#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2goi s LYS 3 N 0.00 0.58 -0.18 0.00 2.20 -1.26 -4.98 119.74 116.09 2goi s LYS 3 Ca 0.00 1.01 0.01 0.00 -0.36 0.00 0.00 55.97 56.63 2goi s LYS 3 Cb 0.00 0.10 0.02 0.00 -1.51 0.00 0.00 37.83 36.44 2goi s LYS 3 CO 0.00 -0.15 -0.19 0.08 -0.36 0.00 0.00 175.35 174.74 2goi s VAL 4 N 1.39 2.01 0.43 4.02 1.01 -1.26 -1.63 120.40 126.38 2goi s VAL 4 Ca -0.09 -0.96 -0.17 0.00 0.00 0.00 0.00 61.98 60.76 2goi s VAL 4 Cb -0.06 -1.85 -0.09 0.00 0.00 0.00 0.00 36.38 34.38 2goi s VAL 4 CO -0.15 0.48 0.89 -0.36 0.00 0.00 0.00 175.10 175.96 2goi s PHE 5 N 1.30 3.40 0.54 5.22 0.40 -0.97 -5.02 117.98 122.84 2goi s PHE 5 Ca 0.04 1.39 -0.10 0.00 -0.60 0.00 0.00 56.93 57.65 2goi s PHE 5 Cb -0.14 -2.70 -0.05 0.00 0.51 0.00 0.00 43.02 40.65 2goi s PHE 5 CO -0.12 -0.15 0.92 -1.54 0.70 0.00 0.00 175.22 175.03 2goi s SER 6 N -2.65 6.34 0.17 1.36 1.04 -1.26 -4.84 113.70 113.86 2goi s SER 6 Ca 0.58 1.27 -0.19 0.00 0.48 0.00 0.00 55.95 58.08 2goi s SER 6 Cb -0.10 -2.39 0.09 0.00 0.10 0.00 0.00 66.02 63.72 2goi s SER 6 CO 0.23 -0.68 1.63 0.08 0.98 0.00 0.00 173.24 175.47 2goi h ARG 7 N 0.22 -0.14 -0.05 4.02 0.11 -1.98 -0.52 114.38 116.06 2goi h ARG 7 Ca -0.46 0.01 -0.13 0.00 0.10 0.00 0.00 59.98 59.50 2goi h ARG 7 Cb 1.19 0.03 -0.01 0.00 1.11 0.00 0.00 29.97 32.29 2goi h ARG 7 CO 0.62 -0.09 -0.59 0.00 0.10 0.00 0.00 179.97 180.01 2goi h GLU 9 N 0.11 -0.10 -0.59 0.00 4.81 -1.83 -1.18 114.58 115.80 2goi h GLU 9 Ca -0.00 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2goi h GLU 9 Cb 1.06 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.44 2goi h GLU 9 CO 0.09 -0.07 0.32 1.25 -0.73 0.00 0.00 179.01 179.87 2goi h LEU 10 N -0.11 0.75 -0.78 1.64 5.85 -0.88 -1.53 115.31 120.26 2goi h LEU 10 Ca -0.01 -0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.71 2goi h LEU 10 Cb 0.09 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 40.85 2goi h LEU 10 CO 0.01 0.63 0.42 0.00 -0.34 0.00 0.00 178.44 179.16 2goi h ALA 11 N 1.15 1.10 -0.20 1.25 0.00 -0.58 -1.22 119.26 120.75 2goi h ALA 11 Ca 0.21 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 2goi h ALA 11 Cb 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2goi h ALA 11 CO -0.03 0.01 -0.05 -0.22 0.00 0.00 0.00 179.25 178.96 2goi h LYS 12 N 0.69 0.39 -0.36 0.00 3.11 -0.67 -1.47 116.57 118.26 2goi h LYS 12 Ca 0.38 -0.15 0.06 0.00 -2.81 0.00 0.00 60.65 58.14 2goi h LYS 12 Cb 0.40 -0.02 -0.06 0.00 -1.00 0.00 0.00 32.23 31.55 2goi h LYS 12 CO -0.27 0.64 0.02 0.93 -2.81 0.00 0.00 179.45 177.96 2goi h GLU 13 N 0.12 0.12 0.00 1.90 4.39 -1.02 -0.27 114.58 119.83 2goi h GLU 13 Ca 0.05 -0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.69 2goi h GLU 13 Cb 0.50 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.11 2goi h GLU 13 CO 0.02 0.08 -0.28 0.52 -1.16 0.00 0.00 179.01 178.19 