#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gtg n ASP 2 N 0.00 0.22 -0.04 7.83 2.03 -1.26 -4.71 116.55 120.61 3gtg n ASP 2 Ca 0.00 -0.55 0.03 0.00 0.52 0.00 0.00 54.79 54.79 3gtg n ASP 2 Cb 0.00 0.39 -0.16 0.00 -0.72 0.00 0.00 41.12 40.63 3gtg n ASP 2 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3gtg n GLN 3 N -0.39 0.69 0.12 -0.67 3.00 -1.26 -3.87 117.38 115.00 3gtg n GLN 3 Ca 0.00 -0.13 0.12 0.00 -0.01 0.00 0.00 57.00 56.99 3gtg n GLN 3 Cb 0.04 -1.51 0.46 0.00 0.00 0.00 0.00 30.24 29.23 3gtg n GLN 3 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 3gtg n GLU 4 N -2.43 0.22 0.03 -1.09 4.71 -1.26 -0.09 120.64 120.72 3gtg n GLU 4 Ca -0.15 0.34 -0.06 0.00 -0.01 0.00 0.00 57.16 57.28 3gtg n GLU 4 Cb 0.78 -1.84 -0.12 0.00 -1.01 0.00 0.00 31.44 29.25 3gtg n GLU 4 CO 0.00 0.00 0.00 -0.91 0.09 0.00 0.00 177.13 176.31 3gtg h ASN 5 N 0.00 0.00 0.98 1.62 2.35 -1.85 -3.29 115.58 115.39 3gtg h ASN 5 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3gtg h ASN 5 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 3gtg h ASN 5 CO 0.00 0.93 -0.67 -0.08 -1.65 0.00 0.00 177.43 175.96 3gtg h GLU 6 N 0.00 0.00 0.00 0.81 4.22 -1.24 -3.15 114.58 115.22 3gtg h GLU 6 Ca -0.14 0.00 -0.37 0.00 0.08 0.00 0.00 59.36 58.93 3gtg h GLU 6 Cb 1.84 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 31.02 3gtg h GLU 6 CO 0.10 0.00 -2.38 0.54 -2.18 0.00 0.00 179.01 175.09 3gtg n ARG 7 N -2.32 0.69 0.30 1.92 1.74 0.87 -3.65 116.66 116.19 3gtg n ARG 7 Ca 0.02 0.00 0.16 0.00 -0.77 0.00 0.00 57.85 57.27 3gtg n ARG 7 Cb 0.47 -1.53 0.92 0.00 -1.02 0.00 0.00 32.46 31.30 3gtg n ARG 7 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 3gtg h ASN 8 N 0.00 0.00 0.00 0.55 -0.00 -1.65 -0.34 115.58 114.15 3gtg h ASN 8 Ca -0.54 0.00 -0.03 0.00 -0.00 0.00 0.00 56.30 55.72 3gtg h ASN 8 Cb 2.23 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 40.55 3gtg h ASN 8 CO 0.03 0.03 -0.27 -0.29 -0.00 0.00 0.00 177.43 176.92 3gtg h ILE 9 N 0.00 0.62 -0.90 2.57 2.10 -1.73 -2.80 117.51 117.38 3gtg h ILE 9 Ca -0.00 -1.53 0.25 0.00 1.08 0.00 0.00 64.86 64.65 3gtg h ILE 9 Cb 0.09 1.24 -0.15 0.00 -1.09 0.00 0.00 36.82 36.91 3gtg h ILE 9 CO 0.00 0.21 0.22 -1.28 -1.08 0.00 0.00 178.15 176.23 3gtg h SER 10 N -1.00 -0.05 0.12 2.19 0.87 -1.58 0.27 113.55 114.37 3gtg h SER 10 Ca -0.05 0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 3gtg h SER 10 Cb 0.55 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 3gtg h SER 10 CO -0.03 -0.20 -0.06 0.03 -0.53 0.00 0.00 176.83 176.05 3gtg h ARG 11 N 0.17 -0.16 -0.86 2.24 3.08 -1.22 -2.85 114.38 114.78 3gtg h ARG 11 Ca 0.57 0.01 0.23 0.00 0.07 0.00 0.00 59.98 60.87 3gtg h ARG 11 Cb 1.18 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 31.22 3gtg h ARG 11 CO -0.70 0.20 0.60 1.25 -1.07 0.00 0.00 179.97 180.26 3gtg h LEU 12 N -0.55 0.10 0.14 3.04 5.85 -0.69 0.15 115.31 123.35 3gtg h LEU 12 Ca -0.02 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3gtg h LEU 12 Cb 0.44 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.46 3gtg h LEU 12 CO 0.03 0.04 -0.07 -0.25 -0.34 0.00 0.00 178.44 177.85 3gtg h TRP 13 N 0.10 -0.17 0.00 1.25 7.01 -0.50 -2.51 115.95 121.12 3gtg h TRP 13 Ca 0.42 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.40 3gtg h TRP 13 Cb 1.50 0.06 -0.00 0.00 -2.10 0.00 0.00 29.16 28.62 3gtg h TRP 13 CO -0.00 0.17 -0.07 0.00 -2.79 0.00 0.00 178.44 175.75 3gtg h ARG 14 N -0.53 0.00 -0.37 2.65 3.08 -0.54 -0.94 114.38 117.73 3gtg h ARG 14 Ca -0.02 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 3gtg h ARG 14 Cb 0.41 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 3gtg h ARG 14 CO 0.03 0.07 0.05 0.00 -1.07 0.00 0.00 179.97 179.05 3gtg h ALA 15 N 1.93 0.50 0.35 0.04 0.00 -1.11 -1.98 119.26 118.98 3gtg h ALA 15 Ca -0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 3gtg h ALA 15 Cb 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3gtg h ALA 15 CO 0.01 0.21 -0.18 0.35 0.00 0.00 0.00 179.25 179.64 3gtg h PHE 16 N 0.46 -0.46 -0.86 0.00 3.57 -0.73 -1.57 116.94 117.35 3gtg h PHE 16 Ca 0.11 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.69 3gtg h PHE 16 Cb 0.37 0.16 -0.11 0.00 2.79 0.00 0.00 35.95 39.16 3gtg h PHE 16 CO 0.03 -0.28 -0.47 -2.13 -2.23 0.00 0.00 178.31 173.22 3gtg n ARG 17 N -3.34 -0.34 0.32 1.11 0.63 -0.87 -0.21 116.66 113.95 3gtg n ARG 17 Ca -0.06 1.30 0.19 0.00 -0.92 0.00 0.00 57.85 58.36 3gtg n ARG 17 Cb 0.19 -1.91 1.06 0.00 0.45 0.00 0.00 32.46 32.25 3gtg n ARG 17 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 3gtg h THR 18 N 0.00 0.20 -0.21 5.15 2.02 -1.27 0.50 112.91 119.30 3gtg h THR 18 Ca 0.17 -0.09 -0.15 0.00 0.77 0.00 0.00 66.41 67.11 3gtg h THR 18 Cb 0.38 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 3gtg h THR 18 CO -0.81 0.01 -0.44 0.58 0.37 0.00 0.00 175.52 175.23 3gtg h VAL 19 N 0.00 1.32 0.77 3.16 2.07 0.46 -3.22 116.25 120.81 3gtg h VAL 19 Ca -0.00 -1.66 -0.03 0.00 0.82 0.00 0.00 66.70 65.83 3gtg h VAL 19 Cb 0.07 1.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.66 3gtg h VAL 19 CO 0.00 0.52 -0.47 0.11 0.02 0.00 0.00 177.57 177.75 3gtg h LYS 20 N 0.37 -1.12 -0.91 1.57 1.79 -0.31 -1.72 116.57 116.26 3gtg h LYS 20 Ca 0.01 0.08 0.20 0.00 -2.18 0.00 0.00 60.65 58.75 3gtg h LYS 20 Cb 1.04 0.25 -0.17 0.00 -1.58 0.00 0.00 32.23 31.77 3gtg h LYS 20 CO 0.10 -0.74 -0.16 0.93 -1.08 0.00 0.00 179.45 178.50 3gtg h GLU 21 N -1.16 0.01 0.06 3.15 5.08 -1.57 0.52 114.58 120.68 3gtg h GLU 21 Ca -0.10 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3gtg h GLU 21 Cb 0.93 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.14 3gtg h GLU 21 CO 0.10 0.01 -0.25 1.98 -1.00 0.00 0.00 179.01 179.85 3gtg h MET 22 N 0.01 -0.41 -0.40 2.33 4.05 -1.48 -0.65 114.93 118.38 3gtg h MET 22 Ca 0.46 0.03 0.08 0.00 -0.28 0.00 0.00 59.70 59.99 3gtg h MET 22 Cb 0.77 0.09 -0.09 0.00 -0.80 0.00 0.00 31.60 31.57 3gtg h MET 22 CO -0.90 -0.28 -0.37 0.28 0.23 0.00 0.00 176.91 175.87 3gtg h VAL 23 N -0.43 0.18 -0.12 -5.77 2.07 0.95 0.51 116.25 113.63 3gtg h VAL 23 Ca 0.05 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.50 3gtg h VAL 23 Cb 0.48 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 3gtg h VAL 23 CO -0.18 0.00 -0.24 0.07 0.02 0.00 0.00 177.57 177.24 3gtg h LYS 24 N -0.28 0.21 0.00 1.57 2.10 -1.24 -1.30 116.57 117.63 3gtg h LYS 24 Ca 0.16 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 3gtg h LYS 24 Cb 0.56 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.87 3gtg h LYS 24 CO -0.56 0.44 0.00 -0.25 -2.00 0.00 0.00 179.45 177.09 3gtg n ASP 25 N -4.18 0.10 0.19 7.07 8.00 0.26 -0.11 116.55 127.87 3gtg n ASP 25 Ca -0.01 0.51 0.05 0.00 0.71 0.00 0.00 54.79 56.06 3gtg n ASP 25 Cb 0.34 -0.54 0.32 0.00 -0.02 0.00 0.00 41.12 41.22 3gtg n ASP 25 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3gtg h ARG 26 N 0.00 0.00 0.00 -1.24 2.47 0.11 -3.47 114.38 112.25 3gtg h ARG 26 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3gtg h ARG 26 Cb 0.48 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.80 3gtg h ARG 26 CO 0.00 0.38 0.00 0.41 0.56 0.00 0.00 179.97 181.32 3gtg n GLY 27 N 0.30 1.79 1.29 0.04 0.00 0.84 -5.08 105.19 104.37 3gtg n GLY 27 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3gtg n GLY 27 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3gtg n TYR 28 N 0.00 -3.20 -3.71 1.61 4.02 -1.02 -2.59 117.16 112.26 3gtg n TYR 28 Ca 0.00 -0.59 -0.39 0.00 -0.01 0.00 0.00 57.90 56.91 3gtg n TYR 28 Cb 0.00 -0.24 -0.12 0.00 -0.02 0.00 0.00 39.34 38.96 3gtg n TYR 28 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 3gtg s PHE 29 N -0.82 3.25 -0.18 -0.72 5.36 0.25 -4.09 117.98 121.04 3gtg s PHE 29 Ca 0.22 -1.30 -0.12 0.00 -0.96 0.00 0.00 56.93 54.77 3gtg s PHE 29 Cb -0.01 -2.33 0.06 0.00 -0.34 0.00 0.00 43.02 40.40 3gtg s PHE 29 CO 0.14 -0.71 0.44 0.42 -1.46 0.00 0.00 175.22 174.06 3gtg s ILE 30 N 1.44 -0.02 0.40 3.12 1.01 -1.26 -4.69 121.20 121.21 3gtg s ILE 30 Ca -0.01 0.06 -0.24 0.00 0.00 0.00 0.00 60.65 60.46 3gtg s ILE 30 Cb -0.19 -0.64 -0.09 0.00 0.01 0.00 0.00 42.46 41.55 3gtg s ILE 30 CO 0.04 0.02 1.06 0.28 0.00 0.00 0.00 174.94 176.34 3gtg s THR 31 N 1.05 3.67 -0.19 2.92 -1.32 -1.26 -4.94 115.64 115.57 3gtg s THR 31 Ca -0.07 1.28 0.29 0.00 -1.21 0.00 0.00 61.69 61.98 3gtg s THR 31 Cb -0.06 -3.66 0.32 0.00 -1.51 0.00 0.00 72.50 67.59 3gtg s THR 31 CO -0.09 0.00 1.85 -0.61 -2.21 0.00 0.00 174.62 173.57 3gtg h GLN 32 N 2.46 0.00 -0.03 7.08 5.75 -2.01 -1.91 115.11 126.45 3gtg h GLN 32 Ca -0.48 0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 57.87 3gtg h GLN 32 Cb 1.22 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.75 3gtg h GLN 32 CO 0.62 0.00 -0.64 1.49 -2.65 0.00 0.00 178.83 177.65 3gtg h GLU 33 N 0.00 0.11 -0.18 1.69 4.81 -1.93 -3.20 114.58 115.88 3gtg h GLU 33 Ca 0.00 -0.08 -0.12 0.00 -0.13 0.00 0.00 59.36 59.03 3gtg h GLU 33 Cb 0.43 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 3gtg h GLU 33 CO 0.00 0.71 -0.39 1.49 -0.73 0.00 0.00 179.01 180.09 3gtg h GLU 34 N 0.08 0.39 0.25 1.92 4.81 -1.73 -3.33 114.58 116.98 3gtg h GLU 34 Ca -0.01 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.02 3gtg h GLU 34 Cb 1.14 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.52 3gtg h GLU 34 CO 0.09 0.73 -0.12 0.28 -0.73 0.00 0.00 179.01 179.26 3gtg h VAL 35 N 0.33 0.00 0.00 0.32 2.07 -1.61 -3.33 116.25 114.03 3gtg h VAL 35 Ca 0.03 -0.32 -0.23 0.00 0.82 0.00 0.00 66.70 67.00 3gtg h VAL 35 Cb 0.84 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 3gtg h VAL 35 CO 0.07 0.00 1.10 -0.62 0.02 0.00 0.00 177.57 178.14 3gtg n GLU 36 N -3.79 1.61 -3.14 1.57 1.02 -1.21 -4.79 120.64 111.92 3gtg n GLU 36 Ca -0.04 -0.98 -0.40 0.00 -0.02 0.00 0.00 57.16 55.72 3gtg n GLU 36 Cb 0.13 -2.08 -0.06 0.00 -0.02 0.00 0.00 31.44 29.41 3gtg n GLU 36 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3gtg s LEU 37 N 0.04 4.08 1.27 -4.62 2.96 -1.25 -4.98 118.68 116.18 3gtg s LEU 37 Ca 0.41 0.70 -0.20 0.00 -0.22 0.00 0.00 54.13 54.82 3gtg s LEU 37 Cb 0.16 -2.83 0.31 0.00 0.50 0.00 0.00 46.19 44.33 3gtg s LEU 37 CO -0.01 -0.33 1.04 -2.84 -1.32 0.00 0.00 176.35 172.89 3gtg s PRO 38 N 2.32 -1.76 0.12 0.98 0.02 -1.26 -4.91 135.00 130.52 3gtg s PRO 38 Ca 0.26 0.08 -0.11 0.00 0.02 0.00 0.00 61.00 61.24 3gtg s PRO 38 Cb -0.16 -1.52 -0.10 0.00 0.02 0.00 0.00 34.50 32.75 3gtg s PRO 38 CO 0.09 -4.09 1.38 1.25 -0.33 0.00 0.00 177.00 175.30 3gtg h LEU 39 N -2.86 0.96-10.09 -5.54 5.85 -1.98 -3.27 115.31 98.38 3gtg h LEU 39 Ca -0.46 -0.55 -0.55 0.00 0.84 0.00 0.00 57.88 57.16 3gtg h LEU 39 Cb 1.31 -0.28 0.14 0.00 0.37 0.00 0.00 40.66 42.21 3gtg h LEU 39 CO 0.34 1.35 0.53 -1.61 -0.34 0.00 0.00 178.44 178.71 3gtg s GLU 40 N -4.02 2.82 0.00 1.25 0.41 -1.26 -0.93 118.70 116.97 3gtg s GLU 40 Ca -0.10 2.05 0.00 0.00 -0.41 0.00 0.00 54.97 56.51 3gtg s GLU 40 Cb 0.10 -1.98 0.00 0.00 -1.78 0.00 0.00 34.13 30.47 3gtg s GLU 40 CO 0.89 -1.38 0.00 -0.25 -0.49 0.00 0.00 175.26 174.03 3gtg n ASP 41 N -1.58 0.00 0.27 -0.19 8.00 -1.26 -4.51 116.55 117.28 3gtg n ASP 41 Ca 0.14 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.78 3gtg n ASP 41 Cb 0.48 0.00 0.73 0.00 -0.02 0.00 0.00 41.12 42.31 3gtg n ASP 41 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 3gtg h PHE 42 N 0.00 0.00 -0.67 1.24 3.57 -1.60 -2.14 116.94 117.34 3gtg h PHE 42 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3gtg h PHE 42 Cb 0.00 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 3gtg h PHE 42 CO 0.00 0.11 0.43 -0.22 -2.23 0.00 0.00 178.31 176.40 3gtg h LYS 43 N 0.00 0.89 0.00 1.11 3.64 -1.26 -3.39 116.57 117.56 3gtg h LYS 43 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3gtg h LYS 43 Cb 0.37 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 3gtg h LYS 43 CO 0.01 0.60 0.00 0.00 -2.27 0.00 0.00 179.45 177.80 3gtg n ALA 44 N -2.43 0.00 0.00 5.00 0.00 -0.80 -4.45 120.51 117.82 3gtg n ALA 44 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3gtg n ALA 44 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 3gtg n ALA 44 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3gtg n LYS 45 N -0.30 0.00 0.00 0.00 4.81 -1.25 -4.27 118.16 117.15 3gtg n LYS 45 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3gtg n LYS 45 Cb 0.00 -1.06 0.00 0.00 0.02 0.00 0.00 35.03 33.99 3gtg n LYS 45 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3gtg n TYR 46 N -0.77 0.00 -3.73 5.64 4.02 -1.26 -5.03 117.16 116.03 3gtg n TYR 46 Ca 0.00 -0.01 -0.22 0.00 -0.01 0.00 0.00 57.90 57.66 3gtg n TYR 46 Cb 0.00 -0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.28 3gtg n TYR 46 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3gtg n ASP 48 N -1.49 0.00 -0.04 0.00 10.43 -0.97 -4.88 116.55 119.62 3gtg n ASP 48 Ca 0.02 -0.55 0.00 0.00 2.57 0.00 0.00 54.79 56.83 3gtg n ASP 48 Cb 0.63 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.59 3gtg n ASP 48 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 3gtg n SER 49 N -1.64 0.03 0.00 -2.24 2.88 -1.26 -3.78 113.62 107.61 3gtg n SER 49 Ca 0.00 -0.72 0.00 0.00 -1.33 0.00 0.00 58.87 56.82 3gtg n SER 49 Cb 0.00 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.45 3gtg n SER 49 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 3gtg n MET 50 N -0.44 0.00 0.00 -1.46 0.00 -1.26 -5.06 117.12 108.90 3gtg n MET 50 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 3gtg n MET 50 Cb 0.01 -0.49 0.00 0.00 0.00 0.00 0.00 33.22 32.74 3gtg n MET 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3gtg n GLY 51 N 1.77 -0.27 3.67 -5.12 0.00 -1.25 -5.14 105.19 98.85 3gtg n GLY 51 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3gtg n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gtg s ARG 52 N 0.00 4.31 -0.19 1.61 0.52 -1.26 -4.81 118.95 119.13 3gtg s ARG 52 Ca 0.00 1.42 -0.29 0.00 -0.52 0.00 0.00 55.73 56.34 3gtg s ARG 52 Cb 0.00 -3.62 -0.02 0.00 0.52 0.00 0.00 34.95 31.83 3gtg s ARG 52 CO 0.00 -0.54 1.37 -2.14 0.02 0.00 0.00 175.30 174.01 3gtg s PRO 53 N 2.85 4.09 -0.30 3.54 0.02 -1.26 -2.28 135.00 141.65 3gtg s PRO 53 Ca 0.47 1.64 -0.11 0.00 0.02 0.00 0.00 61.00 63.02 3gtg s PRO 53 Cb -0.17 -3.86 -0.03 0.00 0.02 0.00 0.00 34.50 30.46 3gtg s PRO 53 CO 0.11 -0.90 0.19 -1.14 -0.33 0.00 0.00 177.00 174.93 3gtg s GLN 54 N 3.89 3.68 -0.04 5.54 2.00 -0.23 -4.98 119.66 129.51 3gtg s GLN 54 Ca 0.60 -0.51 -0.22 0.00 -2.00 0.00 0.00 55.36 53.24 3gtg s GLN 54 Cb -0.23 -3.67 -0.31 0.00 0.80 0.00 0.00 33.01 29.60 3gtg s GLN 54 CO 0.21 -0.31 0.91 0.00 -0.50 0.00 0.00 175.29 175.60 3gtg h ARG 55 N 8.40 0.31 0.00 1.67 3.08 -1.92 -3.19 114.38 122.73 3gtg h ARG 55 Ca -0.34 -0.51 0.00 0.00 0.07 0.00 0.00 59.98 59.20 3gtg h ARG 55 Cb 1.17 