.02 0.00 0.00 57.03 56.82 2gq3 h ASP 494 Cb 0.10 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 2gq3 h ASP 494 CO -0.13 1.08 -0.12 -0.74 -1.72 0.00 0.00 179.24 177.60 2gq3 h HIS 495 N 0.84 0.31 -0.27 4.55 2.76 -0.40 -0.60 115.15 122.34 2gq3 h HIS 495 Ca 0.13 -0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.21 2gq3 h HIS 495 Cb 0.68 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.54 2gq3 h HIS 495 CO 0.04 0.42 -0.05 -0.97 -1.30 0.00 0.00 177.93 176.08 2gq3 h ASN 496 N 0.28 0.52 0.06 3.26 -0.73 -1.31 -0.99 115.58 116.68 2gq3 h ASN 496 Ca 0.06 -0.35 -0.00 0.00 1.87 0.00 0.00 56.30 57.87 2gq3 h ASN 496 Cb 0.40 -0.14 0.00 0.00 0.27 0.00 0.00 38.32 38.85 2gq3 h ASN 496 CO 0.02 0.75 -0.03 0.58 -0.37 0.00 0.00 177.43 178.38 2gq3 h VAL 497 N 0.28 1.03 -0.61 2.57 2.07 -1.34 -1.58 116.25 118.66 2gq3 h VAL 497 Ca 0.07 -0.30 0.10 0.00 0.82 0.00 0.00 66.70 67.39 2gq3 h VAL 497 Cb 0.51 1.22 -0.07 0.00 -1.52 0.00 0.00 31.29 31.43 2gq3 h VAL 497 CO 0.02 0.07 0.22 0.44 0.02 0.00 0.00 177.57 178.35 2gq3 h ASP 498 N -0.22 0.21 -0.48 0.57 3.32 -1.07 0.10 116.42 118.85 2gq3 h ASP 498 Ca -0.01 0.08 -0.04 0.00 0.02 0.00 0.00 57.03 57.08 2gq3 h ASP 498 Cb 0.19 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 2gq3 h ASP 498 CO 0.01 0.13 0.14 0.00 -1.72 0.00 0.00 179.24 177.80 2gq3 h ALA 499 N 1.42 0.63 -0.28 3.45 0.00 -0.96 0.11 119.26 123.64 2gq3 h ALA 499 Ca 0.31 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2gq3 h ALA 499 Cb 0.39 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2gq3 h ALA 499 CO -0.31 0.31 0.16 0.78 0.00 0.00 0.00 179.25 180.18 2gq3 h GLY 500 N 0.65 0.40 1.05 0.00 0.00 -0.94 -0.87 103.07 103.36 2gq3 h GLY 500 Ca 0.15 -0.17 -0.10 0.00 0.00 0.00 0.00 47.33 47.21 2gq3 h GLY 500 CO -0.00 0.17 -0.10 1.41 0.00 0.00 0.00 176.54 178.01 2gq3 h LEU 501 N 0.34 0.93 -1.65 3.11 3.38 -0.79 -1.83 115.31 118.81 2gq3 h LEU 501 Ca 0.10 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 2gq3 h LEU 501 Cb 0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2gq3 h LEU 501 CO -0.02 1.07 -0.14 0.00 0.09 0.00 0.00 178.44 179.44 2gq3 h ALA 502 N 0.89 1.71 0.00 1.53 0.00 -0.70 0.81 119.26 123.51 2gq3 h ALA 502 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2gq3 h ALA 502 Cb 0.66 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2gq3 h ALA 502 CO 0.05 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.51 2gq3 n ALA 503 N -2.51 2.52 -2.28 0.00 0.00 -0.34 -4.73 120.51 113.18 2gq3 n ALA 503 Ca -0.02 -0.09 -0.04 0.00 0.00 0.00 0.00 53.44 53.29 2gq3 n ALA 503 Cb 0.22 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.45 2gq3 n ALA 503 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gq3 n GLY 504 N 0.65 0.38 0.27 0.00 0.00 0.28 -1.25 105.19 105.51 2gq3 n GLY 504 Ca 0.10 -0.66 -0.04 0.00 0.00 0.00 0.00 46.02 45.42 2gq3 n GLY 504 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2gq3 h PHE 505 N -0.16 0.72 -2.46 1.61 -1.00 -1.48 -3.40 116.94 110.77 2gq3 h PHE 505 Ca -0.09 -0.12 -0.56 0.00 2.81 0.00 0.00 57.97 60.01 2gq3 h PHE 505 Cb 1.06 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 40.43 2gq3 h PHE 505 CO 0.09 0.75 1.24 0.45 -1.61 0.00 0.00 178.31 179.23 2gq3 s SER 506 N -6.72 6.21 0.00 2.17 0.15 -1.26 0.13 113.70 114.37 2gq3 s SER 506 Ca -0.08 2.03 0.00 0.00 0.70 0.00 0.00 55.95 58.59 2gq3 s SER 506 Cb 0.14 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.93 2gq3 s SER 506 CO 0.80 -1.34 0.00 0.61 1.20 0.00 0.00 173.24 174.52 2gq3 n GLY 507 N 4.84 0.75 0.00 9.45 0.00 -1.24 -4.87 105.19 114.12 2gq3 n GLY 507 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2gq3 n GLY 507 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gq3 n ARG 508 N -2.20 1.42 -3.54 1.61 1.74 0.34 -4.75 116.66 111.28 2gq3 n ARG 508 Ca 0.00 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.91 2gq3 n ARG 508 Cb 0.00 -0.55 -0.06 0.00 -1.02 0.00 0.00 32.46 30.83 2gq3 n ARG 508 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gq3 s ALA 509 N -0.91 -1.74 0.41 7.54 0.00 0.20 -4.49 121.76 122.76 2gq3 s ALA 509 Ca 0.00 1.39 -0.25 0.00 0.00 0.00 0.00 51.96 53.10 2gq3 s ALA 509 Cb 0.00 -0.16 -0.08 0.00 0.00 0.00 0.00 23.12 22.88 2gq3 s ALA 509 CO 0.00 -0.36 1.14 -0.65 0.00 0.00 0.00 175.76 175.89 2gq3 s GLN 510 N -0.98 4.04 -0.38 0.00 -0.21 -0.12 -4.49 119.66 117.53 2gq3 s GLN 510 Ca -0.10 1.75 -0.02 0.00 0.02 0.00 0.00 55.36 57.01 2gq3 s GLN 510 Cb -0.01 -2.61 0.09 0.00 1.00 0.00 0.00 33.01 31.49 2gq3 s GLN 510 CO 0.09 -0.30 0.14 0.08 -2.12 0.00 0.00 175.29 173.17 2gq3 s VAL 511 N -1.49 3.11 0.11 1.09 1.01 -1.26 -2.29 120.40 120.69 2gq3 s VAL 511 Ca 0.58 -1.93 0.03 0.00 0.00 0.00 0.00 61.98 60.65 2gq3 s VAL 511 Cb -0.28 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 2gq3 s VAL 511 CO 0.35 -0.55 0.17 -0.83 0.00 0.00 0.00 175.10 174.24 2gq3 s GLY 512 N 1.59 1.92 0.32 4.51 0.00 0.29 -0.70 107.32 115.24 2gq3 s GLY 512 Ca 0.06 -1.02 0.01 0.00 0.00 0.00 0.00 44.72 43.76 2gq3 s GLY 512 CO -0.04 -1.02 0.03 0.28 0.00 0.00 0.00 173.10 172.35 2gq3 n LYS 513 N 0.01 1.05 -1.01 2.90 5.02 -0.44 -2.03 118.16 123.67 2gq3 n LYS 513 Ca -0.07 -2.42 -0.02 0.00 -2.02 0.00 0.00 58.31 53.77 2gq3 n LYS 513 Cb 0.53 0.82 0.01 0.00 -0.02 0.00 0.00 35.03 36.37 2gq3 n LYS 513 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gq3 n GLY 514 N 0.77 1.31 3.75 0.72 0.00 -1.24 -2.67 105.19 107.82 2gq3 n GLY 514 Ca -0.11 -2.05 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 2gq3 n GLY 514 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2gq3 s MET 515 N -2.49 4.59 -0.18 1.61 1.75 -1.26 -3.02 119.30 120.29 2gq3 s MET 515 Ca 0.07 1.82 -0.25 0.00 -1.25 0.00 0.00 55.69 56.09 2gq3 s MET 515 Cb -0.00 -3.21 -0.02 0.00 2.84 0.00 0.00 34.83 34.44 2gq3 s MET 515 CO 0.05 0.11 0.81 -0.46 -0.65 0.00 0.00 175.02 174.87 2gq3 s TRP 516 N -0.76 3.41 -0.16 4.11 -0.11 -1.18 -4.97 118.94 119.27 2gq3 s TRP 516 Ca 0.47 1.21 0.10 0.00 1.22 0.00 0.00 56.10 59.09 2gq3 s TRP 516 Cb -0.32 -2.99 -0.13 0.00 -1.50 0.00 0.00 33.47 28.53 2gq3 s TRP 516 CO 0.40 -0.24 0.28 0.25 -4.62 0.00 0.00 176.95 173.01 2gq3 n THR 517 N 4.77 0.00 -2.82 5.86 -2.24 -1.26 -4.30 114.28 114.29 2gq3 n THR 517 Ca 0.04 -0.24 -0.43 0.00 -2.27 0.00 0.00 64.05 61.14 2gq3 n THR 517 Cb 0.49 0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 69.23 2gq3 n THR 517 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gq3 s MET 518 N -2.39 3.74 0.65 -0.78 0.00 -1.26 -0.04 119.30 119.20 2gq3 s MET 518 Ca -0.01 -1.82 0.37 0.00 0.00 0.00 0.00 55.69 54.23 2gq3 s MET 518 Cb 0.06 -5.10 2.06 0.00 0.00 0.00 0.00 34.83 31.86 2gq3 s MET 518 CO 0.39 -1.91 2.22 1.79 0.00 0.00 0.00 175.02 177.52 2gq3 h THR 519 N 5.77 0.15 0.00 3.16 1.35 -1.84 -1.62 112.91 119.87 2gq3 h THR 519 Ca 0.23 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.09 2gq3 h THR 519 Cb 0.98 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 2gq3 h THR 519 CO 1.24 0.00 -1.19 -0.62 -0.25 0.00 0.00 175.52 174.70 2gq3 n GLU 520 N -3.26 0.89 -2.60 4.72 -0.58 -1.26 -4.55 120.64 113.99 2gq3 n GLU 520 Ca -0.02 -0.06 -0.42 0.00 -0.42 0.00 0.00 57.16 56.25 2gq3 n GLU 520 Cb 0.18 -1.38 0.01 0.00 -0.57 0.00 0.00 31.44 29.68 2gq3 n GLU 520 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2gq3 n LEU 521 N -1.67 7.11 -0.10 -4.62 4.77 -0.61 -4.65 117.00 117.23 2gq3 n LEU 521 Ca 0.01 -5.16 -0.14 0.00 -0.03 0.00 0.00 56.01 50.69 2gq3 n LEU 521 Cb 0.35 -1.27 -0.03 0.00 -2.33 0.00 0.00 43.42 40.13 2gq3 n LEU 521 CO 0.37 1.86 0.50 0.24 -1.33 0.00 0.00 177.39 179.03 2gq3 h MET 522 N 4.84 0.88 -0.97 3.23 2.86 -1.80 -0.42 114.93 123.56 2gq3 h MET 522 Ca 0.44 -0.51 0.22 0.00 -2.06 0.00 0.00 59.70 57.80 2gq3 h MET 522 Cb 0.45 0.04 -0.12 0.00 0.06 0.00 0.00 31.60 32.02 2gq3 h MET 522 CO 1.34 1.15 0.54 0.00 1.06 0.00 0.00 176.91 181.00 2gq3 h ALA 523 N 0.72 1.65 0.04 6.32 0.00 -1.83 -0.17 119.26 126.00 2gq3 h ALA 523 Ca 0.04 0.12 -0.28 0.00 0.00 0.00 0.00 54.91 54.79 2gq3 h ALA 523 Cb 1.04 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.88 2gq3 h ALA 523 CO 0.10 -0.23 -1.11 -0.44 0.00 0.00 0.00 179.25 177.57 2gq3 h ASP 524 N 0.58 