2goi h MET 14 N 0.13 0.00 -0.05 2.33 2.86 -1.13 -1.78 114.93 117.29 2goi h MET 14 Ca 0.18 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.62 2goi h MET 14 Cb 0.23 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.89 2goi h MET 14 CO -0.28 0.28 -0.79 1.25 1.06 0.00 0.00 176.91 178.43 2goi h HIS 15 N 0.00 0.50 0.00 -0.22 -0.00 -0.49 -2.34 115.15 112.60 2goi h HIS 15 Ca -0.00 -0.24 -0.07 0.00 -0.00 0.00 0.00 60.37 60.06 2goi h HIS 15 Cb 0.54 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.87 2goi h HIS 15 CO 0.00 1.01 -0.32 -0.44 -0.00 0.00 0.00 177.93 178.18 2goi h ASP 16 N 0.23 0.00 0.32 3.26 3.32 -0.39 -2.37 116.42 120.80 2goi h ASP 16 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2goi h ASP 16 Cb 1.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.94 2goi h ASP 16 CO 0.13 0.32 -0.04 0.49 -1.72 0.00 0.00 179.24 178.42 2goi n PHE 17 N -3.80 0.00 -1.86 4.55 3.01 -0.73 -4.95 117.46 113.68 2goi n PHE 17 Ca -0.01 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.43 2goi n PHE 17 Cb 0.41 -0.16 -0.00 0.00 -0.01 0.00 0.00 39.48 39.71 2goi n PHE 17 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2goi n GLY 18 N 1.21 0.34 0.17 1.37 0.00 -0.89 -4.97 105.19 102.42 2goi n GLY 18 Ca 0.17 -0.87 0.08 0.00 0.00 0.00 0.00 46.02 45.40 2goi n GLY 18 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2goi h LEU 19 N 0.00 0.00 -9.43 0.99 3.38 -1.63 -3.40 115.31 105.21 2goi h LEU 19 Ca -0.03 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.41 2goi h LEU 19 Cb 0.87 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.64 2goi h LEU 19 CO 0.04 0.18 1.09 -0.62 0.09 0.00 0.00 178.44 179.21 2goi s ASP 20 N -6.10 6.52 0.00 -0.43 -1.08 -1.26 -1.77 116.67 112.55 2goi s ASP 20 Ca 0.04 2.58 0.00 0.00 -0.52 0.00 0.00 52.55 54.65 2goi s ASP 20 Cb 0.07 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 38.97 2goi s ASP 20 CO 0.72 -0.96 0.00 0.61 0.52 0.00 0.00 175.17 176.06 2goi n GLY 21 N 4.18 1.02 3.68 2.66 0.00 0.25 -4.92 105.19 112.05 2goi n GLY 21 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2goi n GLY 21 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2goi s TYR 22 N -3.24 1.98 -1.17 1.61 5.04 -0.73 -1.63 117.35 119.21 2goi s TYR 22 Ca 0.00 0.03 -0.03 0.00 -2.44 0.00 0.00 57.07 54.64 2goi s TYR 22 Cb 0.00 -4.06 0.02 0.00 0.35 0.00 0.00 41.96 38.27 2goi s TYR 22 CO 0.00 -4.46 0.18 0.54 -1.34 0.00 0.00 175.55 170.47 2goi n ARG 23 N 6.47 -2.76 -1.08 4.97 5.12 -1.26 -1.79 116.66 126.34 2goi n ARG 23 Ca 0.17 0.59 -0.03 0.00 -1.93 0.00 0.00 57.85 56.66 2goi n ARG 23 Cb 0.41 -5.25 -0.01 0.00 -1.16 0.00 0.00 32.46 26.45 2goi n ARG 23 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2goi n GLY 24 N -0.97 0.60 3.61 -0.13 0.00 -0.65 -5.03 105.19 102.62 2goi n GLY 24 Ca -0.11 -0.63 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 2goi n