0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.41 3gtg h ARG 55 CO 0.59 1.24 0.12 1.63 -1.07 0.00 0.00 179.97 182.48 3gtg n LYS 56 N -4.13 0.09 0.06 0.04 5.02 -1.26 -0.76 118.16 117.23 3gtg n LYS 56 Ca -0.14 0.57 0.01 0.00 -2.02 0.00 0.00 58.31 56.73 3gtg n LYS 56 Cb 0.82 -1.93 -0.05 0.00 -0.02 0.00 0.00 35.03 33.84 3gtg n LYS 56 CO 0.00 0.00 0.00 1.98 -0.52 0.00 0.00 177.40 178.86 3gtg h MET 57 N 0.00 0.00 0.00 1.97 4.05 -1.92 -3.36 114.93 115.67 3gtg h MET 57 Ca 0.00 0.00 -0.20 0.00 -0.28 0.00 0.00 59.70 59.22 3gtg h MET 57 Cb 0.24 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.03 3gtg h MET 57 CO 0.00 0.36 -0.88 0.52 0.23 0.00 0.00 176.91 177.13 3gtg h MET 58 N 0.00 0.22 -6.09 0.39 2.86 -1.06 -3.47 114.93 107.77 3gtg h MET 58 Ca -0.11 -0.24 -0.71 0.00 -2.06 0.00 0.00 59.70 56.58 3gtg h MET 58 Cb 1.53 0.07 0.08 0.00 0.06 0.00 0.00 31.60 33.34 3gtg h MET 58 CO 0.05 0.97 -0.11 0.43 1.06 0.00 0.00 176.91 179.31 3gtg n SER 59 N -3.67 -0.12 -3.74 1.22 7.64 -1.24 -5.00 113.62 108.72 3gtg n SER 59 Ca -0.04 1.14 -0.14 0.00 1.01 0.00 0.00 58.87 60.85 3gtg n SER 59 Cb 0.81 -1.01 -0.08 0.00 -1.01 0.00 0.00 64.21 62.92 3gtg n SER 59 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 3gtg s PHE 60 N -0.46 -0.22 0.77 1.43 -0.12 -0.78 -5.01 117.98 113.59 3gtg s PHE 60 Ca 0.76 0.33 -0.12 0.00 -0.05 0.00 0.00 56.93 57.85 3gtg s PHE 60 Cb -1.02 0.12 0.05 0.00 -0.63 0.00 0.00 43.02 41.54 3gtg s PHE 60 CO 0.56 -0.42 1.14 1.14 -0.05 0.00 0.00 175.22 177.59 3gtg s GLN 61 N -1.37 2.33 0.04 1.99 -2.07 -1.26 -0.71 119.66 118.60 3gtg s GLN 61 Ca -0.13 0.27 0.02 0.00 -1.82 0.00 0.00 55.36 53.70 3gtg s GLN 61 Cb -0.05 -1.98 -0.02 0.00 -1.09 0.00 0.00 33.01 29.87 3gtg s GLN 61 CO 0.04 -1.37 -0.07 0.00 -1.32 0.00 0.00 175.29 172.57 3gtg s ALA 62 N -3.47 0.51 0.04 2.60 0.00 0.65 -4.86 121.76 117.22 3gtg s ALA 62 Ca 0.60 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.88 3gtg s ALA 62 Cb -0.11 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 3gtg s ALA 62 CO 0.50 -0.03 -0.11 -0.80 0.00 0.00 0.00 175.76 175.32 3gtg s ASN 63 N -1.50 1.28 0.11 0.00 0.01 -1.26 -2.81 114.94 110.77 3gtg s ASN 63 Ca -0.10 -0.45 -0.25 0.00 -0.71 0.00 0.00 52.86 51.35 3gtg s ASN 63 Cb -0.10 -0.05 -0.07 0.00 0.41 0.00 0.00 41.25 41.44 3gtg s ASN 63 CO 0.00 -0.04 0.77 -2.16 -1.51 0.00 0.00 177.10 174.16 3gtg s PRO 64 N -1.18 4.52 0.35 -0.60 0.04 -1.26 0.86 135.00 137.73 3gtg s PRO 64 Ca -0.02 1.10 -0.26 0.00 0.04 0.00 0.00 61.00 61.86 3gtg s PRO 64 Cb -0.08 -3.31 -0.13 0.00 0.04 0.00 0.00 34.50 31.03 3gtg s PRO 64 CO 0.01 0.45 0.97 -2.37 0.04 0.00 0.00 177.00 176.10 3gtg n THR 65 N 2.13 2.13 0.23 1.26 5.66 -1.07 -4.74 114.28 119.89 3gtg n THR 65 Ca -0.04 -0.50 0.18 0.00 -3.05 0.00 0.00 64.05 60.63 3gtg n THR 65 Cb 0.49 -1.03 0.87 0.00 -1.55 0.00 0.00 70.33 69.12 3gtg n THR 65 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 3gtg h GLU 66 N 1.72 0.00 0.00 1.09 3.07 -1.95 0.30 114.58 118.81 3gtg h GLU 66 Ca -0.42 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.44 3gtg h GLU 66 Cb 1.34 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.25 3gtg h GLU 66 CO 0.58 0.00 -0.00 1.49 -1.40 0.00 0.00 179.01 179.68 3gtg h GLU 67 N 0.00 0.00 0.05 2.33 4.81 -1.94 -3.31 114.58 116.51 3gtg h GLU 67 Ca 0.07 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3gtg h GLU 67 Cb 0.49 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.88 3gtg h GLU 67 CO -0.00 0.00 -0.02 0.77 -0.73 0.00 0.00 179.01 179.03 3gtg h SER 68 N 0.00 -0.06 0.00 1.04 0.02 -0.67 -3.20 113.55 110.68 3gtg h SER 68 Ca -0.00 -0.52 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 3gtg h SER 68 Cb 0.49 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.04 3gtg h SER 68 CO 0.00 0.52 0.31 -0.38 -1.14 0.00 0.00 176.83 176.14 3gtg n ILE 69 N -4.85 0.59 -0.03 3.27 2.08 -1.24 -0.14 119.36 119.05 3gtg n ILE 69 Ca -0.09 0.75 -0.14 0.00 0.56 0.00 0.00 62.75 63.83 3gtg n ILE 69 Cb 0.29 -1.75 -0.11 0.00 -0.75 0.00 0.00 39.64 37.32 3gtg n ILE 69 CO 0.00 0.00 0.00 -1.28 0.56 0.00 0.00 176.55 175.83 3gtg h SER 70 N 0.00 0.17 0.37 4.38 0.87 -1.74 -3.15 113.55 114.45 3gtg h SER 70 Ca 0.00 -0.72 -0.31 0.00 -1.23 0.00 0.00 61.79 59.52 3gtg h SER 70 Cb 0.63 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.49 3gtg h SER 70 CO 0.00 0.87 -1.86 0.29 -0.53 0.00 0.00 176.83 175.60 3gtg n LYS 71 N -4.59 0.65 -3.77 2.24 5.02 -0.37 -4.74 118.16 112.61 3gtg n LYS 71 Ca -0.09 0.24 -0.30 0.00 -2.02 0.00 0.00 58.31 56.14 3gtg n LYS 71 Cb 0.44 -1.74 -0.14 0.00 -0.02 0.00 0.00 35.03 33.57 3gtg n LYS 71 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3gtg s PHE 72 N -2.58 2.14 -0.71 2.13 0.40 0.81 -4.90 117.98 115.27 3gtg s PHE 72 Ca -0.07 -2.25 0.00 0.00 -0.60 0.00 0.00 56.93 54.01 3gtg s PHE 72 Cb 0.08 -1.99 0.00 0.00 0.51 0.00 0.00 43.02 41.62 3gtg s PHE 72 CO 0.82 -0.84 0.63 -2.30 0.70 0.00 0.00 175.22 174.23 3gtg n PRO 73 N 4.16 0.99 -0.06 0.24 -0.02 -1.19 -3.61 135.00 135.50 3gtg n PRO 73 Ca 0.04 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.43 3gtg n PRO 73 Cb 0.38 -1.35 -0.06 0.00 -0.02 0.00 0.00 33.50 32.45 3gtg n PRO 73 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3gtg n ASP 74 N 0.15 2.90 -4.77 2.55 9.92 -1.26 -4.98 116.55 121.06 3gtg n ASP 74 Ca 0.00 -0.05 -0.38 0.00 -0.53 0.00 0.00 54.79 53.82 3gtg n ASP 74 Cb 0.32 -0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.79 3gtg n ASP 74 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 3gtg s MET 75 N -2.25 3.96 0.00 -1.24 -2.45 -1.24 -4.87 119.30 111.21 3gtg s MET 75 Ca -0.15 1.94 0.00 0.00 -1.25 0.00 0.00 55.69 56.24 3gtg s MET 75 Cb 0.04 -2.66 0.00 0.00 1.25 0.00 0.00 34.83 33.46 3gtg s MET 75 CO 0.32 -0.43 0.00 0.41 1.05 0.00 0.00 175.02 176.37 3gtg n GLY 76 N 0.63 -0.19 2.59 2.11 0.00 -1.26 -4.88 105.19 104.20 3gtg n GLY 76 Ca 0.05 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 3gtg n GLY 76 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gtg s SER 77 N -1.56 3.44 0.03 1.61 0.01 -1.26 -4.11 113.70 111.86 3gtg s SER 77 Ca 0.00 -2.01 0.03 0.00 1.31 0.00 0.00 55.95 55.28 3gtg s SER 77 Cb 0.00 -0.63 -0.04 0.00 0.21 0.00 0.00 66.02 65.57 3gtg s SER 77 CO 0.00 -0.35 -0.02 -0.22 0.41 0.00 0.00 173.24 173.07 3gtg s LEU 78 N 1.21 3.42 -0.03 2.44 0.20 -1.12 -1.33 118.68 123.47 3gtg s LEU 78 Ca 0.15 -0.10 0.01 0.00 0.69 0.00 0.00 54.13 54.87 3gtg s LEU 78 Cb -0.21 -2.03 0.02 0.00 -0.43 0.00 0.00 46.19 43.54 3gtg s LEU 78 CO -0.12 0.24 -0.01 0.86 -0.29 0.00 0.00 176.35 177.04 3gtg s TRP 79 N -1.15 0.32 -0.07 5.38 -0.11 -0.77 0.24 118.94 122.78 3gtg s TRP 79 Ca 0.21 -0.01 0.00 0.00 1.22 0.00 0.00 56.10 57.52 3gtg s TRP 79 Cb -0.11 -0.38 -0.03 0.00 -1.50 0.00 0.00 33.47 31.45 3gtg s TRP 79 CO 0.12 -0.11 -0.06 0.08 -4.62 0.00 0.00 176.95 172.37 3gtg s VAL 80 N 0.85 3.81 0.03 5.86 1.01 0.11 -1.59 120.40 130.48 3gtg s VAL 80 Ca -0.09 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.48 3gtg s VAL 80 Cb -0.12 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 3gtg s VAL 80 CO -0.01 0.60 -0.09 -1.61 0.00 0.00 0.00 175.10 173.98 3gtg s GLU 81 N -0.79 0.61 0.19 2.72 2.02 -0.91 -1.86 118.70 120.69 3gtg s GLU 81 Ca 0.12 -0.62 0.08 0.00 0.02 0.00 0.00 54.97 54.57 3gtg s GLU 81 Cb -0.11 -0.50 -0.04 0.00 0.10 0.00 0.00 34.13 33.57 3gtg s GLU 81 CO 0.02 0.12 -0.01 -0.06 0.02 0.00 0.00 175.26 175.34 3gtg s PHE 82 N -0.93 2.79 -0.00 1.61 0.40 -1.26 -1.45 117.98 119.15 3gtg s PHE 82 Ca -0.04 -0.16 -0.00 0.00 -0.60 0.00 0.00 56.93 56.13 3gtg s PHE 82 Cb -0.07 -1.33 -0.00 0.00 0.51 0.00 0.00 43.02 42.12 3gtg s PHE 82 CO 0.01 0.53 0.01 0.00 0.70 0.00 0.00 175.22 176.47 3gtg h ASP 84 N 6.04 0.74 -2.45 0.00 5.19 -1.94 -3.41 116.42 120.59 3gtg h ASP 84 Ca -0.25 -0.41 -0.56 0.00 -0.62 0.00 0.00 57.03 55.20 3gtg h ASP 84 Cb 1.21 -0.21 -0.00 0.00 0.18 0.00 0.00 39.33 40.50 3gtg h ASP 84 CO 0.50 1.16 1.23 -1.61 -3.12 0.00 0.00 179.24 177.40 3gtg s GLU 85 N -3.98 3.85 0.03 3.56 2.02 -1.26 -4.94 118.70 117.97 3gtg s GLU 85 Ca -0.08 2.15 -0.19 0.00 0.02 0.00 0.00 54.97 56.87 3gtg s GLU 85 Cb 0.11 -4.14 -0.10 0.00 0.10 0.00 0.00 34.13 30.09 3gtg s GLU 85 CO 0.86 -1.26 1.28 -1.35 0.02 0.00 0.00 175.26 174.81 3gtg h PRO 86 N 11.35 -0.65 -6.51 0.39 0.11 -1.96 -3.43 132.00 131.30 3gtg h PRO 86 Ca -0.42 0.04 -0.53 0.00 0.11 0.00 0.00 66.00 65.21 3gtg h PRO 86 Cb 1.20 0.15 0.01 0.00 0.11 0.00 0.00 31.00 32.47 3gtg h PRO 86 CO 0.96 -0.43 0.56 0.45 -0.21 0.00 0.00 178.00 179.33 3gtg s SER 87 N -3.00 7.08 -0.29 -2.05 0.15 -1.26 -3.86 113.70 110.46 3gtg s SER 87 Ca -0.10 2.05 0.00 0.00 0.70 0.00 0.00 55.95 58.61 3gtg s SER 87 Cb 0.01 -2.58 0.09 0.00 -1.71 0.00 0.00 66.02 61.83 3gtg s SER 87 CO 0.30 -0.45 0.06 0.68 1.20 0.00 0.00 173.24 175.02 3gtg s VAL 88 N 0.88 1.27 0.00 4.45 -7.23 -1.21 -5.05 120.40 113.51 3gtg s VAL 88 Ca 0.58 -1.52 0.00 0.00 -1.81 0.00 0.00 61.98 59.23 3gtg s VAL 88 Cb -0.30 -1.87 0.00 0.00 0.56 0.00 0.00 36.38 34.77 3gtg s VAL 88 CO 0.30 -0.53 0.00 0.61 -0.31 0.00 0.00 175.10 175.18 3gtg n GLY 89 N 4.70 1.46 0.17 2.32 0.00 -1.26 -1.38 105.19 111.20 3gtg n GLY 89 Ca -0.03 -1.90 0.13 0.00 0.00 0.00 0.00 46.02 44.22 3gtg n GLY 89 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3gtg h VAL 90 N 0.00 0.00 -0.13 1.61 3.04 -1.91 -3.25 116.25 115.61 3gtg h VAL 90 Ca 0.00 -0.48 -0.09 0.00 -1.01 0.00 0.00 66.70 65.11 3gtg h VAL 90 Cb 0.00 1.39 0.00 0.00 -2.01 0.00 0.00 31.29 30.67 3gtg h VAL 90 CO 0.00 0.00 -0.29 0.11 -1.01 0.00 0.00 177.57 176.38 3gtg h LYS 91 N 0.00 0.42 0.00 4.17 1.57 -1.94 -3.30 116.57 117.50 3gtg h LYS 91 Ca 0.00 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 3gtg h LYS 91 Cb 0.60 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3gtg h LYS 91 CO 0.00 0.89 0.00 1.15 -0.57 0.00 0.00 179.45 180.92 3gtg h THR 92 N 0.02 0.00 -0.28 -0.16 2.02 -1.94 -3.27 112.91 109.30 3gtg h THR 92 Ca 0.00 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.43 3gtg h THR 92 Cb 0.89 1.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.98 3gtg h THR 92 CO 0.06 0.00 0.01 -0.03 0.37 0.00 0.00 175.52 175.94 3gtg h MET 93 N 0.00 0.49 -0.98 6.66 1.85 -1.63 -2.78 114.93 118.54 3gtg h MET 93 Ca 0.00 -0.15 0.00 0.00 -0.61 0.00 0.00 59.70 58.94 3gtg h MET 93 Cb 0.83 -0.05 0.00 0.00 0.43 0.00 0.00 31.60 32.81 3gtg h MET 93 CO 0.00 0.64 0.00 1.63 -0.40 0.00 0.00 176.91 178.78 3gtg n LYS 94 N -4.60 0.97 -0.09 0.39 4.76 -1.23 -2.78 118.16 115.57 3gtg n LYS 94 Ca -0.03 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.29 3gtg n LYS 94 Cb 0.24 -1.40 -0.10 0.00 -1.84 0.00 0.00 35.03 31.93 3gtg n LYS 94 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 3gtg n THR 95 N 0.10 1.13 -0.07 -0.18 -1.04 -1.05 -4.48 114.28 108.70 3gtg n THR 95 Ca 0.00 -0.50 -0.11 0.00 -2.04 0.00 0.00 64.05 61.40 3gtg n THR 95 Cb 0.29 -1.04 -0.15 0.00 -1.82 0.00 0.00 70.33 67.61 3gtg n THR 95 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 3gtg n PHE 96 N -2.95 0.42 -0.03 -1.42 7.35 -1.14 -3.29 117.46 116.40 3gtg n PHE 96 Ca -0.33 0.14 -0.11 0.00 -0.76 0.00 0.00 57.45 56.39 3gtg n PHE 96 Cb 0.91 -1.07 -0.05 0.00 0.35 0.00 0.00 39.48 39.62 3gtg n PHE 96 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3gtg h VAL 97 N 0.00 1.13 -0.44 -2.13 2.07 -1.81 -2.94 116.25 112.13 3gtg h VAL 97 Ca -0.45 -0.37 0.04 0.00 0.82 0.00 0.00 66.70 66.74 3gtg h VAL 97 Cb 2.13 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 32.95 3gtg h VAL 97 CO 0.04 0.12 0.21 0.40 0.02 0.00 0.00 177.57 178.35 3gtg h ILE 98 N 0.11 0.94 -0.57 4.57 1.08 -1.79 0.04 117.51 121.90 3gtg h ILE 98 Ca 0.05 -0.14 0.11 0.00 -0.39 0.00 0.00 64.86 64.49 3gtg h ILE 98 Cb 0.12 0.49 -0.11 0.00 -3.07 0.00 0.00 36.82 34.26 3gtg h ILE 98 CO -0.01 0.08 -0.22 -0.74 -0.69 0.00 0.00 178.15 176.57 3gtg h HIS 99 N 0.41 -0.56 -0.06 1.37 2.76 -1.52 -2.74 115.15 114.82 3gtg h HIS 99 Ca 0.19 0.06 -0.04 0.00 -2.20 0.00 0.00 60.37 58.39 3gtg h HIS 99 Cb 0.12 0.33 -0.00 0.00 1.55 0.00 0.00 27.41 29.41 3gtg h HIS 99 CO -0.11 -0.31 -0.10 0.82 -1.30 0.00 0.00 177.93 176.92 3gtg h ILE 100 N -0.08 1.40 -1.00 6.26 2.04 -1.29 -3.15 117.51 121.70 3gtg h ILE 100 Ca 0.26 -1.36 0.14 0.00 1.00 0.00 0.00 64.86 64.90 3gtg h ILE 100 Cb 0.49 2.17 -0.15 0.00 -0.74 0.00 0.00 36.82 38.58 3gtg h ILE 100 CO -0.63 0.38 -0.42 1.67 0.00 0.00 0.00 178.15 179.15 3gtg n GLN 101 N -4.67 -0.26 0.08 2.37 7.27 -0.04 -1.70 117.38 120.43 3gtg n GLN 101 Ca -0.08 1.53 -0.13 0.00 0.07 0.00 0.00 57.00 58.39 3gtg n GLN 101 Cb 0.34 -2.27 -0.13 0.00 2.41 0.00 0.00 30.24 30.59 3gtg n GLN 101 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 3gtg h GLU 102 N 0.00 0.18 0.00 3.69 5.08 -1.64 -3.25 114.58 118.63 3gtg h GLU 102 Ca 0.32 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3gtg h GLU 102 Cb 0.57 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3gtg h GLU 102 CO -0.98 1.13 0.00 1.63 -1.00 0.00 0.00 179.01 179.79 3gtg n LYS 103 N -3.46 0.07 -3.27 2.33 5.02 -0.83 -4.93 118.16 113.09 3gtg n LYS 103 Ca -0.06 0.23 -0.15 0.00 -2.02 0.00 0.00 58.31 56.31 3gtg n LYS 103 Cb 1.00 -1.61 0.08 0.00 -0.02 0.00 0.00 35.03 34.48 3gtg n LYS 103 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3gtg n ASN 104 N -1.74 -2.29 -2.68 4.39 4.05 -0.69 -5.05 115.26 111.25 3gtg n ASN 104 Ca 0.04 -0.54 0.00 0.00 0.45 0.00 0.00 54.58 54.53 3gtg n ASN 104 Cb 0.24 -4.57 0.00 0.00 1.23 0.00 0.00 39.78 36.68 3gtg n ASN 104 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 3gtg n PHE 105 N -3.82 -0.30 0.00 1.20 3.01 -1.23 -4.95 117.46 111.37 3gtg n PHE 105 Ca -0.24 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.22 3gtg n PHE 105 Cb 0.64 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.11 3gtg n PHE 105 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3gtg n GLN 106 N -0.08 0.00 -4.37 -1.08 6.02 -0.44 -4.84 117.38 112.59 3gtg n GLN 106 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.74 3gtg n GLN 106 Cb 0.00 -0.40 -0.17 0.00 1.02 0.00 0.00 30.24 30.69 3gtg n GLN 106 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3gtg s THR 107 N -1.00 1.08 -0.25 5.09 2.01 -1.21 0.42 115.64 121.78 3gtg s THR 107 Ca 0.00 -0.41 0.03 0.00 0.31 0.00 0.00 61.69 61.62 3gtg s THR 107 Cb 0.00 -1.02 0.05 0.00 0.01 0.00 0.00 72.50 71.54 3gtg s THR 107 CO 0.00 0.35 -0.12 -0.83 -0.69 0.00 0.00 174.62 173.33 3gtg s GLY 108 N 0.98 1.59 -0.32 4.40 0.00 -0.73 -1.84 107.32 111.38 3gtg s GLY 108 Ca -0.09 -1.65 -0.16 0.00 0.00 0.00 0.00 44.72 42.82 3gtg s GLY 108 CO 0.00 0.58 0.39 -0.42 0.00 0.00 0.00 173.10 173.65 3gtg s ILE 109 N 1.15 5.15 -0.23 0.90 -1.09 -0.62 -0.82 121.20 125.63 3gtg s ILE 109 Ca -0.07 0.23 -0.06 0.00 -2.23 0.00 0.00 60.65 58.52 3gtg s ILE 109 Cb -0.19 -3.81 -0.02 0.00 -1.58 0.00 0.00 42.46 36.86 3gtg s ILE 109 CO -0.06 -0.05 0.03 0.12 -1.23 0.00 0.00 174.94 173.75 3gtg s PHE 110 N 2.09 3.06 -0.38 3.97 5.99 -0.74 -2.13 117.98 129.83 3gtg s PHE 110 Ca 0.14 -0.51 -0.04 0.00 0.00 0.00 0.00 56.93 56.52 3gtg s PHE 110 Cb -0.16 -2.17 0.09 0.00 0.00 0.00 0.00 43.02 40.78 3gtg s PHE 110 CO 0.11 -0.35 0.16 0.08 -0.00 0.00 0.00 175.22 175.23 3gtg s VAL 111 N 1.40 3.38 0.00 3.12 1.01 -0.53 -1.69 120.40 127.10 3gtg s VAL 111 Ca 0.05 -1.77 0.00 0.00 0.00 0.00 0.00 61.98 60.26 3gtg s VAL 111 Cb -0.15 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.05 3gtg s VAL 111 CO 0.02 -0.51 0.00 0.00 0.00 0.00 0.00 175.10 174.61 3gtg n TYR 112 N 4.66 0.00 -0.09 5.22 0.18 -1.17 -2.64 117.16 123.32 3gtg n TYR 112 Ca -0.06 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.72 3gtg n TYR 112 Cb 0.42 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.38 3gtg n TYR 112 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3gtg n GLN 113 N 0.00 1.44 0.00 -3.48 10.64 -1.26 -3.60 117.38 121.13 3gtg n GLN 113 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 3gtg n GLN 113 Cb 0.00 -0.12 0.00 0.00 -0.86 0.00 0.00 30.24 29.26 3gtg n GLN 113 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3gtg n ASN 114 N 0.00 0.00 -3.53 2.61 3.02 -1.26 -4.81 115.26 111.29 3gtg n ASN 114 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.41 3gtg n ASN 114 Cb 0.00 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 3gtg n ASN 114 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3gtg s ASN 115 N 0.10 -0.49 0.15 6.41 2.20 -1.25 -5.01 114.94 117.05 3gtg s ASN 115 Ca 0.00 0.20 -0.09 0.00 -0.94 0.00 0.00 52.86 52.03 3gtg s ASN 115 Cb 0.00 0.52 -0.06 0.00 -2.00 0.00 0.00 41.25 39.71 3gtg s ASN 115 CO 0.00 -0.76 0.47 -0.63 -2.94 0.00 0.00 177.10 173.24 3gtg s ILE 116 N -2.59 5.02 0.11 0.54 -1.09 -1.26 -3.29 121.20 118.64 3gtg s ILE 116 Ca -0.04 0.43 -0.23 0.00 -2.23 0.00 0.00 60.65 58.57 3gtg s ILE 116 Cb -0.01 -3.65 -0.07 0.00 -1.58 0.00 0.00 42.46 37.16 3gtg s ILE 116 CO -0.03 0.11 0.70 0.42 -1.23 0.00 0.00 174.94 174.92 3gtg s THR 117 N -1.60 4.56 -0.47 2.92 -4.23 -0.48 -4.95 115.64 111.39 3gtg s THR 117 Ca 0.40 1.53 0.06 0.00 -1.18 0.00 0.00 61.69 62.50 3gtg s THR 117 Cb -0.13 -4.05 0.06 0.00 1.34 0.00 0.00 72.50 69.72 3gtg s THR 117 CO 0.21 0.50 1.08 -2.65 -0.54 0.00 0.00 174.62 173.22 3gtg n PRO 118 N 1.87 0.04 0.09 3.99 -0.02 -1.26 0.21 135.00 139.93 3gtg n PRO 118 Ca -0.07 0.45 0.13 0.00 -2.02 0.00 0.00 63.50 61.99 3gtg n PRO 118 Cb 0.50 -1.80 0.33 0.00 -0.02 0.00 0.00 33.50 32.51 3gtg n PRO 118 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3gtg n SER 119 N -1.65 0.78 -0.03 2.55 2.88 -1.26 -3.51 113.62 113.37 3gtg n SER 119 Ca -0.00 0.42 0.04 0.00 -1.33 0.00 0.00 58.87 57.99 3gtg n SER 119 Cb 0.17 -0.47 -0.15 0.00 -0.75 0.00 0.00 64.21 63.00 3gtg n SER 119 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3gtg n ALA 120 N -1.80 2.33 1.16 -1.46 0.00 0.13 -4.38 120.51 116.48 3gtg n ALA 120 Ca 0.05 -0.77 0.14 0.00 0.00 0.00 0.00 53.44 52.85 3gtg n ALA 120 Cb 0.43 -0.60 0.53 0.00 0.00 0.00 0.00 19.45 19.81 3gtg n ALA 120 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3gtg n MET 121 N -2.47 0.25 0.08 0.00 2.81 -1.10 -3.51 117.12 113.17 3gtg n MET 121 Ca -0.13 -0.08 -0.09 0.00 -1.81 0.00 0.00 57.70 55.59 3gtg n MET 121 Cb 0.77 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.79 3gtg n MET 121 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 3gtg h LYS 122 N 0.19 0.26 -1.45 0.03 1.63 -1.76 -3.31 116.57 112.16 3gtg h LYS 122 Ca 0.00 -0.26 -0.64 0.00 -0.85 0.00 0.00 60.65 58.91 3gtg h LYS 122 Cb 0.44 0.07 -0.25 0.00 -0.60 0.00 0.00 32.23 31.89 3gtg h LYS 122 CO 0.00 0.95 0.82 1.28 -3.45 0.00 0.00 179.45 179.06 3gtg n LEU 123 N -3.72 7.38 -0.06 5.20 7.99 -1.23 -4.66 117.00 127.90 3gtg n LEU 123 Ca -0.04 -4.29 -0.05 0.00 -0.01 0.00 0.00 56.01 51.63 3gtg n LEU 123 Cb 0.77 -1.04 -0.02 0.00 -0.11 0.00 0.00 43.42 43.03 3gtg n LEU 123 CO 0.48 1.54 -0.35 0.52 -1.51 0.00 0.00 177.39 178.07 3gtg n VAL 124 N -0.47 1.03 0.28 4.08 0.31 -1.25 -4.63 118.33 117.69 3gtg n VAL 124 Ca 0.55 0.28 0.06 0.00 -0.01 0.00 0.00 64.34 65.21 3gtg n VAL 124 Cb 0.52 -2.12 0.22 0.00 -0.91 0.00 0.00 33.84 31.54 3gtg n VAL 124 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 3gtg n PRO 125 N -3.92 2.59 0.00 5.55 -0.05 -1.26 -4.40 135.00 133.52 3gtg n PRO 125 Ca -0.07 -1.71 0.15 0.00 -0.05 0.00 0.00 63.50 61.81 3gtg n PRO 125 Cb 0.27 -1.61 0.70 0.00 -0.05 0.00 0.00 33.50 32.81 3gtg n PRO 125 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 175.50 174.32 3gtg n SER 126 N 0.61 0.52 -3.58 3.54 3.41 -1.26 -4.37 113.62 112.49 3gtg n SER 126 Ca 0.16 -0.88 -0.27 0.00 -0.26 0.00 0.00 58.87 57.61 3gtg n SER 126 Cb 0.57 -0.04 -0.10 0.00 -0.26 0.00 0.00 64.21 64.37 3gtg n SER 126 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3gtg n ILE 127 N -0.74 0.98 -1.40 -1.33 -0.00 -1.26 -5.11 119.36 110.50 3gtg n ILE 127 Ca 0.18 -4.57 -0.30 0.00 -0.00 0.00 0.00 62.75 58.06 3gtg n ILE 127 Cb 0.24 -2.03 0.19 0.00 -0.00 0.00 0.00 39.64 38.05 3gtg n ILE 127 CO 0.00 0.00 0.00 -2.84 -0.00 0.00 0.00 176.55 173.71 3gtg s PRO 128 N -1.42 -0.04 0.01 0.38 0.02 -1.26 -4.16 135.00 128.53 3gtg s PRO 128 Ca 0.32 0.00 0.29 0.00 0.02 0.00 0.00 61.00 61.63 3gtg s PRO 128 Cb 0.06 -1.73 1.17 0.00 0.02 0.00 0.00 34.50 34.02 3gtg s PRO 128 CO -0.12 -2.94 1.89 -0.35 -0.33 0.00 0.00 177.00 175.14 3gtg n PRO 129 N -4.23 0.02 -0.63 5.54 -0.05 -1.26 -5.05 135.00 129.33 3gtg n PRO 129 Ca 0.11 0.01 -0.16 0.00 -0.05 0.00 0.00 63.50 63.42 3gtg n PRO 129 Cb 0.59 -1.52 0.13 0.00 -0.05 0.00 0.00 33.50 32.65 3gtg n PRO 129 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 3gtg n ALA 130 N -1.52 -1.61 -3.14 0.55 0.00 -1.26 -5.09 120.51 108.44 3gtg n ALA 130 Ca 0.07 -0.86 -0.12 0.00 0.00 0.00 0.00 53.44 52.52 3gtg n ALA 130 Cb 0.34 -0.06 -0.10 0.00 0.00 0.00 0.00 19.45 19.64 3gtg n ALA 130 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3gtg s THR 131 N -2.13 0.05 -0.05 0.00 2.01 0.17 -4.96 115.64 110.73 3gtg s THR 131 Ca 0.38 -0.39 0.05 0.00 0.31 0.00 0.00 61.69 62.04 3gtg s THR 131 Cb -0.03 -0.44 -0.01 0.00 0.01 0.00 0.00 72.50 72.03 3gtg s THR 131 CO 0.28 -0.21 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.17 3gtg s ILE 132 N -0.83 1.69 0.35 1.82 1.01 -1.26 -1.78 121.20 122.20 3gtg s ILE 132 Ca -0.09 -0.86 0.09 0.00 0.00 0.00 0.00 60.65 59.79 3gtg s ILE 132 Cb -0.05 -1.44 -0.07 0.00 0.01 0.00 0.00 42.46 40.91 3gtg s ILE 132 CO 0.02 0.48 -0.09 -1.61 0.00 0.00 0.00 174.94 173.74 3gtg s GLU 133 N -0.04 1.83 -0.07 2.79 2.02 -0.01 -4.93 118.70 120.29 3gtg s GLU 133 Ca -0.04 -1.95 -0.04 0.00 0.02 0.00 0.00 54.97 52.96 3gtg s GLU 133 Cb -0.12 -1.69 0.03 0.00 0.10 0.00 0.00 34.13 32.44 3gtg s GLU 133 CO 0.03 0.12 0.16 -0.08 0.02 0.00 0.00 175.26 175.51 3gtg s THR 134 N -2.62 -0.02 0.01 3.63 -1.32 -1.26 -1.80 115.64 112.26 3gtg s THR 134 Ca 0.33 0.08 0.00 0.00 -1.21 0.00 0.00 61.69 60.89 3gtg s THR 134 Cb 0.03 -0.25 -0.01 0.00 -1.51 0.00 0.00 72.50 70.76 3gtg s THR 134 CO 0.17 0.03 -0.02 -0.36 -2.21 0.00 0.00 174.62 172.23 3gtg s PHE 135 N 0.62 0.21 -0.07 9.09 0.08 -0.68 -4.96 117.98 122.26 3gtg s PHE 135 Ca -0.04 -0.26 -0.22 0.00 0.12 0.00 0.00 56.93 56.53 3gtg s PHE 135 Cb -0.06 -0.14 -0.04 0.00 -0.57 0.00 0.00 43.02 42.21 3gtg s PHE 135 CO -0.03 -0.08 0.62 1.21 -0.10 0.00 0.00 175.22 176.84 3gtg s ASN 136 N -0.71 6.90 0.26 1.36 3.84 -1.26 -3.04 114.94 122.29 3gtg s ASN 136 Ca -0.07 1.08 -0.06 0.00 0.21 0.00 0.00 52.86 54.03 3gtg s ASN 136 Cb -0.05 -2.37 0.49 0.00 -0.55 0.00 0.00 41.25 38.77 3gtg s ASN 136 CO -0.00 -0.05 1.62 -0.33 -2.79 0.00 0.00 177.10 175.54 3gtg h GLU 137 N 6.56 0.07 0.00 0.43 5.08 -1.87 -1.00 114.58 123.84 3gtg h GLU 137 Ca -0.42 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.94 3gtg h GLU 137 Cb 1.19 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 3gtg h GLU 137 CO 0.74 0.05 -0.00 0.00 -1.00 0.00 0.00 179.01 178.80 3gtg h ALA 138 N 1.78 1.23 0.05 3.43 0.00 -1.90 -0.49 119.26 123.36 3gtg h ALA 138 Ca 0.45 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 55.08 3gtg h ALA 138 Cb 0.81 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3gtg h ALA 138 CO -0.75 0.01 -1.41 0.00 0.00 0.00 0.00 179.25 177.10 3gtg h ALA 139 N 2.00 0.43 -0.54 0.00 0.00 -1.60 -3.38 119.26 116.17 3gtg h ALA 139 Ca -0.00 -1.14 0.00 0.00 0.00 0.00 0.00 54.91 53.77 3gtg h ALA 139 Cb 0.02 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3gtg h ALA 139 CO 0.00 1.29 0.00 1.28 0.00 0.00 0.00 179.25 181.82 3gtg n LEU 140 N -3.31 4.25 0.16 0.00 4.77 -0.22 -4.07 117.00 118.57 3gtg n LEU 140 Ca -0.11 -2.15 0.04 0.00 -0.03 0.00 0.00 56.01 53.76 3gtg n LEU 140 Cb 1.01 -0.55 0.18 0.00 -2.33 0.00 0.00 43.42 41.73 3gtg n LEU 140 CO 0.48 0.67 0.56 0.58 -1.33 0.00 0.00 177.39 178.35 3gtg h VAL 141 N 3.43 0.93 -3.31 4.08 2.07 -1.67 -3.34 116.25 118.44 3gtg h VAL 141 Ca 0.00 -1.93 -0.53 0.00 0.82 0.00 0.00 66.70 65.06 3gtg h VAL 141 Cb 1.35 2.19 -0.35 0.00 -1.52 0.00 0.00 31.29 32.97 3gtg h VAL 141 CO 0.24 0.46 -0.81 -0.69 0.02 0.00 0.00 177.57 176.79 3gtg s VAL 142 N -3.28 1.15 -0.01 2.57 1.01 -1.26 -4.31 120.40 116.27 3gtg s VAL 142 Ca 0.02 -0.43 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 3gtg s VAL 142 Cb 0.09 -1.09 -0.07 0.00 0.00 0.00 0.00 36.38 35.31 3gtg s VAL 142 CO 0.72 0.37 1.88 0.21 0.00 0.00 0.00 175.10 178.27 3gtg s ASN 143 N 1.08 6.46 0.07 3.32 3.84 -1.26 -4.89 114.94 123.57 3gtg s ASN 143 Ca -0.06 2.47 -0.25 0.00 0.21 0.00 0.00 52.86 55.23 3gtg s ASN 143 Cb -0.14 -2.53 -0.16 0.00 -0.55 0.00 0.00 41.25 37.86 3gtg s ASN 143 CO -0.01 -1.07 1.66 0.16 -2.79 0.00 0.00 177.10 175.05 3gtg h ILE 144 N 5.71 0.94 -0.54 -5.21 3.07 -1.97 -3.16 117.51 116.36 3gtg h ILE 144 Ca -0.46 -0.13 0.16 0.00 1.55 0.00 0.00 64.86 65.98 3gtg h ILE 144 Cb 1.22 1.03 -0.02 0.00 -0.27 0.00 0.00 36.82 38.77 3gtg h ILE 144 CO 0.95 0.03 0.41 0.71 -1.05 0.00 0.00 178.15 179.20 3gtg h THR 145 N -0.19 0.65 -0.14 0.16 1.35 -1.94 -2.97 112.91 109.83 3gtg h THR 145 Ca -0.01 0.00 -0.66 0.00 -0.55 0.00 0.00 66.41 65.19 3gtg h THR 145 Cb 0.15 0.71 -0.02 0.00 -1.73 0.00 0.00 68.15 67.26 3gtg h THR 145 CO 0.02 0.00 2.61 1.41 -0.25 0.00 0.00 175.52 179.32 3gtg n HIS 146 N -4.25 3.10 -3.64 4.73 8.25 -1.19 -4.78 115.22 117.44 3gtg n HIS 146 Ca 0.10 -2.49 -0.08 0.00 -0.26 0.00 0.00 57.72 55.00 3gtg n HIS 146 Cb 0.64 -2.31 -0.07 0.00 1.12 0.00 0.00 29.99 29.37 3gtg n HIS 146 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3gtg s HIS 147 N 4.45 -0.46 0.07 4.41 5.04 -1.12 -4.91 115.29 122.76 3gtg s HIS 147 Ca 0.53 1.09 -0.15 0.00 -1.54 0.00 0.00 55.06 54.98 3gtg s HIS 147 Cb 0.12 0.37 -0.04 0.00 0.04 0.00 0.00 32.58 33.07 3gtg s HIS 147 CO 0.01 -0.22 1.26 0.93 -2.34 0.00 0.00 174.74 174.38 3gtg h GLU 148 N 4.42 -0.07 0.00 2.88 5.08 -1.90 -0.31 114.58 124.69 3gtg h GLU 148 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 3gtg h GLU 148 Cb 1.18 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3gtg h GLU 148 CO 0.13 -0.04 0.00 1.28 -1.00 0.00 0.00 179.01 179.37 3gtg n LEU 149 N -4.02 0.00 -4.46 1.33 4.77 -1.26 -4.38 117.00 108.98 3gtg n LEU 149 Ca -0.00 0.24 -0.38 0.00 -0.03 0.00 0.00 56.01 55.84 3gtg n LEU 149 Cb 0.14 -0.24 -0.12 0.00 -2.33 0.00 0.00 43.42 40.87 3gtg n LEU 149 CO -0.05 -0.20 -0.22 -0.69 -1.33 0.00 0.00 177.39 174.90 3gtg s VAL 150 N -2.47 4.62 0.37 4.08 1.01 -0.13 -5.09 120.40 122.79 3gtg s VAL 150 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.77 3gtg s VAL 150 Cb 0.03 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 3gtg s VAL 150 CO 0.07 0.17 0.58 -2.16 0.00 0.00 0.00 175.10 173.76 3gtg s PRO 151 N 1.64 3.41 -0.05 2.72 0.04 -1.26 -4.70 135.00 136.79 3gtg s PRO 151 Ca 0.05 -0.35 -0.30 0.00 0.04 0.00 0.00 61.00 60.44 3gtg s PRO 151 Cb -0.16 -2.63 -0.03 0.00 0.04 0.00 0.00 34.50 31.71 3gtg s PRO 151 CO 0.06 0.06 1.17 -1.59 0.04 0.00 0.00 177.00 176.74 3gtg s LYS 152 N -4.37 4.37 0.14 4.56 -2.85 -1.26 -4.91 119.74 115.43 3gtg s LYS 152 Ca 0.42 1.64 -0.06 0.00 -1.00 0.00 0.00 55.97 56.97 3gtg s LYS 152 Cb -0.10 -3.53 -0.06 0.00 -2.06 0.00 0.00 37.83 32.08 3gtg s LYS 152 CO 0.37 -0.40 0.40 -1.01 0.10 0.00 0.00 175.35 174.80 3gtg s HIS 153 N 2.05 3.48 -0.01 1.78 3.76 -1.26 -2.34 115.29 122.75 3gtg s HIS 153 Ca 0.55 0.63 0.02 0.00 -0.15 0.00 0.00 55.06 56.11 3gtg s HIS 153 Cb -0.24 -2.06 -0.00 0.00 1.11 0.00 0.00 32.58 31.39 3gtg s HIS 153 CO 0.22 0.43 -0.06 0.42 -0.85 0.00 0.00 174.74 174.90 3gtg s ILE 154 N -1.64 0.47 0.63 0.60 -1.09 0.09 -4.97 121.20 115.29 3gtg s ILE 154 Ca 0.41 -0.24 -0.10 0.00 -2.23 0.00 0.00 60.65 58.48 3gtg s ILE 154 Cb -0.12 -0.41 -0.02 0.00 -1.58 0.00 0.00 42.46 40.33 3gtg s ILE 154 CO 0.23 0.14 1.02 -0.60 -1.23 0.00 0.00 174.94 174.50 3gtg s ARG 155 N -0.06 3.31 0.00 2.79 3.52 -1.26 -1.48 118.95 125.78 3gtg s ARG 155 Ca 0.01 0.55 -0.00 0.00 -0.13 0.00 0.00 55.73 56.16 3gtg s ARG 155 Cb -0.03 -2.11 -0.00 0.00 -1.56 0.00 0.00 34.95 31.25 3gtg s ARG 155 CO -0.00 -0.69 0.00 -0.51 -0.81 0.00 0.00 175.30 173.29 3gtg s LEU 156 N -5.18 2.01 0.86 -0.88 1.43 -1.19 -4.86 118.68 110.88 3gtg s LEU 156 Ca 0.55 -0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 53.50 3gtg s LEU 156 Cb -0.11 0.02 0.11 0.00 0.03 0.00 0.00 46.19 46.24 3gtg s LEU 156 CO 0.52 -0.03 1.11 -0.94 0.23 0.00 0.00 176.35 177.24 3gtg s SER 157 N -0.14 3.61 0.00 2.29 1.04 -1.26 -4.62 113.70 114.62 3gtg s SER 157 Ca -0.02 1.92 -0.22 0.00 0.48 0.00 0.00 55.95 58.11 3gtg s SER 157 Cb -0.01 -2.49 -0.19 0.00 0.10 0.00 0.00 66.02 63.43 3gtg s SER 157 CO -0.00 -2.62 1.21 0.77 0.98 0.00 0.00 173.24 173.59 3gtg h SER 158 N -1.53 0.29 0.20 7.02 4.64 -1.99 0.75 113.55 122.94 3gtg h SER 158 Ca -0.45 -0.60 -0.03 0.00 -0.47 0.00 0.00 61.79 60.25 3gtg h SER 158 Cb 1.26 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3gtg h SER 158 CO 0.48 0.84 -0.14 0.44 -0.87 0.00 0.00 176.83 177.58 3gtg h ASP 159 N -0.24 0.00 0.11 4.97 5.19 -1.97 -2.63 116.42 121.85 3gtg h ASP 159 Ca -0.00 0.00 -0.23 0.00 -0.62 0.00 0.00 57.03 56.18 3gtg h ASP 159 Cb 0.80 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.34 3gtg h ASP 159 CO 0.04 0.14 -0.97 -0.08 -3.12 0.00 0.00 179.24 175.25 3gtg h GLU 160 N 0.00 0.46 -0.42 3.56 4.22 -1.88 -3.31 114.58 117.21 3gtg h GLU 160 Ca -0.00 -0.64 0.05 0.00 0.08 0.00 0.00 59.36 58.84 3gtg h GLU 160 Cb 0.27 0.22 -0.05 0.00 0.50 0.00 0.00 28.75 29.70 3gtg h GLU 160 CO 0.02 1.28 0.16 -0.22 -2.18 0.00 0.00 179.01 178.06 3gtg h LYS 161 N -0.04 0.32 -0.14 1.92 3.64 0.79 0.25 116.57 123.31 3gtg h LYS 161 Ca -0.15 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.25 