0.90 0.35 0.00 3.32 -1.80 -2.87 116.42 116.90 2gq3 h ASP 524 Ca 0.60 -0.77 -0.01 0.00 0.02 0.00 0.00 57.03 56.87 2gq3 h ASP 524 Cb 1.09 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 40.36 2gq3 h ASP 524 CO -0.46 1.56 -0.20 -0.03 -1.72 0.00 0.00 179.24 178.39 2gq3 h MET 525 N 0.35 -0.49 -0.79 3.56 4.05 -0.21 0.11 114.93 121.50 2gq3 h MET 525 Ca -0.15 0.03 0.18 0.00 -0.28 0.00 0.00 59.70 59.49 2gq3 h MET 525 Cb 1.77 0.11 -0.12 0.00 -0.80 0.00 0.00 31.60 32.56 2gq3 h MET 525 CO 0.22 -0.33 0.21 0.28 0.23 0.00 0.00 176.91 177.52 2gq3 h VAL 526 N -0.51 0.46 -0.04 -5.77 2.07 -1.17 0.46 116.25 111.75 2gq3 h VAL 526 Ca -0.04 -0.09 -0.18 0.00 0.82 0.00 0.00 66.70 67.20 2gq3 h VAL 526 Cb 0.41 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 2gq3 h VAL 526 CO 0.05 0.05 -0.77 -0.08 0.02 0.00 0.00 177.57 176.84 2gq3 h GLU 527 N 0.27 0.29 0.00 1.57 4.81 -1.34 -3.40 114.58 116.78 2gq3 h GLU 527 Ca 0.46 -0.26 -0.33 0.00 -0.13 0.00 0.00 59.36 59.10 2gq3 h GLU 527 Cb 0.83 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 30.21 2gq3 h GLU 527 CO -0.55 0.92 -2.27 0.25 -0.73 0.00 0.00 179.01 176.64 2gq3 n THR 528 N -3.77 1.27 0.66 0.32 -2.24 0.36 -4.51 114.28 106.37 2gq3 n THR 528 Ca -0.04 -0.62 0.11 0.00 -2.27 0.00 0.00 64.05 61.23 2gq3 n THR 528 Cb 0.73 -0.95 0.45 0.00 -2.10 0.00 0.00 70.33 68.46 2gq3 n THR 528 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2gq3 n LYS 529 N -2.93 0.06 -0.16 -0.78 4.81 0.15 -2.00 118.16 117.31 2gq3 n LYS 529 Ca -0.35 0.19 0.29 0.00 -0.87 0.00 0.00 58.31 57.57 2gq3 n LYS 529 Cb 1.00 -1.59 0.67 0.00 0.02 0.00 0.00 35.03 35.12 2gq3 n LYS 529 CO 0.00 0.00 0.00 0.97 1.17 0.00 0.00 177.40 179.54 2gq3 h ILE 530 N 0.00 0.25 -0.66 3.15 2.10 -1.78 -2.61 117.51 117.96 2gq3 h ILE 530 Ca 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.93 2gq3 h ILE 530 Cb 0.41 0.36 -0.03 0.00 -1.09 0.00 0.00 36.82 36.46 2gq3 h ILE 530 CO 0.00 0.00 0.37 0.00 -1.08 0.00 0.00 178.15 177.44 2gq3 h ALA 531 N 1.17 1.41 0.64 0.18 0.00 -1.73 -1.63 119.26 119.29 2gq3 h ALA 531 Ca 0.43 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 2gq3 h ALA 531 Cb 2.11 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.63 2gq3 h ALA 531 CO -0.00 0.49 -0.36 1.96 0.00 0.00 0.00 179.25 181.34 2gq3 h GLN 532 N 0.91 -0.89 -0.84 0.00 4.20 -1.73 0.35 115.11 117.12 2gq3 h GLN 532 Ca 0.23 0.06 0.15 0.00 0.06 0.00 0.00 58.65 59.16 2gq3 h GLN 532 Cb 0.01 0.20 -0.06 0.00 0.30 0.00 0.00 27.48 27.93 2gq3 h GLN 532 CO -0.04 -0.59 0.55 -1.00 -0.67 0.00 0.00 178.83 177.08 2gq3 h PRO 533 N -0.92 0.53 0.00 1.46 0.13 -1.71 -0.03 132.00 131.46 2gq3 h PRO 533 Ca -0.09 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.00 2gq3 h PRO 533 Cb 0.73 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 31.73 2gq3 h PRO 533 CO 0.11 0.35 -0.06 0.00 -0.23 0.00 0.00 178.00 178.17 2gq3 h ARG 534 N 0.55 0.00 -0.30 0.86 3.08 -0.88 -1.27 114.38 116.42 2gq3 h ARG 534 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.47 2gq3 h ARG 534 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.88 2gq3 h ARG 534 CO -0.17 0.06 0.00 0.00 -1.07 0.00 0.00 179.97 178.79 2gq3 n ALA 535 N -2.17 2.45 -1.05 0.04 0.00 0.12 -4.90 120.51 115.00 2gq3 n ALA 535 Ca -0.01 -0.53 -0.02 0.00 0.00 0.00 0.00 53.44 52.88 2gq3 n ALA 535 Cb 0.23 -0.98 -0.01 0.00 0.00 0.00 0.00 19.45 18.69 2gq3 n ALA 535 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gq3 n GLY 536 N 0.99 0.54 3.71 0.00 0.00 -0.48 -4.99 105.19 104.96 2gq3 n GLY 536 Ca 0.11 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 2gq3 n GLY 536 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gq3 s ALA 537 N -2.00 3.60 -1.54 4.61 0.00 -1.03 -4.79 121.76 120.60 2gq3 s ALA 537 Ca 0.00 1.09 0.30 0.00 0.00 0.00 0.00 51.96 53.35 2gq3 s ALA 537 Cb 0.00 -3.56 1.57 0.00 0.00 0.00 0.00 23.12 21.13 2gq3 s ALA 537 CO 0.00 -0.70 2.07 -1.13 0.00 0.00 0.00 175.76 176.00 2gq3 n SER 538 N 4.32 0.04 -3.53 0.00 3.41 0.12 -4.33 113.62 113.64 2gq3 n SER 538 Ca 0.12 -0.32 -0.14 0.00 -0.26 0.00 0.00 58.87 58.27 2gq3 n SER 538 Cb 0.42 -0.22 -0.05 0.00 -0.26 0.00 0.00 64.21 64.11 2gq3 n SER 538 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2gq3 s THR 539 N -2.47 0.02 0.13 6.66 -1.32 -1.17 -1.67 115.64 115.82 2gq3 s THR 539 Ca 0.32 -0.16 -0.11 0.00 -1.21 0.00 0.00 61.69 60.53 2gq3 s THR 539 Cb 0.21 -0.99 0.01 0.00 -1.51 0.00 0.00 72.50 70.21 2gq3 s THR 539 CO 0.45 -0.09 0.29 0.00 -2.21 0.00 0.00 174.62 173.06 2gq3 s ALA 540 N -2.54 -0.36 0.02 11.08 0.00 -1.26 -1.32 121.76 127.39 2gq3 s ALA 540 Ca -0.05 -0.55 -0.21 0.00 0.00 0.00 0.00 51.96 51.15 2gq3 s ALA 540 Cb -0.01 0.67 -0.06 0.00 0.00 0.00 0.00 23.12 23.72 2gq3 s ALA 540 CO -0.02 -0.60 0.63 -1.58 0.00 0.00 0.00 175.76 174.18 2gq3 s TRP 541 N -3.88 3.72 0.05 0.00 0.52 -1.09 -2.03 118.94 116.22 2gq3 s TRP 541 Ca 0.08 1.27 0.06 0.00 0.02 0.00 0.00 56.10 57.54 2gq3 s TRP 541 Cb 0.03 -2.63 -0.02 0.00 -1.15 0.00 0.00 33.47 29.70 2gq3 s TRP 541 CO -0.07 0.38 -0.17 0.14 0.02 0.00 0.00 176.95 177.25 2gq3 s VAL 542 N -0.35 1.37 -0.84 4.03 -7.23 -0.88 -3.10 120.40 113.39 2gq3 s VAL 542 Ca 0.32 -1.12 0.25 0.00 -1.81 0.00 0.00 61.98 59.62 2gq3 s VAL 542 Cb -0.19 -1.22 0.03 0.00 0.56 0.00 0.00 36.38 35.56 2gq3 s VAL 542 CO 0.19 0.08 1.38 -0.81 -0.31 0.00 0.00 175.10 175.63 2gq3 n PRO 543 N 1.82 0.12 -3.78 4.82 -0.04 -1.26 -3.37 135.00 133.31 2gq3 n PRO 543 Ca -0.18 0.03 -0.10 0.00 -0.04 0.00 0.00 63.50 63.22 2gq3 n PRO 543 Cb 0.54 -1.57 -0.05 0.00 -0.04 0.00 0.00 33.50 32.37 2gq3 n PRO 543 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2gq3 s SER 544 N -3.51 -0.11 0.28 3.54 1.04 -1.26 -4.86 113.70 108.82 2gq3 s SER 544 Ca 0.09 -0.56 0.01 0.00 0.48 0.00 0.00 55.95 55.97 2gq3 s SER 544 Cb 0.16 0.47 0.57 0.00 0.10 0.00 0.00 66.02 67.31 2gq3 s SER 544 CO 0.70 -0.89 1.80 -0.65 0.98 0.00 0.00 173.24 175.18 2gq3 h PRO 545 N 2.43 0.78 0.56 4.02 0.11 -1.93 0.34 132.00 138.31 2gq3 h PRO 545 Ca -0.32 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.72 2gq3 h PRO 545 Cb 1.24 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2gq3 h PRO 545 CO 0.46 0.52 -0.47 1.15 -0.21 0.00 0.00 178.00 179.45 2gq3 h THR 546 N 0.80 0.07 -0.63 -1.15 2.02 -1.97 -1.62 112.91 110.43 2gq3 h THR 546 Ca 0.49 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.78 2gq3 h THR 546 Cb 0.62 0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 67.05 2gq3 h THR 546 CO -0.32 0.00 0.42 0.00 0.37 0.00 0.00 175.52 175.99 2gq3 h ALA 547 N -0.83 2.01 -0.28 6.16 0.00 -1.76 -0.76 119.26 123.81 2gq3 h ALA 547 Ca -0.07 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2gq3 h ALA 547 Cb 0.86 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2gq3 h ALA 547 CO -0.02 -0.15 -0.16 0.00 0.00 0.00 0.00 179.25 178.92 2gq3 h ALA 548 N 1.68 1.20 -0.02 0.00 0.00 -0.72 0.26 119.26 121.67 2gq3 h ALA 548 Ca 0.29 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2gq3 h ALA 548 Cb 0.56 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2gq3 h ALA 548 CO -0.08 0.51 -0.59 1.15 0.00 0.00 0.00 179.25 180.23 2gq3 h THR 549 N 0.45 1.41 0.20 0.00 2.02 -0.16 -1.65 112.91 115.18 2gq3 h THR 549 Ca 0.08 -2.01 -0.34 0.00 0.77 0.00 0.00 66.41 64.90 2gq3 h THR 549 Cb 0.54 2.06 0.01 0.00 -1.74 0.00 0.00 68.15 69.03 2gq3 h THR 549 CO 0.04 0.58 -1.67 -0.07 0.37 0.00 0.00 175.52 174.76 2gq3 h LEU 550 N 0.06 0.65 -0.78 2.58 3.38 -1.05 -3.30 115.31 116.83 2gq3 h LEU 550 Ca -0.01 -0.88 -0.04 0.00 0.09 0.00 0.00 57.88 57.04 2gq3 h LEU 550 Cb 1.07 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.57 2gq3 h LEU 550 CO 0.08 1.73 0.35 -0.74 0.09 0.00 0.00 178.44 179.96 2gq3 h HIS 551 N 0.11 1.16 -1.40 1.13 2.76 -0.51 -2.13 115.15 116.27 2gq3 h HIS 551 Ca -0.31 -0.07 0.41 0.00 -2.20 0.00 0.00 60.37 58.19 2gq3 h HIS 551 Cb 2.11 -0.35 -0.06 0.00 1.55 0.00 0.00 27.41 30.66 2gq3 h HIS 551 CO 0.10 0.86 1.09 0.00 -1.30 0.00 0.00 177.93 178.68 2gq3 h ALA 552 N 1.18 3.31 -0.45 5.26 0.00 -1.38 0.48 119.26 127.67 2gq3 h ALA 552 Ca 0.27 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.17 2gq3 h ALA 552 Cb 0.16 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2gq3 