GLY 24 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2goi s TYR 25 N -2.05 3.10 0.74 1.61 1.51 -0.74 -4.94 117.35 116.59 2goi s TYR 25 Ca 0.00 0.01 -0.11 0.00 -1.01 0.00 0.00 57.07 55.96 2goi s TYR 25 Cb 0.00 -1.86 0.04 0.00 -0.11 0.00 0.00 41.96 40.03 2goi s TYR 25 CO 0.00 0.26 1.09 1.21 -1.11 0.00 0.00 175.55 177.00 2goi s ASN 26 N -0.36 4.71 0.19 2.29 3.84 -1.26 0.85 114.94 125.19 2goi s ASN 26 Ca 0.07 1.83 -0.15 0.00 0.21 0.00 0.00 52.86 54.81 2goi s ASN 26 Cb -0.12 -2.52 0.17 0.00 -0.55 0.00 0.00 41.25 38.22 2goi s ASN 26 CO 0.02 -1.90 1.65 0.25 -2.79 0.00 0.00 177.10 174.34 2goi h LEU 27 N -0.88 -0.45 -0.88 3.21 5.85 -1.92 -2.00 115.31 118.24 2goi h LEU 27 Ca -0.44 0.15 0.23 0.00 0.84 0.00 0.00 57.88 58.66 2goi h LEU 27 Cb 1.23 0.31 -0.13 0.00 0.37 0.00 0.00 40.66 42.44 2goi h LEU 27 CO 0.52 -0.16 0.32 0.00 -0.34 0.00 0.00 178.44 178.78 2goi h ALA 28 N 1.51 1.36 -0.24 1.25 0.00 -1.93 -0.50 119.26 120.71 2goi h ALA 28 Ca 0.25 0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.40 2goi h ALA 28 Cb 0.38 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 2goi h ALA 28 CO -0.52 -0.41 -0.14 -0.44 0.00 0.00 0.00 179.25 177.75 2goi h ASP 29 N 0.30 -0.46 -0.61 0.00 3.32 -1.69 0.20 116.42 117.49 2goi h ASP 29 Ca 0.55 0.10 -0.05 0.00 0.02 0.00 0.00 57.03 57.66 2goi h ASP 29 Cb 1.09 0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.86 2goi h ASP 29 CO -0.58 -0.17 0.18 -0.50 -1.72 0.00 0.00 179.24 176.44 2goi h TRP 30 N -0.12 0.99 -0.15 4.55 4.06 -1.12 -0.37 115.95 123.81 2goi h TRP 30 Ca 0.13 -0.11 -0.02 0.00 2.06 0.00 0.00 58.89 60.95 2goi h TRP 30 Cb 0.32 -0.28 -0.01 0.00 -1.00 0.00 0.00 29.16 28.19 2goi h TRP 30 CO -0.31 0.83 0.00 0.28 -3.56 0.00 0.00 178.44 175.68 2goi h VAL 31 N 0.87 1.25 -0.72 1.49 2.07 -0.87 -1.46 116.25 118.89 2goi h VAL 31 Ca 0.19 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 2goi h VAL 31 Cb 0.31 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 2goi h VAL 31 CO -0.00 0.24 0.40 0.00 0.02 0.00 0.00 177.57 178.23 2goi h LEU 33 N 1.00 0.72 -0.72 0.00 5.85 -0.80 -2.53 115.31 118.82 2goi h LEU 33 Ca 0.25 -0.11 -0.12 0.00 0.84 0.00 0.00 57.88 58.75 2goi h LEU 33 Cb 0.01 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2goi h LEU 33 CO -0.04 0.62 -0.34 0.00 -0.34 0.00 0.00 178.44 178.34 2goi h ALA 34 N 1.13 0.90 0.07 1.25 0.00 -0.64 -1.24 119.26 120.73 2goi h ALA 34 Ca 0.20 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2goi h ALA 34 Cb 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2goi h ALA 34 CO -0.03 0.63 -0.04 -0.92 0.00 0.00 0.00 179.25 178.89 2goi h TYR 35 N 0.50 -0.09 0.00 0.00 3.20 -1.11 -1.33 116.97 118.14 2goi h TYR 35 Ca 0.06 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2goi h TYR 35 Cb 0.83 0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.13 2goi h TYR 35 CO 0.03 0.17 -0.08 