3gtg h LYS 161 Cb 1.70 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.44 3gtg h LYS 161 CO 0.18 0.21 0.58 -0.09 -2.27 0.00 0.00 179.45 178.07 3gtg h ARG 162 N 0.33 0.00 0.16 1.90 2.43 -1.56 -0.19 114.38 117.45 3gtg h ARG 162 Ca 0.19 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 3gtg h ARG 162 Cb 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 3gtg h ARG 162 CO -0.19 0.00 -0.07 1.49 -1.51 0.00 0.00 179.97 179.69 3gtg h GLU 163 N 0.00 -0.20 0.09 0.20 4.57 -0.60 -2.61 114.58 116.03 3gtg h GLU 163 Ca 0.06 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.28 3gtg h GLU 163 Cb 1.22 0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 29.81 3gtg h GLU 163 CO -0.00 0.23 -0.38 1.25 -1.18 0.00 0.00 179.01 178.93 3gtg h LEU 164 N -0.85 -1.12 -0.94 1.64 5.85 -1.02 -0.74 115.31 118.13 3gtg h LEU 164 Ca -0.02 0.13 0.28 0.00 0.84 0.00 0.00 57.88 59.10 3gtg h LEU 164 Cb 0.53 0.43 -0.15 0.00 0.37 0.00 0.00 40.66 41.84 3gtg h LEU 164 CO 0.04 -0.45 0.37 -0.07 -0.34 0.00 0.00 178.44 177.98 3gtg h LEU 165 N -0.59 0.20 0.19 2.25 -0.00 -1.42 -0.70 115.31 115.24 3gtg h LEU 165 Ca 0.03 0.20 -0.33 0.00 -0.00 0.00 0.00 57.88 57.79 3gtg h LEU 165 Cb 0.63 0.22 0.02 0.00 -0.00 0.00 0.00 40.66 41.53 3gtg h LEU 165 CO -0.24 -0.16 -1.53 0.50 -0.00 0.00 0.00 178.44 177.01 3gtg h LYS 166 N 0.25 0.40 -0.07 1.13 3.64 -1.24 0.15 116.57 120.83 3gtg h LYS 166 Ca 0.63 -0.69 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3gtg h LYS 166 Cb 1.37 0.26 0.00 0.00 -0.41 0.00 0.00 32.23 33.44 3gtg h LYS 166 CO -0.65 1.31 0.00 0.54 -2.27 0.00 0.00 179.45 178.38 3gtg n ARG 167 N -3.60 1.65 -0.07 1.90 5.12 -0.30 -1.40 116.66 119.96 3gtg n ARG 167 Ca -0.17 -0.96 0.04 0.00 -1.93 0.00 0.00 57.85 54.83 3gtg n ARG 167 Cb 1.07 -1.45 0.06 0.00 -1.16 0.00 0.00 32.46 30.98 3gtg n ARG 167 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 3gtg n TYR 168 N 0.16 0.00 -4.23 -1.55 0.53 -0.42 -5.02 117.16 106.63 3gtg n TYR 168 Ca 0.18 -0.64 -0.35 0.00 -1.02 0.00 0.00 57.90 56.07 3gtg n TYR 168 Cb 0.33 -0.09 -0.04 0.00 -1.03 0.00 0.00 39.34 38.51 3gtg n TYR 168 CO 0.00 0.00 0.00 2.89 -1.02 0.00 0.00 176.86 178.73 3gtg n ARG 169 N -0.83 -2.60 -3.05 -0.72 0.00 -0.49 -4.96 116.66 104.01 3gtg n ARG 169 Ca 0.07 0.32 -0.22 0.00 -0.00 0.00 0.00 57.85 58.02 3gtg n ARG 169 Cb 0.47 -4.79 0.01 0.00 -0.00 0.00 0.00 32.46 28.15 3gtg n ARG 169 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 3gtg s LEU 170 N -7.22 3.67 0.28 2.89 1.43 0.51 -5.00 118.68 115.24 3gtg s LEU 170 Ca 0.55 0.13 0.09 0.00 -1.03 0.00 0.00 54.13 53.87 3gtg s LEU 170 Cb -0.31 -3.03 -0.04 0.00 0.03 0.00 0.00 46.19 42.85 3gtg s LEU 170 CO 0.94 -0.70 0.08 -0.54 0.23 0.00 0.00 176.35 176.36 3gtg s LYS 171 N -4.49 2.45 0.03 1.70 1.02 -1.26 -4.70 119.74 114.49 3gtg s LYS 171 Ca 0.49 -1.37 -0.06 0.00 0.02 0.00 0.00 55.97 55.04 3gtg s LYS 171 Cb -0.10 -2.25 -0.01 0.00 -0.52 0.00 0.00 37.83 34.94 3gtg s LYS 171 CO 0.36 0.31 0.86 0.39 -0.92 0.00 0.00 175.35 176.36 3gtg n GLU 172 N -1.02 -0.09 -0.29 1.68 1.02 -1.26 -1.29 120.64 119.39 3gtg n GLU 172 Ca -0.06 0.86 -0.00 0.00 -0.02 0.00 0.00 57.16 57.94 3gtg n GLU 172 Cb 0.59 -1.28 0.04 0.00 -0.02 0.00 0.00 31.44 30.78 3gtg n GLU 172 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3gtg n SER 173 N -3.36 -0.46 0.07 1.62 3.41 -1.26 -2.74 113.62 110.89 3gtg n SER 173 Ca 0.00 1.31 0.06 0.00 -0.26 0.00 0.00 58.87 59.99 3gtg n SER 173 Cb 0.05 -0.31 0.31 0.00 -0.26 0.00 0.00 64.21 64.00 3gtg n SER 173 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gtg n GLN 174 N -5.12 0.07 -1.80 4.33 6.02 -0.41 -4.70 117.38 115.77 3gtg n GLN 174 Ca 0.08 0.48 -0.33 0.00 -0.01 0.00 0.00 57.00 57.22 3gtg n GLN 174 Cb 0.31 -1.69 0.04 0.00 1.02 0.00 0.00 30.24 29.92 3gtg n GLN 174 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3gtg s LEU 175 N -3.68 3.40 1.07 1.08 2.01 -1.11 -5.02 118.68 116.43 3gtg s LEU 175 Ca 0.01 1.95 -0.12 0.00 0.01 0.00 0.00 54.13 55.99 3gtg s LEU 175 Cb 0.05 -4.55 0.23 0.00 0.01 0.00 0.00 46.19 41.94 3gtg s LEU 175 CO 0.17 -1.55 1.07 -2.84 1.01 0.00 0.00 176.35 174.21 3gtg s PRO 176 N -4.13 -0.19 0.10 1.29 0.02 -1.26 -4.87 135.00 125.97 3gtg s PRO 176 Ca 0.66 1.00 0.06 0.00 0.02 0.00 0.00 61.00 62.74 3gtg s PRO 176 Cb -0.19 -1.63 -0.03 0.00 0.02 0.00 0.00 34.50 32.67 3gtg s PRO 176 CO 0.41 -3.28 -0.15 1.03 -0.33 0.00 0.00 177.00 174.69 3gtg s ARG 177 N -4.58 0.93 -0.05 5.54 0.52 -1.26 -2.16 118.95 117.89 3gtg s ARG 177 Ca 0.67 -1.10 0.06 0.00 -0.52 0.00 0.00 55.73 54.84 3gtg s ARG 177 Cb -0.23 -0.90 -0.01 0.00 0.52 0.00 0.00 34.95 34.32 3gtg s ARG 177 CO 0.62 0.19 -0.24 -1.50 0.02 0.00 0.00 175.30 174.39 3gtg s ILE 178 N -1.66 1.94 0.54 1.52 2.07 0.47 -4.88 121.20 121.20 3gtg s ILE 178 Ca 0.04 -1.01 -0.20 0.00 -1.41 0.00 0.00 60.65 58.06 3gtg s ILE 178 Cb -0.08 -1.64 -0.05 0.00 0.13 0.00 0.00 42.46 40.82 3gtg s ILE 178 CO 0.03 0.54 1.20 -1.10 -1.91 0.00 0.00 174.94 173.70 3gtg s GLN 179 N -0.16 3.28 0.14 3.50 -1.52 -1.26 -1.83 119.66 121.80 3gtg s GLN 179 Ca -0.03 1.82 -0.12 0.00 -1.95 0.00 0.00 55.36 55.08 3gtg s GLN 179 Cb -0.13 -2.10 -0.03 0.00 -0.22 0.00 0.00 33.01 30.53 3gtg s GLN 179 CO 0.03 -0.96 1.51 -0.09 -0.25 0.00 0.00 175.29 175.53 3gtg h ARG 180 N 1.32 0.89 0.00 2.91 2.43 -1.95 -2.65 114.38 117.33 3gtg h ARG 180 Ca -0.50 -0.40 0.00 0.00 -0.81 0.00 0.00 59.98 58.27 3gtg h ARG 180 Cb 1.28 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 3gtg h ARG 180 CO 0.57 1.05 0.00 0.00 -1.51 0.00 0.00 179.97 180.08 3gtg n ALA 181 N -2.50 2.19 -1.68 2.80 0.00 -1.26 -4.33 120.51 115.72 3gtg n ALA 181 Ca -0.01 -0.12 -0.45 0.00 0.00 0.00 0.00 53.44 52.86 3gtg n ALA 181 Cb 0.46 -1.35 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 3gtg n ALA 181 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3gtg n ASP 182 N -1.15 3.44 -0.33 0.00 -0.08 -1.00 -4.76 116.55 112.67 3gtg n ASP 182 Ca 0.13 1.05 0.13 0.00 -1.51 0.00 0.00 54.79 54.59 3gtg n ASP 182 Cb 0.12 -1.46 0.27 0.00 2.34 0.00 0.00 41.12 42.39 3gtg n ASP 182 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3gtg h PRO 183 N 6.81 0.02 0.36 -0.67 0.11 -1.90 0.65 132.00 137.39 3gtg h PRO 183 Ca -0.45 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 3gtg h PRO 183 Cb 1.24 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3gtg h PRO 183 CO 0.92 0.02 -0.17 0.28 -0.21 0.00 0.00 178.00 178.83 3gtg h VAL 184 N 0.03 0.39 0.00 3.15 2.07 -1.96 -3.03 116.25 116.89 3gtg h VAL 184 Ca 0.57 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3gtg h VAL 184 Cb 1.15 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 3gtg h VAL 184 CO -0.89 0.09 0.00 0.00 0.02 0.00 0.00 177.57 176.78 3gtg n ALA 185 N -2.63 1.83 0.03 1.67 0.00 -0.59 0.31 120.51 121.13 3gtg n ALA 185 Ca -0.08 -0.06 -0.02 0.00 0.00 0.00 0.00 53.44 53.27 3gtg n ALA 185 Cb 0.26 -1.16 -0.01 0.00 0.00 0.00 0.00 19.45 18.54 3gtg n ALA 185 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3gtg h LEU 186 N 0.00 -0.14 0.00 0.00 3.38 -0.95 -2.32 115.31 115.28 3gtg h LEU 186 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3gtg h LEU 186 Cb 0.02 0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3gtg h LEU 186 CO 0.00 0.20 0.07 0.00 0.09 0.00 0.00 178.44 178.80 3gtg n TYR 187 N -4.10 0.00 0.00 1.13 9.36 0.15 0.11 117.16 123.81 3gtg n TYR 187 