h ALA 552 CO -0.03 -1.81 0.30 -0.07 0.00 0.00 0.00 179.25 177.64 2gq3 h LEU 553 N 0.00 0.38 -0.37 0.00 3.38 -1.50 -2.29 115.31 114.91 2gq3 h LEU 553 Ca 0.67 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.46 2gq3 h LEU 553 Cb 2.83 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 43.50 2gq3 h LEU 553 CO -0.01 0.26 -0.50 0.45 0.09 0.00 0.00 178.44 178.73 2gq3 h HIS 554 N 0.44 1.04 -0.01 1.13 3.86 -0.18 -3.00 115.15 118.43 2gq3 h HIS 554 Ca 0.19 -0.35 -0.12 0.00 -1.16 0.00 0.00 60.37 58.93 2gq3 h HIS 554 Cb 0.20 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 2gq3 h HIS 554 CO -0.00 1.17 -0.56 1.88 0.86 0.00 0.00 177.93 181.28 2gq3 h TYR 555 N 0.66 0.02 -0.20 2.45 -1.99 -1.47 0.14 116.97 116.58 2gq3 h TYR 555 Ca 0.03 -0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.69 2gq3 h TYR 555 Cb 1.09 -0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.81 2gq3 h TYR 555 CO 0.06 0.57 -0.15 0.45 -0.00 0.00 0.00 178.16 179.10 2gq3 h HIS 556 N 0.01 0.35 0.09 4.88 3.86 -1.46 -3.32 115.15 119.56 2gq3 h HIS 556 Ca -0.01 -0.05 -0.31 0.00 -1.16 0.00 0.00 60.37 58.85 2gq3 h HIS 556 Cb 0.99 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 29.35 2gq3 h HIS 556 CO 0.00 0.47 -1.65 1.96 0.86 0.00 0.00 177.93 179.57 2gq3 h GLN 557 N 0.30 0.20 -5.19 2.45 4.20 -1.08 -3.46 115.11 112.53 2gq3 h GLN 557 Ca 0.06 -0.33 -0.62 0.00 0.06 0.00 0.00 58.65 57.82 2gq3 h GLN 557 Cb 0.45 0.12 -0.16 0.00 0.30 0.00 0.00 27.48 28.19 2gq3 h GLN 557 CO 0.03 1.00 -0.55 0.08 -0.67 0.00 0.00 178.83 178.73 2gq3 s VAL 558 N -2.60 4.96 -0.69 -0.54 1.01 -0.09 -5.05 120.40 117.41 2gq3 s VAL 558 Ca -0.11 0.04 -0.23 0.00 0.00 0.00 0.00 61.98 61.68 2gq3 s VAL 558 Cb 0.07 -3.27 0.07 0.00 0.00 0.00 0.00 36.38 33.25 2gq3 s VAL 558 CO 0.83 0.41 1.00 -0.62 0.00 0.00 0.00 175.10 176.73 2gq3 s ASP 559 N 0.70 6.20 0.09 3.32 -1.08 -1.26 -4.60 116.67 120.03 2gq3 s ASP 559 Ca 0.05 -1.02 -0.16 0.00 -0.52 0.00 0.00 52.55 50.90 2gq3 s ASP 559 Cb -0.13 -2.43 -0.08 0.00 -1.46 0.00 0.00 42.92 38.82 2gq3 s ASP 559 CO 0.02 -1.45 1.45 0.58 0.52 0.00 0.00 175.17 176.28 2gq3 h VAL 560 N 5.98 1.30 -0.73 1.11 2.07 -1.87 -1.57 116.25 122.54 2gq3 h VAL 560 Ca -0.25 -1.26 0.13 0.00 0.82 0.00 0.00 66.70 66.14 2gq3 h VAL 560 Cb 1.07 1.52 -0.09 0.00 -1.52 0.00 0.00 31.29 32.26 2gq3 h VAL 560 CO 1.19 0.40 0.30 0.00 0.02 0.00 0.00 177.57 179.47 2gq3 h ALA 561 N 0.74 1.01 -0.44 1.67 0.00 -1.96 -0.11 119.26 120.17 2gq3 h ALA 561 Ca 0.06 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 2gq3 h ALA 561 Cb 0.68 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2gq3 h ALA 561 CO 0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 179.25 179.10 2gq3 h ALA 562 N 1.51 0.59 -0.25 0.00 0.00 -1.94 -1.75 119.26 117.43 2gq3 h ALA 562 Ca 0.39 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2gq3 h ALA 562 Cb 0.56 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 2gq3 h ALA 562 CO -0.37 0.40 0.07 0.28 0.00 0.00 0.00 179.25 179.62 2gq3 h VAL 563 N 0.62 0.91 -0.24 0.00 2.07 -0.29 -2.07 116.25 117.25 2gq3 h VAL 563 Ca 0.12 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.55 2gq3 h VAL 563 Cb 0.51 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 2gq3 h VAL 563 CO 0.03 0.03 0.00 1.56 0.02 0.00 0.00 177.57 179.21 2gq3 h GLN 564 N 0.17 0.36 -0.43 1.57 4.20 -0.94 -0.86 115.11 119.18 2gq3 h GLN 564 Ca 0.11 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 2gq3 h GLN 564 Cb 0.09 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 2gq3 h GLN 564 CO -0.13 0.39 -0.19 0.37 -0.67 0.00 0.00 178.83 178.60 2gq3 h GLN 565 N 0.35 0.84 -0.00 1.46 5.75 -1.04 -2.58 115.11 119.89 2gq3 h GLN 565 Ca 0.08 -0.33 0.00 0.00 -0.15 0.00 0.00 58.65 58.25 2gq3 h GLN 565 Cb 0.23 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.74 2gq3 h GLN 565 CO 0.00 0.96 -0.10 0.41 -2.65 0.00 0.00 178.83 177.45 2gq3 n GLY 566 N -0.26 -1.21 0.04 2.39 0.00 -0.40 -3.17 105.19 102.58 2gq3 n GLY 566 Ca 0.01 -0.20 0.11 0.00 0.00 0.00 0.00 46.02 45.93 2gq3 n GLY 566 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gq3 n LEU 567 N -1.24 0.25 -1.57 0.99 4.77 -0.76 -4.99 117.00 114.46 2gq3 n LEU 567 Ca 0.11 0.07 -0.22 0.00 -0.03 0.00 0.00 56.01 55.94 2gq3 n LEU 567 Cb 0.29 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.33 2gq3 n LEU 567 CO 0.26 -0.04 0.48 0.00 -1.33 0.00 0.00 177.39 176.76 2gq3 n ALA 568 N -2.21 -0.24 -0.82 -1.18 0.00 -0.99 -2.13 120.51 112.94 2gq3 n ALA 568 Ca -0.03 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2gq3 n ALA 568 Cb 0.56 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 19.32 2gq3 n ALA 568 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gq3 n GLY 569 N 1.88 1.02 3.73 0.00 0.00 -1.26 -5.00 105.19 105.56 2gq3 n GLY 569 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2gq3 n GLY 569 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gq3 s LYS 570 N -0.14 4.53 -0.35 1.61 3.01 -0.91 -5.03 119.74 122.47 2gq3 s LYS 570 Ca 0.00 1.79 -0.04 0.00 -1.01 0.00 0.00 55.97 56.71 2gq3 s LYS 570 Cb 0.00 -3.27 0.07 0.00 -1.01 0.00 0.00 37.83 33.61 2gq3 s LYS 570 CO 0.00 -0.04 0.10 0.50 0.51 0.00 0.00 175.35 176.42 2gq3 s ARG 571 N -0.11 2.36 -0.01 1.68 3.52 -1.26 -4.81 118.95 120.33 2gq3 s ARG 571 Ca 0.52 -1.42 0.16 0.00 -0.13 0.00 0.00 55.73 54.86 2gq3 s ARG 571 Cb -0.31 -3.40 -0.19 0.00 -1.56 0.00 0.00 34.95 29.50 2gq3 s ARG 571 CO 0.35 -0.78 0.57 0.54 -0.81 0.00 0.00 175.30 175.17 2gq3 n ARG 572 N 4.67 1.50 -4.38 5.12 1.74 -1.26 -4.99 116.66 119.07 2gq3 n ARG 572 Ca -0.10 -0.04 -0.20 0.00 -0.77 0.00 0.00 57.85 56.75 2gq3 n ARG 572 Cb 0.43 -1.27 -0.14 0.00 -1.02 0.00 0.00 32.46 30.46 2gq3 n ARG 572 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gq3 s ALA 573 N -2.64 1.08 0.21 7.54 0.00 -1.26 -4.98 121.76 121.71 2gq3 s ALA 573 Ca 0.03 -0.73 0.08 0.00 0.00 0.00 0.00 51.96 51.33 2gq3 s ALA 573 Cb 0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 2gq3 s ALA 573 CO 0.64 0.21 0.02 0.95 0.00 0.00 0.00 175.76 177.58 2gq3 s THR 574 N -0.72 3.71 0.19 0.00 -4.23 -1.26 -4.98 115.64 108.35 2gq3 s THR 574 Ca 0.02 -1.57 -0.16 0.00 -1.18 0.00 0.00 61.69 58.80 2gq3 s THR 574 Cb -0.07 -2.92 0.18 0.00 1.34 0.00 0.00 72.50 71.03 2gq3 s THR 574 CO 0.01 -0.22 1.63 0.40 -0.54 0.00 0.00 174.62 175.91 2gq3 h ILE 575 N 2.19 0.41 -0.94 2.99 2.04 -1.99 -1.27 117.51 120.94 2gq3 h ILE 575 Ca -0.46 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.43 2gq3 h ILE 575 Cb 1.22 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 2gq3 h ILE 575 CO 0.59 0.00 0.62 -0.08 0.00 0.00 0.00 178.15 179.28 2gq3 h GLU 576 N -0.03 1.16 -0.79 2.37 4.81 -1.97 -0.27 114.58 119.86 2gq3 h GLU 576 Ca 0.26 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.37 2gq3 h GLU 576 Cb 0.43 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 2gq3 h GLU 576 CO -0.57 0.77 0.31 1.96 -0.73 0.00 0.00 179.01 180.75 2gq3 h GLN 577 N 1.20 1.17 -0.56 1.92 4.20 -1.71 -2.34 115.11 118.99 2gq3 h GLN 577 Ca 0.37 -0.21 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 2gq3 h GLN 577 Cb -0.01 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.55 2gq3 h GLN 577 CO -0.11 0.95 0.27 -0.07 -0.67 0.00 0.00 178.83 179.21 2gq3 h LEU 578 N 1.15 0.70 -1.16 1.46 3.38 0.02 -2.47 115.31 118.39 2gq3 h LEU 578 Ca 0.26 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2gq3 h LEU 578 Cb 0.21 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2gq3 h LEU 578 CO -0.02 0.59 0.00 0.18 0.09 0.00 0.00 178.44 179.28 2gq3 n LEU 579 N -4.37 1.77 -4.60 1.67 4.77 -0.66 -4.78 117.00 110.80 2gq3 n LEU 579 Ca 0.05 -0.67 -0.43 0.00 -0.03 0.00 0.00 56.01 54.93 2gq3 n LEU 579 Cb 0.12 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2gq3 n LEU 579 CO 0.37 0.34 1.60 -0.89 -1.33 0.00 0.00 177.39 177.48 2gq3 s THR 580 N -1.88 3.38 -0.02 -5.08 2.01 -0.90 -4.96 115.64 108.20 2gq3 s THR 580 Ca 0.35 0.39 -0.30 0.00 0.31 0.00 0.00 61.69 62.44 2gq3 s THR 580 Cb 0.19 -3.