1.88 -1.64 0.00 0.00 178.16 178.52 2goi h TYR 36 N -0.35 0.00 0.00 -3.82 -1.99 -1.39 0.17 116.97 109.60 2goi h TYR 36 Ca -0.01 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.67 2goi h TYR 36 Cb 0.30 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.02 2goi h TYR 36 CO 0.01 0.00 -0.35 1.79 -0.00 0.00 0.00 178.16 179.61 2goi h THR 37 N 0.00 1.05 0.00 -2.88 1.35 -1.22 -3.45 112.91 107.76 2goi h THR 37 Ca 0.00 -1.90 0.00 0.00 -0.55 0.00 0.00 66.41 63.96 2goi h THR 37 Cb 0.77 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 2goi h THR 37 CO 0.00 0.36 0.00 -1.54 -0.25 0.00 0.00 175.52 174.09 2goi n SER 38 N -4.60 0.08 -2.13 5.36 3.41 -0.62 -4.87 113.62 110.25 2goi n SER 38 Ca -0.13 -0.40 -0.16 0.00 -0.26 0.00 0.00 58.87 57.91 2goi n SER 38 Cb 0.41 0.56 0.01 0.00 -0.26 0.00 0.00 64.21 64.93 2goi n SER 38 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2goi n GLY 39 N 0.56 -0.24 2.42 5.00 0.00 0.61 -2.43 105.19 111.11 2goi n GLY 39 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2goi n GLY 39 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2goi n PHE 40 N -4.13 0.00 -3.06 1.61 3.72 -1.12 -4.86 117.46 109.62 2goi n PHE 40 Ca -0.12 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.85 2goi n PHE 40 Cb 0.61 -0.13 -0.06 0.00 -0.94 0.00 0.00 39.48 38.96 2goi n PHE 40 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2goi s ASN 41 N -2.32 6.32 0.30 4.37 2.47 -1.02 -2.30 114.94 122.77 2goi s ASN 41 Ca 0.00 -0.40 0.23 0.00 0.42 0.00 0.00 52.86 53.11 2goi s ASN 41 Cb 0.00 -2.34 1.10 0.00 -1.45 0.00 0.00 41.25 38.56 2goi s ASN 41 CO 0.00 -0.88 1.70 0.35 -3.72 0.00 0.00 177.10 174.55 2goi n THR 42 N 5.91 0.92 0.33 -5.21 -2.24 -0.64 -2.40 114.28 110.95 2goi n THR 42 Ca -0.01 0.49 0.08 0.00 -2.27 0.00 0.00 64.05 62.34 2goi n THR 42 Cb 0.47 -1.46 0.13 0.00 -2.10 0.00 0.00 70.33 67.38 2goi n THR 42 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2goi n ASN 43 N -2.28 2.80 -4.74 3.42 2.85 -1.26 -3.98 115.26 112.06 2goi n ASN 43 Ca 0.00 -1.82 -0.41 0.00 -0.11 0.00 0.00 54.58 52.24 2goi n ASN 43 Cb 0.13 -0.14 0.01 0.00 1.24 0.00 0.00 39.78 41.02 2goi n ASN 43 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2goi n ALA 44 N 0.99 1.90 -3.25 5.20 0.00 -1.01 -4.79 120.51 119.55 2goi n ALA 44 Ca 0.13 0.31 -0.13 0.00 0.00 0.00 0.00 53.44 53.75 2goi n ALA 44 Cb 0.46 -2.36 -0.11 0.00 0.00 0.00 0.00 19.45 17.44 2goi n ALA 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2goi s VAL 45 N -1.15 -0.00 -0.04 0.00 0.11 -1.26 -1.11 120.40 116.94 2goi s VAL 45 Ca 0.57 0.02 0.04 0.00 -2.93 0.00 0.00 61.98 59.68 2goi s VAL 45 Cb -0.49 -0.43 -0.00 0.00 -1.53 0.00 0.00 36.38 33.93 2goi s VAL 45 CO 0.61 0.01 -0.17 -0.62 -3.33 0.00 0.00 175.10 171.59 2goi s ASP 46 N 0.31 2.20 -0.30 3.54 2.15 -0.68 -4.96 116.67 118.91 2goi s ASP 46 Ca -0.01 -0.36 -0.05 0.00 