Ca -0.02 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.20 3gtg n TYR 187 Cb 0.06 -0.09 0.00 0.00 -0.63 0.00 0.00 39.34 38.68 3gtg n TYR 187 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 3gtg n LEU 188 N -0.95 0.00 -2.18 2.98 4.77 -0.97 -4.79 117.00 115.86 3gtg n LEU 188 Ca 0.00 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3gtg n LEU 188 Cb 0.07 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3gtg n LEU 188 CO 0.00 0.00 -0.29 0.61 -1.33 0.00 0.00 177.39 176.38 3gtg n GLY 189 N 1.74 -3.75 0.00 -0.72 0.00 0.30 -4.95 105.19 97.82 3gtg n GLY 189 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3gtg n GLY 189 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gtg n LEU 190 N 0.46 0.00 -4.16 0.99 7.99 -0.99 -5.03 117.00 116.26 3gtg n LEU 190 Ca -0.03 0.00 -0.17 0.00 -0.01 0.00 0.00 56.01 55.80 3gtg n LEU 190 Cb 0.04 0.00 -0.05 0.00 -0.11 0.00 0.00 43.42 43.30 3gtg n LEU 190 CO 0.25 -0.25 0.06 -0.75 -1.51 0.00 0.00 177.39 175.20 3gtg s LYS 191 N -0.04 1.91 -0.53 3.23 2.20 -1.26 -5.02 119.74 120.23 3gtg s LYS 191 Ca 0.00 -1.89 -0.26 0.00 -0.36 0.00 0.00 55.97 53.45 3gtg s LYS 191 Cb 0.00 0.41 -0.06 0.00 -1.51 0.00 0.00 37.83 36.67 3gtg s LYS 191 CO 0.00 -0.77 2.27 0.50 -0.36 0.00 0.00 175.35 177.00 3gtg s ARG 192 N -3.09 2.22 0.00 4.03 6.06 -1.26 -3.14 118.95 123.77 3gtg s ARG 192 Ca 0.34 1.19 0.00 0.00 -2.50 0.00 0.00 55.73 54.76 3gtg s ARG 192 Cb 0.00 -4.54 0.00 0.00 0.06 0.00 0.00 34.95 30.47 3gtg s ARG 192 CO 0.24 -3.17 0.00 0.41 -2.50 0.00 0.00 175.30 170.28 3gtg n GLY 193 N 5.95 1.88 3.71 8.12 0.00 -1.25 -5.04 105.19 118.56 3gtg n GLY 193 Ca 0.33 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.93 3gtg n GLY 193 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gtg s GLU 194 N -0.83 4.42 -0.14 1.61 2.02 -1.19 -4.69 118.70 119.91 3gtg s GLU 194 Ca 0.00 1.76 -0.05 0.00 0.02 0.00 0.00 54.97 56.70 3gtg s GLU 194 Cb 0.00 -3.37 -0.04 0.00 0.10 0.00 0.00 34.13 30.82 3gtg s GLU 194 CO 0.00 -0.28 0.04 0.08 0.02 0.00 0.00 175.26 175.12 3gtg s VAL 195 N 1.19 4.62 0.02 2.63 1.01 -1.26 -3.56 120.40 125.06 3gtg s VAL 195 Ca 0.58 -0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.45 3gtg s VAL 195 Cb -0.29 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 3gtg s VAL 195 CO 0.28 0.53 0.15 0.68 0.00 0.00 0.00 175.10 176.74 3gtg s VAL 196 N -0.19 5.10 -0.02 2.92 -7.23 0.21 -3.14 120.40 118.05 3gtg s VAL 196 Ca 0.07 -0.36 0.03 0.00 -1.81 0.00 0.00 61.98 59.91 3gtg s VAL 196 Cb -0.12 -3.40 -0.03 0.00 0.56 0.00 0.00 36.38 33.38 3gtg s VAL 196 CO 0.02 0.26 -0.11 -0.75 -0.31 0.00 0.00 175.10 174.21 3gtg s LYS 197 N -2.07 2.50 -0.10 4.82 2.20 -0.55 -0.41 119.74 126.14 3gtg s LYS 197 Ca 0.28 -0.72 0.02 0.00 -0.36 0.00 0.00 55.97 55.19 3gtg s LYS 197 Cb -0.12 -2.43 0.02 0.00 -1.51 0.00 0.00 37.83 33.78 3gtg s LYS 197 CO 0.20 0.61 -0.14 0.42 -0.36 0.00 0.00 175.35 176.08 3gtg s ILE 198 N -0.86 1.37 -1.06 5.43 1.01 0.68 -0.73 121.20 127.04 3gtg s ILE 198 Ca 0.14 -0.57 -0.07 0.00 0.00 0.00 0.00 60.65 60.15 3gtg s ILE 198 Cb -0.11 -1.26 0.27 0.00 0.01 0.00 0.00 42.46 41.37 3gtg s ILE 198 CO 0.04 0.41 1.05 -0.38 0.00 0.00 0.00 174.94 176.06 3gtg n ILE 199 N 4.18 4.19 -2.50 2.92 5.41 -0.99 -0.17 119.36 132.39 3gtg n ILE 199 Ca -0.19 -5.34 -0.27 0.00 1.00 0.00 0.00 62.75 57.95 3gtg n ILE 199 Cb 0.51 -2.51 0.02 0.00 -0.71 0.00 0.00 39.64 36.95 3gtg n ILE 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3gtg s ARG 200 N -1.40 3.18 0.26 0.38 1.70 -1.08 -4.28 118.95 117.71 3gtg s ARG 200 Ca 0.30 0.07 0.06 0.00 -0.47 0.00 0.00 55.73 55.68 3gtg s ARG 200 Cb -0.08 -2.32 -0.03 0.00 -0.57 0.00 0.00 34.95 31.95 3gtg s ARG 200 CO -0.08 -0.48 0.35 0.15 -1.08 0.00 0.00 175.30 174.15 3gtg s LYS 201 N -4.88 3.29 -0.02 3.89 -0.14 -1.26 -1.34 119.74 119.29 3gtg s LYS 201 Ca 0.51 -0.86 -0.22 0.00 -1.36 0.00 0.00 55.97 54.04 3gtg s LYS 201 Cb -0.10 -2.82 0.05 0.00 -1.68 0.00 0.00 37.83 33.27 3gtg s LYS 201 CO 0.45 0.36 0.48 0.45 -0.76 0.00 0.00 175.35 176.33 3gtg s SER 202 N -3.99 -0.41 0.00 2.83 0.15 -0.36 -4.86 113.70 107.06 3gtg s SER 202 Ca 0.36 0.34 0.20 0.00 0.70 0.00 0.00 55.95 57.54 3gtg s SER 202 Cb -0.09 0.43 1.17 0.00 -1.71 0.00 0.00 66.02 65.82 3gtg s SER 202 CO 0.29 -0.55 1.68 -1.84 1.20 0.00 0.00 173.24 174.01 3gtg n GLU 203 N 0.99 0.88 -0.07 5.44 0.28 -1.26 -3.96 120.64 122.95 3gtg n GLU 203 Ca -0.20 0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 56.66 3gtg n GLU 203 Cb 0.57 -1.35 -0.05 0.00 1.43 0.00 0.00 31.44 32.05 3gtg n GLU 203 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 3gtg n THR 204 N -0.85 0.71 -3.98 3.84 -1.04 -1.26 -4.96 114.28 106.75 3gtg n THR 204 Ca 0.15 -0.18 -0.21 0.00 -2.04 0.00 0.00 64.05 61.76 3gtg n THR 204 Cb 0.07 -1.66 -0.17 0.00 -1.82 0.00 0.00 70.33 66.75 3gtg n THR 204 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3gtg s SER 205 N -6.15 1.20 0.00 8.00 1.04 -1.26 -5.07 113.70 111.47 3gtg s SER 205 Ca -0.18 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.14 3gtg s SER 205 Cb 0.07 -0.44 0.00 0.00 0.10 0.00 0.00 66.02 65.75 3gtg s SER 205 CO 0.23 -0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.94 3gtg n GLY 206 N 4.52 0.00 3.36 7.32 0.00 -1.25 -3.94 105.19 115.20 3gtg n GLY 206 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 3gtg n GLY 206 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gtg s ARG 207 N -3.30 2.74 -0.08 1.61 0.52 -1.26 -1.23 118.95 117.95 3gtg s ARG 207 Ca 0.00 -0.78 0.03 0.00 -0.52 0.00 0.00 55.73 54.46 3gtg s ARG 207 Cb 0.00 -2.35 0.01 0.00 0.52 0.00 0.00 34.95 33.13 3gtg s ARG 207 CO 0.00 0.42 -0.17 -0.47 0.02 0.00 0.00 175.30 175.10 3gtg s TYR 208 N -0.23 1.87 -0.00 -0.53 5.04 -0.45 -4.96 117.35 118.10 3gtg s TYR 208 Ca -0.00 -0.72 -0.27 0.00 -2.44 0.00 0.00 57.07 53.63 3gtg s TYR 208 Cb -0.13 -1.31 -0.04 0.00 0.35 0.00 0.00 41.96 40.83 3gtg s TYR 208 CO 0.03 -0.32 0.86 0.00 -1.34 0.00 0.00 175.55 174.78 3gtg s ALA 209 N 0.51 3.25 -0.00 3.97 0.00 -1.26 -2.64 121.76 125.59 3gtg s ALA 209 Ca -0.16 0.38 0.04 0.00 0.00 0.00 0.00 51.96 52.22 3gtg s ALA 209 Cb -0.16 -3.17 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 3gtg s ALA 209 CO 0.06 -0.13 -0.13 0.45 0.00 0.00 0.00 175.76 176.01 3gtg s SER 210 N 0.70 1.49 -0.06 0.00 0.15 0.76 -4.94 113.70 111.81 3gtg s SER 210 Ca 0.45 -0.26 0.02 0.00 0.70 0.00 0.00 55.95 56.87 3gtg s SER 210 Cb -0.20 -0.16 0.01 0.00 -1.71 0.00 0.00 66.02 63.97 3gtg s SER 210 CO 0.24 0.14 -0.12 -0.31 1.20 0.00 0.00 173.24 174.39 3gtg s TYR 211 N -0.36 1.43 -0.03 3.44 1.51 -1.26 0.25 117.35 122.32 3gtg s TYR 211 Ca 0.04 -0.52 0.00 0.00 -1.01 0.00 0.00 57.07 55.59 3gtg s TYR 211 Cb -0.05 -1.05 0.03 0.00 -0.11 0.00 0.00 41.96 40.77 3gtg s TYR 211 CO -0.00 -0.27 -0.01 1.03 -1.11 0.00 0.00 175.55 175.19 3gtg s ARG 212 N 0.65 0.38 0.88 -0.62 0.52 0.45 -4.04 118.95 117.18 3gtg s ARG 212 Ca -0.14 0.05 -0.10 0.00 -0.52 0.00 0.00 55.73 55.02 3gtg s ARG 212 Cb -0.16 -0.54 0.18 0.00 0.52 0.00 0.00 34.95 34.95 3gtg s ARG 212 CO 0.04 -0.13 1.20 -1.50 0.02 0.00 0.00 175.30 174.93 3gtg s ILE 213 N 1.02 2.04 0.16 1.52 2.07 -0.92 0.63 121.20 127.72 3gtg s ILE 213 Ca -0.10 -0.24 0.11 0.00 -1.41 0.00 0.00 60.65 59.02 3gtg s ILE 213 Cb -0.14 -2.80 -0.04 0.00 0.13 0.00 0.00 42.46 39.61 3gtg s ILE 213 CO -0.01 0.00 -0.25 0.00 -1.91 0.00 0.00 174.94 172.76