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 2gq3 s THR 580 CO 0.30 -0.34 1.02 -0.63 -0.69 0.00 0.00 174.62 174.28 2gq3 s ILE 581 N 7.22 4.75 -0.58 1.82 1.01 -1.26 -4.10 121.20 130.06 2gq3 s ILE 581 Ca 0.84 1.98 -0.05 0.00 0.00 0.00 0.00 60.65 63.41 2gq3 s ILE 581 Cb -0.24 -4.27 -0.11 0.00 0.01 0.00 0.00 42.46 37.85 2gq3 s ILE 581 CO 0.34 0.12 2.38 -0.81 0.00 0.00 0.00 174.94 176.97 2gq3 n PRO 582 N 4.19 1.90 -2.08 2.79 -0.04 -1.26 -4.93 135.00 135.57 2gq3 n PRO 582 Ca 0.07 -1.17 -0.41 0.00 -0.04 0.00 0.00 63.50 61.94 2gq3 n PRO 582 Cb 0.50 -2.21 -0.03 0.00 -0.04 0.00 0.00 33.50 31.72 2gq3 n PRO 582 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2gq3 s LEU 583 N 0.06 4.39 0.64 1.53 1.02 -1.26 -1.64 118.68 123.42 2gq3 s LEU 583 Ca 0.44 2.55 -0.18 0.00 0.02 0.00 0.00 54.13 56.96 2gq3 s LEU 583 Cb 0.16 -3.61 -0.01 0.00 0.02 0.00 0.00 46.19 42.74 2gq3 s LEU 583 CO -0.02 -0.66 1.30 0.00 0.02 0.00 0.00 176.35 176.99 2gq3 n ALA 584 N 2.76 1.19 -2.16 4.21 0.00 0.08 -4.60 120.51 121.98 2gq3 n ALA 584 Ca 0.08 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2gq3 n ALA 584 Cb 0.41 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.53 2gq3 n ALA 584 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2gq3 n LYS 585 N -1.85 3.44 -0.06 0.00 4.01 -1.26 -4.93 118.16 117.51 2gq3 n LYS 585 Ca 0.16 0.00 0.01 0.00 -0.51 0.00 0.00 58.31 57.96 2gq3 n LYS 585 Cb 0.48 0.00 -0.00 0.00 -0.51 0.00 0.00 35.03 35.00 2gq3 n LYS 585 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2gq3 n GLU 586 N 0.00 -0.12 -0.97 1.97 4.71 -1.26 -3.24 120.64 121.73 2gq3 n GLU 586 Ca 0.00 0.08 -0.12 0.00 -0.01 0.00 0.00 57.16 57.11 2gq3 n GLU 586 Cb 0.00 -0.14 -0.13 0.00 -1.01 0.00 0.00 31.44 30.16 2gq3 n GLU 586 CO 0.00 0.00 0.00 1.47 0.09 0.00 0.00 177.13 178.69 2gq3 n LEU 587 N 0.00 5.41 0.00 -4.62 -0.00 -1.26 -4.90 117.00 111.63 2gq3 n LEU 587 Ca 0.00 -3.16 0.00 0.00 -0.00 0.00 0.00 56.01 52.85 2gq3 n LEU 587 Cb 0.03 -1.35 0.00 0.00 -0.00 0.00 0.00 43.42 42.10 2gq3 n LEU 587 CO 0.00 1.59 0.16 0.00 -0.00 0.00 0.00 177.39 179.14 2gq3 n ALA 588 N 2.13 0.74 -3.74 1.47 0.00 -1.20 -4.61 120.51 115.30 2gq3 n ALA 588 Ca 0.37 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.58 2gq3 n ALA 588 Cb 0.81 -0.51 -0.17 0.00 0.00 0.00 0.00 19.45 19.57 2gq3 n ALA 588 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2gq3 s TRP 589 N -1.60 0.58 0.39 0.00 0.51 -1.26 -5.06 118.94 112.50 2gq3 s TRP 589 Ca 0.00 -0.18 -0.27 0.00 -2.12 0.00 0.00 56.10 53.52 2gq3 s TRP 589 Cb 0.00 -0.77 -0.10 0.00 -0.81 0.00 0.00 33.47 31.79 2gq3 s TRP 589 CO 0.00 -0.35 1.44 0.00 -0.51 0.00 0.00 176.95 177.53 2gq3 s ALA 590 N 2.00 3.47 0.31 0.98 0.00 -1.26 -4.87 121.76 122.39 2gq3 s ALA 590 Ca 0.04 1.49 0.08 0.00 0.00 0.00 0.00 51.96 53.57 2gq3 s ALA 590 Cb -0.13 -3.58 0.90 0.00 0.00 0.00 0.00 23.12 20.32 2gq3 s ALA 590 CO -0.05 -1.02 1.46 -2.30 0.00 0.00 0.00 175.76 173.85 2gq3 n PRO 591 N 0.34 -0.07 -0.14 0.00 -0.01 -1.26 -0.09 135.00 133.77 2gq3 n PRO 591 Ca 0.02 1.35 0.09 0.00 -0.01 0.00 0.00 63.50 64.95 2gq3 n PRO 591 Cb 0.40 -2.24 0.28 0.00 -0.01 0.00 0.00 33.50 31.93 2gq3 n PRO 591 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 175.50 175.24 2gq3 n ASP 592 N -5.27 1.98 -0.03 2.55 8.00 -1.26 -0.96 116.55 121.55 2gq3 n ASP 592 Ca 0.27 -1.85 -0.22 0.00 0.71 0.00 0.00 54.79 53.70 2gq3 n ASP 592 Cb 0.89 -0.18 -0.13 0.00 -0.02 0.00 0.00 41.12 41.68 2gq3 n ASP 592 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2gq3 n GLU 593 N 0.54 0.71 -0.22 -1.24 1.02 0.87 -2.90 120.64 119.41 2gq3 n GLU 593 Ca 0.15 0.32 -0.07 0.00 -0.02 0.00 0.00 57.16 57.54 2gq3 n GLU 593 Cb 0.35 -1.69 0.03 0.00 -0.02 0.00 0.00 31.44 30.11 2gq3 n GLU 593 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2gq3 h ILE 594 N -0.19 1.23 -0.06 -3.67 2.04 -1.38 -1.67 117.51 113.81 2gq3 h ILE 594 Ca -0.43 -0.70 0.03 0.00 1.00 0.00 0.00 64.86 64.75 2gq3 h ILE 594 Cb 1.86 0.52 -0.06 0.00 -0.74 0.00 0.00 36.82 38.40 2gq3 h ILE 594 CO -0.01 0.28 -0.53 -0.09 0.00 0.00 0.00 178.15 177.80 2gq3 h ARG 595 N 0.87 -0.61 -0.96 2.37 9.65 -1.21 -1.68 114.38 122.81 2gq3 h ARG 595 Ca 0.21 0.04 0.06 0.00 -1.10 0.00 0.00 59.98 59.19 2gq3 h ARG 595 Cb 0.18 0.14 -0.06 0.00 -1.39 0.00 0.00 29.97 28.84 2gq3 h ARG 595 CO -0.02 -0.40 0.62 1.49 2.80 0.00 0.00 179.97 184.46 2gq3 h GLU 596 N -0.63 1.12 -0.25 0.20 4.81 -1.37 -0.99 114.58 117.46 2gq3 h GLU 596 Ca 0.02 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 2gq3 h GLU 596 Cb 0.70 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 2gq3 h GLU 596 CO -0.39 0.74 0.04 1.49 -0.73 0.00 0.00 179.01 180.16 2gq3 h GLU 597 N 1.15 0.42 0.29 1.92 4.57 -1.08 -1.13 114.58 120.72 2gq3 h GLU 597 Ca 0.41 -0.11 -0.01 0.00 -1.18 0.00 0.00 59.36 58.46 2gq3 h GLU 597 Cb 0.11 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.66 2gq3 h GLU 597 CO -0.16 0.54 -0.14 0.28 -1.18 0.00 0.00 179.01 178.36 2gq3 h VAL 598 N 0.23 0.75 -0.93 0.32 2.07 -0.81 -0.05 116.25 117.83 2gq3 h VAL 598 Ca 0.08 -0.47 0.06 0.00 0.82 0.00 0.00 66.70 67.18 2gq3 h VAL 598 Cb 0.32 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 31.04 2gq3 h VAL 598 CO 0.00 0.10 0.60 0.44 0.02 0.00 0.00 177.57 178.74 2gq3 h ASP 599 N -0.64 0.95 -0.12 0.57 3.32 -1.25 0.79 116.42 120.04 2gq3 h ASP 599 Ca -0.04 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.79 2gq3 h ASP 599 Cb 0.46 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.81 2gq3 h ASP 599 CO 0.06 0.62 -0.78 -1.13 -1.72 0.00 0.00 179.24 176.30 2gq3 h ASN 600 N 1.09 0.89 -0.33 6.45 -1.24 -1.15 -1.72 115.58 119.56 2gq3 h ASN 600 Ca 0.39 -0.65 -0.13 0.00 0.71 0.00 0.00 56.30 56.62 2gq3 h ASN 600 Cb 0.14 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 38.92 2gq3 h ASN 600 CO -0.14 1.41 -0.26 0.78 -1.29 0.00 0.00 177.43 177.92 2gq3 h ASN 601 N 0.44 0.86 -0.33 1.15 2.35 -0.78 -2.27 115.58 117.02 2gq3 h ASN 601 Ca -0.06 -0.34 -0.08 0.00 -0.55 0.00 0.00 56.30 55.27 2gq3 h ASN 601 Cb 1.42 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.54 2gq3 h ASN 601 CO 0.16 1.08 -0.09 0.00 -1.65 0.00 0.00 177.43 176.92 2gq3 h GLN 603 N 0.42 0.37 -0.46 0.00 4.15 -1.37 0.26 115.11 118.48 2gq3 h GLN 603 Ca 0.08 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2gq3 h GLN 603 Cb 0.60 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.22 2gq3 h GLN 603 CO 0.04 0.48 0.30 0.77 -1.93 0.00 0.00 178.83 178.48 2gq3 h SER 604 N 0.20 0.53 0.10 -0.69 0.02 -1.37 0.16 113.55 112.49 2gq3 h SER 604 Ca 0.07 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2gq3 h SER 604 Cb 0.27 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 2gq3 h SER 604 CO 0.00 0.39 -0.11 0.40 -1.14 0.00 0.00 176.83 176.38 2gq3 h ILE 605 N 0.62 0.76 -0.61 3.27 2.04 -0.38 -2.93 117.51 120.29 2gq3 h ILE 605 Ca 0.17 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.06 2gq3 h ILE 605 Cb -0.06 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 2gq3 h ILE 605 CO -0.04 0.00 0.40 -0.07 0.00 0.00 0.00 178.15 178.45 2gq3 h LEU 606 N -0.23 0.61 -0.35 1.44 3.38 -0.25 -1.69 115.31 118.21 2gq3 h LEU 606 Ca 0.01 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 2gq3 h LEU 606 Cb 0.23 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2gq3 h LEU 606 CO -0.04 0.42 -0.20 1.23 0.09 0.00 0.00 178.44 179.94 2gq3 h GLY 607 N 0.71 0.83 0.40 0.83 0.00 -0.83 -2.53 103.07 102.47 2gq3 h GLY 607 Ca 0.24 -0.76 -0.00 0.00 0.00 0.00 0.00 47.33 46.81 2gq3 h GLY 607 CO -0.07 0.69 -0.00 -1.82 0.00 0.00 0.00 176.54 175.34 2gq3 h TYR 608 N 0.55 0.00 0.00 5.60 3.20 -1.35 -3.37 116.97 121.60 2gq3 h TYR 608 Ca 0.08 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.85 2gq3 h TYR 608 Cb 0.75 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 2gq3 h TYR 608 CO 0.06 0.60 -0.45 0.28 -1.64 0.00 0.00 178.16 177.01 2gq3 h VAL 609 N -0.60 1.29 -0.19 1.81 2.07 -1.30 -1.41 116.25 117.94 2gq3 h VAL 609 Ca -0.00 -1.56 -0.02 0.00 0.82 0.00 0.00 66.70 65.94 2gq3 h VAL 609 Cb 0.60 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 2gq3 h VAL 609 CO 0.00 0.44 0.03 1.62 0.02 0.00 0.00 177.57 179.69 2gq3 h VAL 610 N 0.00 1.22 -0.08 2.57 3.04 -1.62 0.31 116.25 121.69 2gq3 h VAL 610 Ca -0.00 -0.72 -0.17 0.00 -1.01 0.00 0.00 66.70 64.80 2gq3 h VAL 610 Cb 0.81 1.33 -0.01 0.00 -2.01 0.00 0.00 31.29 31.42 2gq3 h VAL 610 CO 0.06 0.22 -0.67 0.03 -1.01 0.00 0.00 177.57 176.20 2gq3 h ARG 611 N 0.10 0.35 0.26 4.17 3.08 -1.69 0.41 114.38 121.07 2gq3 h ARG 611 Ca 0.06 -0.27 0.01 0.00 0.07 0.00 0.00 59.98 59.85 2gq3 h ARG 611 Cb 0.30 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 2gq3 h ARG 611 CO 0.00 0.90 -0.33 2.35 -1.07 0.00 0.00 179.97 181.82 2gq3 h TRP 612 N 0.25 -0.89 0.15 3.04 7.01 -0.91 -1.54 115.95 123.05 2gq3 h TRP 612 Ca -0.02 0.01 -0.29 0.00 2.11 0.00 0.00 58.89 60.70 2gq3 h TRP 612 Cb 1.22 0.36 0.02 0.00 -2.10 0.00 0.00 29.16 28.66 2gq3 h TRP 612 CO 0.04 -0.46 -1.29 0.28 -2.79 0.00 0.00 178.44 174.22 2gq3 h VAL 613 N -0.65 1.39 0.00 2.65 2.07 -0.23 -0.08 116.25 121.41 2gq3 h VAL 613 Ca -0.00 -2.80 -0.03 0.00 0.82 0.00 0.00 66.70 64.69 2gq3 h VAL 613 Cb 0.61 2.89 -0.00 0.00 -1.52 0.00 0.00 31.29 33.26 2gq3 h VAL 613 CO -0.10 0.83 -0.51 0.44 0.02 0.00 0.00 177.57 178.24 2gq3 h ASP 614 N 0.14 0.00 0.00 0.57 5.19 -1.03 -3.39 116.42 117.90 2gq3 h ASP 614 Ca -0.18 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.23 2gq3 h ASP 614 Cb 1.99 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.50 2gq3 h ASP 614 CO 0.23 0.12 0.00 0.00 -3.12 0.00 0.00 179.24 176.47 2gq3 n GLN 615 N -2.96 0.61 -3.80 3.56 6.02 -0.64 -5.01 117.38 115.16 2gq3 n GLN 615 Ca 0.01 -0.07 -0.26 0.00 -0.01 0.00 0.00 57.00 56.68 2gq3 n GLN 615 Cb 0.59 -0.40 0.03 0.00 1.02 0.00 0.00 30.24 31.49 2gq3 n GLN 615 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2gq3 n GLY 616 N 0.11 -0.40 3.59 1.08 0.00 -0.04 -4.97 105.19 104.55 2gq3 n GLY 616 Ca 0.00 0.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 2gq3 n GLY 616 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gq3 s VAL 617 N -3.47 5.27 -2.41 1.61 1.01 -0.87 -4.44 120.40 117.10 2gq3 s VAL 617 Ca 0.36 0.26 0.22 0.00 0.00 0.00 0.00 61.98 62.82 2gq3 s VAL 617 Cb -0.18 -3.59 0.43 0.00 0.00 0.00 0.00 36.38 33.04 2gq3 s VAL 617 CO 0.82 0.21 1.44 0.61 0.00 0.00 0.00 175.10 178.17 2gq3 n GLY 618 N 4.96 1.22 3.00 4.51 0.00 -1.24 -2.44 105.19 115.21 2gq3 n GLY 618 Ca -0.12 -0.63 -0.04 0.00 0.00 0.00 0.00 46.02 45.23 2gq3 n GLY 618 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gq3 s SER 620 N 2.66 1.56 -0.27 0.00 0.01 -1.11 -4.97 113.70 111.58 2gq3 s SER 620 Ca 0.15 -0.77 -0.25 0.00 1.31 0.00 0.00 55.95 56.38 2gq3 s SER 620 Cb -0.14 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.07 2gq3 s SER 620 CO -0.20 -0.21 0.87 -1.59 0.41 0.00 0.00 173.24 172.51 2gq3 s LYS 621 N -2.57 4.10 -0.21 12.44 -2.85 -1.26 -0.71 119.74 128.68 2gq3 s LYS 621 Ca 0.04 0.88 0.01 0.00 -1.00 0.00 0.00 55.97 55.90 2gq3 s LYS 621 Cb -0.05 -3.68 0.05 0.00 -2.06 0.00 0.00 37.83 32.09 2gq3 s LYS 621 CO 0.01 -0.63 -0.10 0.08 0.10 0.00 0.00 175.35 174.81 2gq3 s VAL 622 N 3.02 1.68 0.34 1.79 1.01 -0.22 -4.88 120.40 123.14 2gq3 s VAL 622 Ca 0.36 -1.10 -0.28 0.00 0.00 0.00 0.00 61.98 60.97 2gq3 s VAL 622 Cb -0.14 -1.78 -0.12 0.00 0.00 0.00 0.00 36.38 34.33 2gq3 s VAL 622 CO 0.10 0.12 1.29 -2.65 0.00 0.00 0.00 175.10 173.96 2gq3 n PRO 623 N 4.66 2.13 -1.71 2.72 -0.02 -1.25 -1.81 135.00 139.72 2gq3 n PRO 623 Ca -0.14 0.75 -0.11 0.00 -2.02 0.00 0.00 63.50 61.98 2gq3 n PRO 623 Cb 0.46 -2.33 0.05 0.00 -0.02 0.00 0.00 33.50 31.66 2gq3 n PRO 623 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2gq3 n ASP 624 N 0.76 0.79 -0.05 2.55 5.68 -0.09 -4.72 116.55 121.47 2gq3 n ASP 624 Ca 0.05 -1.62 0.25 0.00 -0.50 0.00 0.00 54.79 52.96 2gq3 n ASP 624 Cb 0.36 -0.27 0.66 0.00 -1.14 0.00 0.00 41.12 40.73 2gq3 n ASP 624 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2gq3 h ILE 625 N -0.29 0.26 -0.60 2.12 6.09 -1.91 0.44 117.51 123.62 2gq3 h ILE 625 Ca -0.15 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.34 2gq3 h ILE 625 Cb 0.60 0.42 0.00 0.00 0.47 0.00 0.00 36.82 38.31 2gq3 h ILE 625 CO 0.18 0.00 0.00 1.41 -3.07 0.00 0.00 178.15 176.67 2gq3 n HIS 626 N -3.62 1.58 -2.61 2.19 8.25 -1.26 -4.93 115.22 114.81 2gq3 n HIS 626 Ca 0.15 -0.65 -0.12 0.00 -0.26 0.00 0.00 57.72 56.84 2gq3 n HIS 626 Cb 0.98 -0.31 -0.00 0.00 1.12 0.00 0.00 29.99 31.77 2gq3 n HIS 626 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2gq3 n ASP 627 N 0.90 -3.30 -4.67 0.41 10.43 0.15 -4.96 116.55 115.52 2gq3 n ASP 627 Ca 0.26 0.16 -0.42 0.00 2.57 0.00 0.00 54.79 57.35 2gq3 n ASP 627 Cb 0.96 -2.82 -0.03 0.00 1.84 0.00 0.00 41.12 41.07 2gq3 n ASP 627 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2gq3 s VAL 628 N -2.55 4.76 -0.45 2.53 1.01 -1.26 -4.76 120.40 119.68 2gq3 s VAL 628 Ca 0.07 1.96 -0.28 0.00 0.00 0.00 0.00 61.98 63.72 2gq3 s VAL 628 Cb -0.04 -4.28 0.01 0.00 0.00 0.00 0.00 36.38 32.07 2gq3 s VAL 628 CO 0.08 -0.06 1.47 0.00 0.00 0.00 0.00 175.10 176.59 2gq3 s ALA 629 N 2.50 2.92 -0.09 5.51 0.00 -1.26 -0.91 121.76 130.44 2gq3 s ALA 629 Ca 0.45 -0.28 0.01 0.00 0.00 0.00 0.00 51.96 52.14 2gq3 s ALA 629 Cb -0.17 -4.01 -0.02 0.00 0.00 0.00 0.00 23.12 18.92 2gq3 s ALA 629 CO 0.12 -2.63 -0.12 -0.51 0.00 0.00 0.00 175.76 172.62 2gq3 s LEU 630 N 5.91 2.84 0.02 0.00 1.43 -0.75 -3.07 118.68 125.06 2gq3 s LEU 630 Ca 0.61 -0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 53.20 2gq3 s LEU 630 Cb -0.14 -1.61 -0.08 0.00 0.03 0.00 0.00 46.19 44.39 2gq3 s LEU 630 CO 0.30 0.27 1.76 -0.32 0.23 0.00 0.00 176.35 178.59 2gq3 s MET 631 N -0.28 4.17 -0.10 1.70 1.75 0.94 -1.06 119.30 126.42 2gq3 s MET 631 Ca 0.02 2.39 -0.00 0.00 -1.25 0.00 0.00 55.69 56.85 2gq3 s MET 631 Cb -0.13 -3.90 -0.03 0.00 2.84 0.00 0.00 34.83 33.61 2gq3 s MET 631 CO 0.03 -0.85 -0.08 -1.21 -0.65 0.00 0.00 175.02 172.26 2gq3 s GLU 632 N 3.68 3.09 0.26 4.11 0.41 0.11 -4.92 118.70 125.44 2gq3 s GLU 632 Ca 0.79 -0.58 0.04 0.00 -0.41 0.00 0.00 54.97 54.80 2gq3 s GLU 632 Cb -0.39 -2.66 -0.01 0.00 -1.78 0.00 0.00 34.13 29.29 2gq3 s GLU 632 CO 0.34 0.46 0.27 -0.40 -0.49 0.00 0.00 175.26 175.44 2gq3 n ASP 633 N 2.82 -0.70 0.19 -0.19 5.75 -1.26 -2.76 116.55 120.40 2gq3 n ASP 633 Ca -0.18 -2.63 0.06 0.00 -0.01 0.00 0.00 54.79 52.04 2gq3 n ASP 633 Cb 0.53 1.50 0.56 0.00 -1.03 0.00 0.00 41.12 42.68 2gq3 n ASP 633 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2gq3 h ARG 634 N 0.00 0.14 -0.23 0.11 3.08 -1.72 -2.11 114.38 113.64 2gq3 h ARG 634 Ca -0.19 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 59.84 2gq3 h ARG 634 Cb 0.92 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.94 2gq3 h ARG 634 CO 0.27 0.13 0.12 0.00 -1.07 0.00 0.00 179.97 179.42 2gq3 h ALA 635 N 1.90 0.29 -0.10 0.04 0.00 -1.94 0.13 119.26 119.59 2gq3 h ALA 635 Ca 0.04 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2gq3 h ALA 635 Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2gq3 h ALA 635 CO -0.00 -0.17 -0.34 1.79 0.00 0.00 0.00 179.25 180.52 2gq3 h THR 636 N 0.26 1.28 -0.46 0.00 1.35 -1.73 -1.70 112.91 111.91 2gq3 h THR 636 Ca 0.08 -1.32 -0.02 0.00 -0.55 0.00 0.00 66.41 64.59 2gq3 h THR 636 Cb 0.07 1.59 -0.02 0.00 -1.73 0.00 0.00 68.15 68.06 2gq3 h THR 636 CO -0.01 0.39 0.19 0.25 -0.25 0.00 0.00 175.52 176.09 2gq3 h LEU 637 N 0.17 0.62 -0.56 3.87 5.85 -1.29 -2.36 115.31 121.62 2gq3 h LEU 637 Ca 0.02 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 2gq3 h LEU 637 Cb 0.69 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 2gq3 h LEU 637 CO 0.05 0.61 0.35 -0.09 -0.34 0.00 0.00 178.44 179.02 2gq3 h ARG 638 N 0.59 0.76 0.62 1.25 2.43 -0.09 -1.06 114.38 118.88 2gq3 h ARG 638 Ca 0.15 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2gq3 h ARG 638 Cb 0.18 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2gq3 h ARG 638 CO -0.01 0.53 -0.35 0.82 -1.51 0.00 0.00 179.97 179.45 2gq3 h ILE 639 N 0.76 0.28 -0.31 1.20 2.04 -1.32 -2.10 117.51 118.05 2gq3 h ILE 639 Ca 0.20 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.13 2gq3 h ILE 639 Cb -0.04 0.28 -0.08 0.00 -0.74 0.00 0.00 36.82 36.24 2gq3 h ILE 639 CO -0.04 0.00 -0.34 0.28 0.00 0.00 0.00 178.15 178.05 2gq3 h SER 640 N -0.91 -1.11 -0.41 1.72 0.02 -1.29 0.30 113.55 111.88 2gq3 h SER 640 Ca -0.08 0.18 -0.07 0.00 -0.84 0.00 0.00 61.79 60.98 2gq3 h SER 640 Cb 0.73 0.50 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 2gq3 h SER 640 CO 0.10 -0.34 -0.01 0.77 -1.14 0.00 0.00 176.83 176.20 2gq3 h SER 641 N -0.31 0.72 -0.43 3.07 4.64 -1.25 -2.25 113.55 117.74 2gq3 h SER 641 Ca 0.14 -0.31 -0.04 0.00 -0.47 0.00 0.00 61.79 61.10 2gq3 h SER 641 Cb 0.55 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 2gq3 h SER 641 CO -0.48 0.86 0.10 1.56 -0.87 0.00 0.00 176.83 178.00 2gq3 h GLN 642 N 0.56 0.69 0.22 4.77 1.08 -1.15 0.56 115.11 121.85 2gq3 h GLN 642 Ca 0.11 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2gq3 h GLN 642 Cb 0.50 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.83 2gq3 h GLN 642 CO 0.02 0.71 -0.19 1.25 -0.95 0.00 0.00 178.83 179.67 2gq3 h LEU 643 N 0.56 -0.51 -0.89 1.46 7.12 -0.35 -1.81 115.31 120.89 2gq3 h LEU 643 Ca 0.13 0.04 0.06 0.00 0.13 0.00 0.00 57.88 58.25 2gq3 h LEU 643 Cb 0.33 0.17 -0.06 0.00 -0.53 0.00 0.00 40.66 40.57 2gq3 h LEU 643 CO 0.00 -0.29 0.56 -0.07 -0.13 0.00 0.00 178.44 178.51 2gq3 h LEU 644 N -0.43 0.88 -1.24 2.25 3.38 -1.29 -0.48 115.31 118.38 2gq3 h LEU 644 Ca -0.01 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2gq3 h LEU 644 Cb 0.40 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 2gq3 h LEU 644 CO -0.03 0.56 0.42 0.00 0.09 0.00 0.00 178.44 179.48 2gq3 h ALA 645 N 1.42 1.43 -0.30 1.53 0.00 -0.64 -0.02 119.26 122.68 2gq3 h ALA 645 Ca 0.39 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 55.06 2gq3 h ALA 645 Cb 0.17 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2gq3 h ALA 645 CO -0.17 0.49 -0.41 -0.97 0.00 0.00 0.00 179.25 178.19 2gq3 h ASN 646 N 0.95 0.88 -0.51 0.00 -0.73 -0.94 0.72 115.58 115.95 2gq3 h ASN 646 Ca 0.25 -0.50 -0.02 0.00 1.87 0.00 0.00 56.30 57.90 2gq3 h ASN 646 Cb -0.04 -0.25 -0.03 0.00 0.27 0.00 0.00 38.32 38.27 2gq3 h ASN 646 CO -0.05 1.21 0.27 -0.50 -0.37 0.00 0.00 177.43 177.99 2gq3 h TRP 647 N 0.58 0.75 0.00 0.67 4.06 -0.78 -2.50 115.95 118.73 2gq3 h TRP 647 Ca 0.03 -0.02 -0.00 0.00 2.06 0.00 0.00 58.89 60.96 2gq3 h TRP 647 Cb 1.01 -0.24 0.00 0.00 -1.00 0.00 0.00 29.16 28.93 2gq3 h TRP 647 CO 0.07 0.55 -0.00 1.25 -3.56 0.00 0.00 178.44 176.75 2gq3 h LEU 648 N 0.77 -0.00 -0.88 -4.49 5.85 -0.54 0.10 115.31 116.11 2gq3 h LEU 648 Ca 0.19 -0.36 0.11 0.00 0.84 0.00 0.00 57.88 58.67 2gq3 h LEU 648 Cb 0.08 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.03 2gq3 h LEU 648 CO -0.03 0.36 0.51 0.03 -0.34 0.00 0.00 178.44 178.97 2gq3 h ARG 649 N -0.37 0.79 -0.24 1.25 2.47 0.74 -1.49 114.38 117.53 2gq3 h ARG 649 Ca -0.00 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 2gq3 h ARG 649 Cb 0.37 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 28.51 2gq3 h ARG 649 CO 0.00 0.52 0.00 0.72 0.56 0.00 0.00 179.97 181.77 2gq3 n HIS 650 N -4.74 0.30 -0.89 3.04 8.25 -0.97 -4.93 115.22 115.28 2gq3 n HIS 650 Ca 0.16 -0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2gq3 n HIS 650 Cb 0.34 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 2gq3 n HIS 650 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gq3 n GLY 651 N 1.33 0.51 0.28 -1.41 0.00 -0.56 -4.89 105.19 100.45 2gq3 n GLY 651 Ca 0.17 -0.44 0.01 0.00 0.00 0.00 0.00 46.02 45.76 2gq3 n GLY 651 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2gq3 h VAL 652 N 0.00 1.18 -4.10 1.61 2.07 -1.05 -3.45 116.25 112.51 2gq3 h VAL 652 Ca 0.00 -0.63 -0.15 0.00 0.82 0.00 0.00 66.70 66.73 2gq3 h VAL 652 Cb 0.00 0.82 -0.15 0.00 -1.52 0.00 0.00 31.29 30.44 2gq3 h VAL 652 CO 0.00 0.23 -0.69 0.27 0.02 0.00 0.00 177.57 177.40 2gq3 s ILE 653 N -5.11 0.37 0.11 4.57 -4.36 -0.81 -4.99 121.20 110.98 2gq3 s ILE 653 Ca -0.08 -1.84 0.04 0.00 -0.26 0.00 0.00 60.65 58.51 2gq3 s ILE 653 Cb 0.16 -1.56 -0.04 0.00 1.25 0.00 0.00 42.46 42.27 2gq3 s ILE 653 CO 0.76 -0.95 0.09 0.42 0.24 0.00 0.00 174.94 175.50 2gq3 s THR 654 N -3.79 4.46 0.54 8.37 -4.23 -1.26 -4.35 115.64 115.38 2gq3 s THR 654 Ca 0.08 -0.91 0.23 0.00 -1.18 0.00 0.00 61.69 59.91 2gq3 s THR 654 Cb 0.07 -3.19 0.34 0.00 1.34 0.00 0.00 72.50 71.05 2gq3 s THR 654 CO -0.08 0.04 2.08 0.77 -0.54 0.00 0.00 174.62 176.89 2gq3 h SER 655 N 2.97 0.00 -0.64 3.99 4.64 -1.99 -0.13 113.55 122.40 2gq3 h SER 655 Ca -0.47 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 60.94 2gq3 h SER 655 Cb 1.18 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.20 2gq3 h SER 655 CO 0.64 0.00 0.28 0.00 -0.87 0.00 0.00 176.83 176.88 2gq3 h ALA 656 N 1.85 0.85 -0.53 5.18 0.00 -1.98 0.41 119.26 125.03 2gq3 h ALA 656 Ca 0.12 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2gq3 h ALA 656 Cb 0.49 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2gq3 h ALA 656 CO -0.00 -0.13 0.28 -0.44 0.00 0.00 0.00 179.25 178.96 2gq3 h ASP 657 N 0.49 0.67 0.53 0.00 3.32 -1.44 -0.29 116.42 119.70 2gq3 h ASP 657 Ca 0.32 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 2gq3 h ASP 657 Cb 0.36 -0.17 0.01 0.00 0.22 0.00 0.00 39.33 39.74 2gq3 h ASP 657 CO -0.28 0.59 -0.25 0.58 -1.72 0.00 0.00 179.24 178.15 2gq3 h VAL 658 N 0.71 0.48 -0.57 -1.35 2.07 -0.99 0.15 116.25 116.75 2gq3 h VAL 658 Ca 0.19 -0.01 0.11 0.00 0.82 0.00 0.00 66.70 67.80 2gq3 h VAL 658 Cb 0.07 0.49 -0.08 0.00 -1.52 0.00 0.00 31.29 30.25 2gq3 h VAL 658 CO -0.03 0.00 0.11 -0.09 0.02 0.00 0.00 177.57 177.59 2gq3 h ARG 659 N -0.71 0.24 -0.77 1.57 9.65 -0.06 -0.81 114.38 123.48 2gq3 h ARG 659 Ca -0.07 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 58.74 2gq3 h ARG 659 Cb 0.55 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 29.04 2gq3 h ARG 659 CO 0.12 0.16 0.27 0.00 2.80 0.00 0.00 179.97 183.32 2gq3 h ALA 660 N 1.46 1.02 -0.27 2.80 0.00 -0.88 -2.44 119.26 120.93 2gq3 h ALA 660 Ca 0.30 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 2gq3 h ALA 660 Cb 0.43 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2gq3 h ALA 660 CO -0.39 0.67 -0.32 1.03 0.00 0.00 0.00 179.25 180.25 2gq3 h SER 661 N 1.14 0.60 -0.34 0.00 0.87 -0.15 -0.16 113.55 115.51 2gq3 h SER 661 Ca 0.25 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.54 2gq3 h SER 661 Cb 0.27 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 2gq3 h SER 661 CO -0.01 0.88 0.07 -0.07 -0.53 0.00 0.00 176.83 177.16 2gq3 h LEU 662 N 0.49 0.53 -0.78 2.23 3.38 -1.05 -0.95 115.31 119.17 2gq3 h LEU 662 Ca 0.06 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 2gq3 h LEU 662 Cb 0.79 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 2gq3 h LEU 662 CO 0.06 0.64 0.31 -0.33 0.09 0.00 0.00 178.44 179.21 2gq3 h GLU 663 N 0.40 1.17 0.00 1.13 5.08 -1.01 -0.06 114.58 121.28 2gq3 h GLU 663 Ca 0.11 -0.21 -0.11 0.00 -1.00 0.00 0.00 59.36 58.14 2gq3 h GLU 663 Cb 0.32 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 2gq3 h GLU 663 CO 0.00 0.95 -0.52 0.07 -1.00 0.00 0.00 179.01 178.52 2gq3 h ARG 664 N 1.13 0.00 0.02 2.33 0.11 -0.88 -3.29 114.38 113.80 2gq3 h ARG 664 Ca 0.26 0.00 -0.24 0.00 0.10 0.00 0.00 59.98 60.09 2gq3 h ARG 664 Cb 0.22 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.31 2gq3 h ARG 664 CO -0.02 0.52 -1.02 0.52 0.10 0.00 0.00 179.97 180.07 2gq3 h MET 665 N 0.00 0.47 -0.08 0.08 2.86 -0.93 -3.39 114.93 113.93 2gq3 h MET 665 Ca -0.01 -0.54 0.03 0.00 -2.06 0.00 0.00 59.70 57.13 2gq3 h MET 665 Cb 1.24 0.16 -0.03 0.00 0.06 0.00 0.00 31.60 33.03 2gq3 h MET 665 CO 0.07 1.18 -0.08 0.00 1.06 0.00 0.00 176.91 179.13 2gq3 h ALA 666 N 0.63 -0.02 -0.21 6.32 0.00 -1.08 -0.39 119.26 124.51 2gq3 h ALA 666 Ca -0.10 0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.90 2gq3 h ALA 666 Cb 1.67 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.62 2gq3 h ALA 666 CO 0.18 -0.55 0.20 -1.00 0.00 0.00 0.00 179.25 178.08 2gq3 h PRO 667 N -0.11 0.00 -0.18 0.00 0.13 -1.78 -1.17 132.00 128.90 2gq3 h PRO 667 Ca 0.06 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.01 2gq3 h PRO 667 Cb 0.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.33 2gq3 h PRO 667 CO -0.15 0.00 -0.63 -0.07 -0.23 0.00 0.00 178.00 176.92 2gq3 h LEU 668 N 0.00 0.73 -0.40 1.56 -0.00 -1.27 -0.87 115.31 115.06 2gq3 h LEU 668 Ca 0.10 -0.42 -0.03 0.00 -0.00 0.00 0.00 57.88 57.53 2gq3 h LEU 668 Cb 0.50 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 40.93 2gq3 h LEU 668 CO -0.00 1.18 0.15 0.58 -0.00 0.00 0.00 178.44 180.34 2gq3 h VAL 669 N 0.47 1.20 -0.11 1.22 2.07 -1.14 -2.17 116.25 117.80 2gq3 h VAL 669 Ca -0.01 -0.64 0.04 0.00 0.82 0.00 0.00 66.70 66.91 2gq3 h VAL 669 Cb 1.21 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.81 2gq3 h VAL 669 CO 0.12 0.23 -0.24 0.44 0.02 0.00 0.00 177.57 178.14 2gq3 h ASP 670 N 0.50 -0.75 -0.87 0.57 3.32 -1.15 -0.02 116.42 118.02 2gq3 h ASP 670 Ca 0.13 0.12 0.15 0.00 0.02 0.00 0.00 57.03 57.45 2gq3 h ASP 670 Cb 0.22 0.33 -0.15 0.00 0.22 0.00 0.00 39.33 39.94 2gq3 h ASP 670 CO -0.01 -0.30 -0.27 0.54 -1.72 0.00 0.00 179.24 177.48 2gq3 n ARG 671 N -5.37 -0.14 0.27 3.56 5.12 -0.34 -1.03 116.66 118.74 2gq3 n ARG 671 Ca -0.03 1.34 0.17 0.00 -1.93 0.00 0.00 57.85 57.40 2gq3 n ARG 671 Cb 0.28 -2.00 0.67 0.00 -1.16 0.00 0.00 32.46 30.25 2gq3 n ARG 671 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 2gq3 h GLN 672 N 0.00 0.00 -0.40 5.56 1.08 -0.38 -2.94 115.11 118.03 2gq3 h GLN 672 Ca 0.36 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.56 2gq3 h GLN 672 Cb 0.58 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.01 2gq3 h GLN 672 CO -0.88 0.03 0.00 0.09 -0.95 0.00 0.00 178.83 177.12 2gq3 n ASN 673 N -3.14 3.45 -4.77 1.46 4.13 -0.20 -4.96 115.26 111.23 2gq3 n ASN 673 Ca 0.00 -2.27 -0.39 0.00 1.68 0.00 0.00 54.58 53.60 2gq3 n ASN 673 Cb 0.31 -0.36 -0.06 0.00 -1.54 0.00 0.00 39.78 38.13 2gq3 n ASN 673 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2gq3 s ALA 674 N -1.49 3.50 0.40 5.41 0.00 -0.69 -0.79 121.76 128.10 2gq3 s ALA 674 Ca 0.33 0.08 -0.14 0.00 0.00 0.00 0.00 51.96 52.23 2gq3 s ALA 674 Cb 0.20 -2.76 -0.08 0.00 0.00 0.00 0.00 23.12 20.49 2gq3 s ALA 674 CO 0.17 0.22 0.82 0.20 0.00 0.00 0.00 175.76 177.17 2gq3 s GLY 675 N -0.47 2.14 -0.19 0.00 0.00 -1.26 -5.06 107.32 102.49 2gq3 s GLY 675 Ca 0.32 0.02 -0.02 0.00 0.00 0.00 0.00 44.72 45.04 2gq3 s GLY 675 CO 0.19 0.24 -0.10 0.99 0.00 0.00 0.00 173.10 174.42 2gq3 s ASP 676 N -2.74 3.97 0.44 1.64 1.11 0.03 -5.00 116.67 116.11 2gq3 s ASP 676 Ca 0.55 -0.43 0.30 0.00 0.18 0.00 0.00 52.55 53.15 2gq3 s ASP 676 Cb -0.10 -1.65 1.42 0.00 1.07 0.00 0.00 42.92 43.66 2gq3 s ASP 676 CO 0.25 0.03 1.63 -0.37 1.18 0.00 0.00 175.17 177.89 2gq3 h VAL 677 N 5.68 0.13 -0.79 -1.27 -1.51 -1.99 2.15 116.25 118.64 2gq3 h VAL 677 Ca -0.38 -0.03 0.02 0.00 -1.23 0.00 0.00 66.70 65.08 2gq3 h VAL 677 Cb 1.17 0.03 -0.04 0.00 -2.13 0.00 0.00 31.29 30.32 2gq3 h VAL 677 CO 0.60 0.02 0.52 0.00 -1.23 0.00 0.00 177.57 177.47 2gq3 h ALA 678 N 1.60 1.02 -2.28 5.19 0.00 -1.97 -3.45 119.26 119.37 2gq3 h ALA 678 Ca 0.81 -0.04 -0.54 0.00 0.00 0.00 0.00 54.91 55.14 2gq3 h ALA 678 Cb 2.55 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 20.06 2gq3 h ALA 678 CO -0.41 0.37 1.28 -0.47 0.00 0.00 0.00 179.25 180.01 2gq3 s TYR 679 N -6.12 1.29 -0.34 0.00 5.04 0.73 -4.99 117.35 112.96 2gq3 s TYR 679 Ca -0.13 -0.24 -0.16 0.00 -2.44 0.00 0.00 57.07 54.10 2gq3 s TYR 679 Cb 0.16 -4.17 -0.01 0.00 0.35 0.00 0.00 41.96 38.29 2gq3 s TYR 679 CO 0.78 -5.21 0.42 0.50 -1.34 0.00 0.00 175.55 170.71 2gq3 s ARG 680 N 4.82 3.63 0.34 4.97 3.00 -1.26 -4.82 118.95 129.63 2gq3 s ARG 680 Ca 0.90 -0.27 -0.29 0.00 -1.00 0.00 0.00 55.73 55.07 2gq3 s ARG 680 Cb -0.40 -3.79 -0.10 0.00 0.00 0.00 0.00 34.95 30.65 2gq3 s ARG 680 CO 0.40 -0.54 1.34 -2.14 0.00 0.00 0.00 175.30 174.35 2gq3 s PRO 681 N 2.16 4.32 -0.01 5.12 0.02 -1.26 -4.96 135.00 140.38 2gq3 s PRO 681 Ca 0.15 2.27 -0.25 0.00 0.02 0.00 0.00 61.00 63.18 2gq3 s PRO 681 Cb -0.16 -3.06 -0.19 0.00 0.02 0.00 0.00 34.50 31.11 2gq3 s PRO 681 CO 0.12 -0.24 1.28 0.52 -0.33 0.00 0.00 177.00 178.34 2gq3 h MET 682 N 3.35 -0.04 -6.58 5.54 2.86 -1.90 -3.46 114.93 114.69 2gq3 h MET 682 Ca -0.49 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 56.64 2gq3 h MET 682 Cb 1.23 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.88 2gq3 h MET 682 CO 0.65 0.40 -0.05 0.00 1.06 0.00 0.00 176.91 178.97 2gq3 s ALA 683 N -4.39 3.52 -0.85 6.32 0.00 -1.26 -2.54 121.76 122.55 2gq3 s ALA 683 Ca -0.15 -0.35 0.25 0.00 0.00 0.00 0.00 51.96 51.70 2gq3 s ALA 683 Cb 0.02 -2.47 0.96 0.00 0.00 0.00 0.00 23.12 21.63 2gq3 s ALA 683 CO 0.65 0.26 1.77 -2.30 0.00 0.00 0.00 175.76 176.14 2gq3 n PRO 684 N -0.78 0.10 -2.37 0.00 -0.02 -1.26 -4.95 135.00 125.72 2gq3 n PRO 684 Ca 0.00 0.17 -0.43 0.00 -2.02 0.00 0.00 63.50 61.22 2gq3 n PRO 684 Cb 0.53 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 2gq3 n PRO 684 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2gq3 n ASN 685 N -1.82 4.95 -0.30 2.55 3.02 -1.05 -4.78 115.26 117.83 2gq3 n ASN 685 Ca 0.05 -3.05 0.03 0.00 -0.03 0.00 0.00 54.58 51.59 2gq3 n ASN 685 Cb 0.32 -1.53 0.18 0.00 -0.61 0.00 0.00 39.78 38.14 2gq3 n ASN 685 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 2gq3 h PHE 686 N 6.09 0.88 -0.00 3.10 0.05 -1.91 -2.76 116.94 122.39 2gq3 h PHE 686 Ca 0.41 0.03 0.00 0.00 3.82 0.00 0.00 57.97 62.23 2gq3 h PHE 686 Cb 0.68 -0.27 0.00 0.00 2.00 0.00 0.00 35.95 38.36 2gq3 h PHE 686 CO 1.26 0.35 -0.05 -0.25 -0.18 0.00 0.00 178.31 179.44 2gq3 n ASP 687 N -4.74 0.36 -1.24 2.17 10.43 -1.26 -2.05 116.55 120.22 2gq3 n ASP 687 Ca 0.14 -0.67 0.12 0.00 2.57 0.00 0.00 54.79 56.96 2gq3 n ASP 687 Cb 0.29 -0.09 0.26 0.00 1.84 0.00 0.00 41.12 43.41 2gq3 n ASP 687 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 2gq3 n ASP 688 N -0.93 3.66 -4.30 -2.24 2.03 -1.04 -4.80 116.55 108.93 2gq3 n ASP 688 Ca 0.17 -2.00 -0.40 0.00 0.52 0.00 0.00 54.79 53.08 2gq3 n ASP 688 Cb 0.24 -0.34 -0.11 0.00 -0.72 0.00 0.00 41.12 40.20 2gq3 n ASP 688 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2gq3 s SER 689 N -1.33 5.61 0.19 1.67 0.15 -0.87 -4.93 113.70 114.20 2gq3 s SER 689 Ca 0.43 -1.31 -0.17 0.00 0.70 0.00 0.00 55.95 55.59 2gq3 s SER 689 Cb 0.24 -1.98 0.16 0.00 -1.71 0.00 0.00 66.02 62.74 2gq3 s SER 689 CO 0.33 -0.46 1.62 0.40 1.20 0.00 0.00 173.24 176.32 2gq3 h ILE 690 N 6.04 0.33 -0.40 6.45 1.08 -1.87 0.22 117.51 129.36 2gq3 h ILE 690 Ca -0.24 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.28 2gq3 h ILE 690 Cb 1.09 0.33 -0.04 0.00 -3.07 0.00 0.00 36.82 35.12 2gq3 h ILE 690 CO 0.71 0.00 0.16 0.00 -0.69 0.00 0.00 178.15 178.33 2gq3 h ALA 691 N 1.30 0.48 -0.54 1.87 0.00 -1.91 0.71 119.26 121.17 2gq3 h ALA 691 Ca 0.25 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.24 2gq3 h ALA 691 Cb 0.48 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 2gq3 h ALA 691 CO -0.60 -0.22 0.29 0.35 0.00 0.00 0.00 179.25 179.07 2gq3 h PHE 692 N 0.34 0.54 0.00 0.00 3.57 -1.68 -2.09 116.94 117.62 2gq3 h PHE 692 Ca 0.18 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.64 2gq3 h PHE 692 Cb 0.14 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 2gq3 h PHE 692 CO -0.13 0.28 -0.28 -0.07 -2.23 0.00 0.00 178.31 175.87 2gq3 h LEU 693 N 0.57 0.00 -0.35 0.59 3.38 0.18 -1.78 115.31 117.90 2gq3 h LEU 693 Ca 0.23 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.14 2gq3 h LEU 693 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2gq3 h LEU 693 CO -0.14 0.28 -0.02 0.00 0.09 0.00 0.00 178.44 178.65 2gq3 h ALA 694 N 1.72 0.48 -0.30 1.53 0.00 0.56 -1.19 119.26 122.06 2gq3 h ALA 694 Ca -0.00 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.67 2gq3 h ALA 694 Cb 0.82 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2gq3 h ALA 694 CO 0.04 0.27 0.12 0.00 0.00 0.00 0.00 179.25 179.68 2gq3 h ALA 695 N 0.85 0.35 -0.21 0.00 0.00 -0.77 0.72 119.26 120.20 2gq3 h ALA 695 Ca 0.10 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.06 2gq3 h ALA 695 Cb 0.49 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2gq3 h ALA 695 CO 0.02 -0.27 -0.00 0.37 0.00 0.00 0.00 179.25 179.37 2gq3 h GLN 696 N 0.27 0.06 -0.31 0.00 4.15 -1.32 -3.07 115.11 114.89 2gq3 h GLN 696 Ca 0.13 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 2gq3 h GLN 696 Cb 0.07 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 2gq3 h GLN 696 CO -0.11 0.04 0.17 1.49 -1.93 0.00 0.00 178.83 178.49 2gq3 h GLU 697 N 0.06 0.44 -0.77 1.69 4.81 -0.66 -1.47 114.58 118.68 2gq3 h GLU 697 Ca 0.10 -0.05 0.21 0.00 -0.13 0.00 0.00 59.36 59.48 2gq3 h GLU 697 Cb 0.13 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 2gq3 h GLU 697 CO -0.17 0.37 0.54 -0.07 -0.73 0.00 0.00 179.01 178.96 2gq3 h LEU 698 N 0.39 0.12 0.00 1.64 3.38 -0.78 -1.56 115.31 118.49 2gq3 h LEU 698 Ca 0.11 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 2gq3 h LEU 698 Cb 0.06 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2gq3 h LEU 698 CO -0.02 0.05 -0.76 0.40 0.09 0.00 0.00 178.44 178.21 2gq3 h ILE 699 N 0.12 1.00 0.00 1.22 2.04 -1.32 -3.11 117.51 117.47 2gq3 h ILE 699 Ca 0.38 -2.02 0.00 0.00 1.00 0.00 0.00 64.86 64.21 2gq3 h ILE 699 Cb 1.30 2.16 0.00 0.00 -0.74 0.00 0.00 36.82 39.55 2gq3 h ILE 699 CO -0.05 0.34 0.00 -0.07 0.00 0.00 0.00 178.15 178.37 2gq3 h LEU 700 N -1.00 0.00 -2.87 1.44 3.38 -1.07 -2.50 115.31 112.70 2gq3 h LEU 700 Ca -0.19 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 2gq3 h LEU 700 Cb 1.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 2gq3 h LEU 700 CO -0.12 0.00 -0.07 -1.54 0.09 0.00 0.00 178.44 176.81 2gq3 n SER 701 N -2.99 2.04 -0.19 -0.43 3.41 -0.61 -4.76 113.62 110.09 2gq3 n SER 701 Ca 0.03 -2.95 -0.08 0.00 -0.26 0.00 0.00 58.87 55.60 2gq3 n SER 701 Cb 0.41 -0.40 0.02 0.00 -0.26 0.00 0.00 64.21 63.98 2gq3 n SER 701 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2gq3 h GLY 702 N 0.00 0.94 1.55 5.00 0.00 -1.36 -1.91 103.07 107.29 2gq3 h GLY 702 Ca -0.00 -0.59 0.03 0.00 0.00 0.00 0.00 47.33 46.77 2gq3 h GLY 702 CO 0.00 0.55 0.19 0.00 0.00 0.00 0.00 176.54 177.28 2gq3 h ALA 703 N 1.02 1.55 -0.00 3.60 0.00 -1.86 -2.44 119.26 121.13 2gq3 h ALA 703 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2gq3 h ALA 703 Cb 0.34 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2gq3 h ALA 703 CO 0.00 -0.25 -0.42 1.04 0.00 0.00 0.00 179.25 179.62 2gq3 n GLN 704 N -3.46 0.14 -2.85 0.00 1.13 -0.72 -4.89 117.38 106.73 2gq3 n GLN 704 Ca -0.00 -0.08 -0.40 0.00 -1.94 0.00 0.00 57.00 54.58 2gq3 n GLN 704 Cb 0.29 -1.50 -0.05 0.00 0.11 0.00 0.00 30.24 29.09 2gq3 n GLN 704 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2gq3 s GLN 705 N -2.91 4.61 0.07 -1.09 -1.52 -0.92 -4.94 119.66 112.96 2gq3 s GLN 705 Ca 0.14 1.27 -0.31 0.00 -1.95 0.00 0.00 55.36 54.51 2gq3 s GLN 705 Cb 0.18 -3.36 -0.09 0.00 -0.22 0.00 0.00 33.01 29.52 2gq3 s GLN 705 CO 0.66 0.27 1.77 -1.25 -0.25 0.00 0.00 175.29 176.48 2gq3 s PRO 706 N -0.11 4.16 -0.94 2.91 0.04 -1.26 -0.66 135.00 139.15 2gq3 s PRO 706 Ca 0.43 2.46 0.00 0.00 0.04 0.00 0.00 61.00 63.93 2gq3 s PRO 706 Cb -0.22 -3.72 0.00 0.00 0.04 0.00 0.00 34.50 30.60 2gq3 s PRO 706 CO 0.27 -0.82 0.00 0.09 0.04 0.00 0.00 177.00 176.58 2gq3 n ASN 707 N 6.06 -5.52 -0.50 6.66 3.02 -1.26 -0.79 115.26 122.94 2gq3 n ASN 707 Ca 0.17 0.22 -0.06 0.00 -0.03 0.00 0.00 54.58 54.88 2gq3 n ASN 707 Cb 0.40 -3.94 -0.02 0.00 -0.61 0.00 0.00 39.78 35.61 2gq3 n ASN 707 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gq3 n GLY 708 N 0.37 0.67 3.79 7.41 0.00 0.17 -4.52 105.19 113.07 2gq3 n GLY 708 Ca -0.09 -0.76 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 2gq3 n GLY 708 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gq3 s TYR 709 N -2.23 3.15 -0.18 1.61 4.12 0.03 -4.83 117.35 119.02 2gq3 s TYR 709 Ca 0.00 1.61 0.12 0.00 0.02 0.00 0.00 57.07 58.83 2gq3 s TYR 709 Cb 0.00 -3.11 -0.18 0.00 -1.52 0.00 0.00 41.96 37.15 2gq3 s TYR 709 CO 0.00 -0.73 0.35 0.25 0.02 0.00 0.00 175.55 175.43 2gq3 n THR 710 N -0.42 0.00 -0.15 -0.71 -2.24 -1.26 -4.54 114.28 104.96 2gq3 n THR 710 Ca 0.07 -0.27 -0.03 0.00 -2.27 0.00 0.00 64.05 61.55 2gq3 n THR 710 Cb 0.51 0.44 0.06 0.00 -2.10 0.00 0.00 70.33 69.23 2gq3 n THR 710 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2gq3 h GLU 711 N 0.00 0.23 -0.43 -0.78 3.07 -1.96 -1.35 114.58 113.36 2gq3 h GLU 711 Ca 0.00 -0.01 0.09 0.00 -0.50 0.00 0.00 59.36 58.94 2gq3 h GLU 711 Cb 0.49 -0.05 -0.09 0.00 -0.84 0.00 0.00 28.75 28.26 2gq3 h GLU 711 CO 0.00 0.15 -0.16 -1.35 -1.40 0.00 0.00 179.01 176.25 2gq3 h PRO 712 N 0.23 -0.07 -0.15 2.33 0.11 -1.99 1.16 132.00 133.62 2gq3 h PRO 712 Ca 0.24 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.29 2gq3 h PRO 712 Cb 0.31 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.43 2gq3 h PRO 712 CO -0.31 -0.05 -0.13 0.82 -0.21 0.00 0.00 178.00 178.13 2gq3 h ILE 713 N -0.07 1.34 -0.26 4.15 2.04 -1.85 -1.59 117.51 121.27 2gq3 h ILE 713 Ca 0.21 -1.26 -0.02 0.00 1.00 0.00 0.00 64.86 64.79 2gq3 h ILE 713 Cb 0.39 1.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 2gq3 h ILE 713 CO -0.48 0.37 0.09 -0.07 0.00 0.00 0.00 178.15 178.06 2gq3 h LEU 714 N -0.01 0.37 0.03 1.44 3.38 -0.36 -1.69 115.31 118.46 2gq3 h LEU 714 Ca 0.03 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.84 2gq3 h LEU 714 Cb 0.65 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 2gq3 h LEU 714 CO 0.03 0.45 -0.21 0.45 0.09 0.00 0.00 178.44 179.25 2gq3 h HIS 715 N 0.26 -0.57 0.00 1.13 3.86 0.13 0.01 115.15 119.97 2gq3 h HIS 715 Ca 0.08 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.26 2gq3 h HIS 715 Cb 0.21 0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.92 2gq3 h HIS 715 CO -0.00 -0.30 -0.23 -0.09 0.86 0.00 0.00 177.93 178.16 2gq3 h ARG 716 N -0.36 0.00 0.21 2.45 2.43 -1.08 -2.24 114.38 115.80 2gq3 h ARG 716 Ca 0.05 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.89 2gq3 h ARG 716 Cb 0.42 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.99 2gq3 h ARG 716 CO -0.18 0.23 -1.56 0.00 -1.51 0.00 0.00 179.97 176.95 2gq3 h ARG 717 N 0.00 0.44 -0.41 0.20 2.47 -1.19 -2.02 114.38 113.87 2gq3 h ARG 717 Ca -0.00 -0.75 -0.04 0.00 -1.26 0.00 0.00 59.98 57.93 2gq3 h ARG 717 Cb 0.44 0.28 -0.02 0.00 -1.65 0.00 0.00 29.97 29.02 2gq3 h ARG 717 CO 0.03 1.35 0.10 -0.09 0.56 0.00 0.00 179.97 181.92 2gq3 h ARG 718 N 0.12 0.60 0.00 0.04 9.65 -0.84 0.55 114.38 124.49 2gq3 h ARG 718 Ca -0.27 -0.10 -0.07 0.00 -1.10 0.00 0.00 59.98 58.44 2gq3 h ARG 718 Cb 2.12 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 30.59 2gq3 h ARG 718 CO 0.23 0.55 -0.32 0.00 2.80 0.00 0.00 179.97 183.22 2gq3 h ARG 719 N 0.59 0.00 -0.22 0.20 3.08 -1.40 0.11 114.38 116.74 2gq3 h ARG 719 Ca 0.14 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.10 2gq3 h ARG 719 Cb 0.22 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 2gq3 h ARG 719 CO -0.00 0.32 -0.19 1.49 -1.07 0.00 0.00 179.97 180.51 2gq3 h GLU 720 N 0.00 0.52 -0.77 0.04 4.81 -0.85 -1.24 114.58 117.09 2gq3 h GLU 720 Ca -0.00 -0.26 -0.05 0.00 -0.13 0.00 0.00 59.36 58.91 2gq3 h GLU 720 Cb 1.18 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 2gq3 h GLU 720 CO 0.04 0.84 0.28 0.35 -0.73 0.00 0.00 179.01 179.80 2gq3 h PHE 721 N 0.21 1.18 0.07 0.92 3.57 -0.64 -2.63 116.94 119.62 2gq3 h PHE 721 Ca 0.04 -0.10 0.01 0.00 3.53 0.00 0.00 57.97 61.45 2gq3 h PHE 721 Cb 0.73 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 2gq3 h PHE 721 CO 0.08 0.91 -0.11 0.87 -2.23 0.00 0.00 178.31 177.82 2gq3 h LYS 722 N 1.12 -0.21 -0.00 1.11 6.56 -0.76 -3.05 116.57 121.35 2gq3 h LYS 722 Ca 0.25 0.01 -0.14 0.00 -1.06 0.00 0.00 60.65 59.72 2gq3 h LYS 722 Cb 0.24 0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 31.93 2gq3 h LYS 722 CO -0.02 -0.14 -0.67 0.00 -2.06 0.00 0.00 179.45 176.56 2gq3 h ALA 723 N 0.69 0.89 0.00 3.86 0.00 -1.11 -2.36 119.26 121.23 2gq3 h ALA 723 Ca 0.02 -0.61 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 2gq3 h ALA 723 Cb 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2gq3 h ALA 723 CO -0.06 0.83 -0.12 0.07 0.00 0.00 0.00 179.25 179.98 2gq3 h ARG 724 N 0.01 0.00 -1.73 0.00 -0.00 -1.52 -3.24 114.38 107.89 2gq3 h ARG 724 Ca -0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 59.98 59.91 2gq3 h ARG 724 Cb 1.19 0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 31.13 2gq3 h ARG 724 CO 0.09 0.12 0.08 0.00 -0.00 0.00 0.00 179.97 180.25 2gq3 n ALA 725 N -2.16 3.93 -0.40 0.08 0.00 -0.89 -5.11 120.51 115.96 2gq3 n ALA 725 Ca 0.01 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2gq3 n ALA 725 Cb 0.38 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.77 2gq3 n ALA 725 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50