0.43 0.00 0.00 52.55 52.55 2goi s ASP 46 Cb -0.03 -0.62 0.03 0.00 -0.30 0.00 0.00 42.92 41.99 2goi s ASP 46 CO -0.01 0.15 0.06 -1.00 -0.17 0.00 0.00 175.17 174.21 2goi s HIS 47 N 0.05 3.19 0.48 -5.34 3.76 -1.26 -0.47 115.29 115.69 2goi s HIS 47 Ca -0.04 -1.31 -0.08 0.00 -0.15 0.00 0.00 55.06 53.48 2goi s HIS 47 Cb -0.12 -2.22 0.11 0.00 1.11 0.00 0.00 32.58 31.46 2goi s HIS 47 CO 0.02 -0.68 0.61 0.39 -0.85 0.00 0.00 174.74 174.24 2goi n GLU 48 N 4.80 -0.82 -0.02 1.40 1.02 0.66 -4.92 120.64 122.75 2goi n GLU 48 Ca -0.14 -0.95 -0.13 0.00 -0.02 0.00 0.00 57.16 55.92 2goi n GLU 48 Cb 0.46 -0.66 -0.10 0.00 -0.02 0.00 0.00 31.44 31.12 2goi n GLU 48 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2goi h ALA 49 N -1.97 0.02 -1.02 0.62 0.00 -1.99 -2.52 119.26 112.40 2goi h ALA 49 Ca -0.20 -0.24 0.32 0.00 0.00 0.00 0.00 54.91 54.78 2goi h ALA 49 Cb 0.56 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.28 2goi h ALA 49 CO 0.14 -0.24 0.69 -0.25 0.00 0.00 0.00 179.25 179.60 2goi n ASP 50 N -4.84 0.07 0.00 0.00 8.00 -1.26 -4.79 116.55 113.73 2goi n ASP 50 Ca -0.08 0.74 0.00 0.00 0.71 0.00 0.00 54.79 56.16 2goi n ASP 50 Cb 0.25 -0.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 2goi n ASP 50 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2goi n GLY 51 N -1.43 1.56 3.78 0.44 0.00 -0.95 -5.07 105.19 103.53 2goi n GLY 51 Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.97 2goi n GLY 51 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2goi s SER 52 N -3.25 4.64 0.08 1.61 1.04 -1.26 -4.67 113.70 111.89 2goi s SER 52 Ca 0.00 1.70 0.09 0.00 0.48 0.00 0.00 55.95 58.22 2goi s SER 52 Cb 0.00 -2.45 -0.03 0.00 0.10 0.00 0.00 66.02 63.64 2goi s SER 52 CO 0.00 -1.93 -0.21 0.42 0.98 0.00 0.00 173.24 172.50 2goi s THR 53 N -2.96 2.61 -0.17 2.02 -4.23 -1.26 -0.25 115.64 111.40 2goi s THR 53 Ca 0.60 -1.39 -0.07 0.00 -1.18 0.00 0.00 61.69 59.65 2goi s THR 53 Cb -0.16 -2.12 -0.04 0.00 1.34 0.00 0.00 72.50 71.52 2goi s THR 53 CO 0.56 0.24 0.06 0.20 -0.54 0.00 0.00 174.62 175.14 2goi s ASN 54 N -1.69 5.64 -0.09 3.99 0.01 0.39 -1.22 114.94 121.97 2goi s ASN 54 Ca 0.15 0.11 0.03 0.00 -0.71 0.00 0.00 52.86 52.43 2goi s ASN 54 Cb -0.10 -1.94 0.01 0.00 0.41 0.00 0.00 41.25 39.63 2goi s ASN 54 CO 0.06 0.20 -0.17 0.20 -1.51 0.00 0.00 177.10 175.88 2goi s ASN 55 N 0.22 2.43 0.02 -1.22 -0.87 0.42 -1.69 114.94 114.26 2goi s ASN 55 Ca 0.04 -0.43 0.00 0.00 -1.57 0.00 0.00 52.86 50.90 2goi s ASN 55 Cb -0.12 -1.11 0.00 0.00 -0.02 0.00 0.00 41.25 40.00 2goi s ASN 55 CO 0.00 0.07 0.00 0.61 -2.57 0.00 0.00 177.10 175.21 2goi n GLY 56 N 3.86 -1.98 0.45 0.66 0.00 -0.27 -1.88 105.19 106.03 2goi n GLY 56 Ca -0.20 -1.40 0.26 0.00 0.00 0.00 0.00 46.02 44.67 2goi n GLY 56 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2goi h ILE 57 N 0.00 0.35 -0.02 -0.61 6.09 -1.69 -0.30 117.51 121.32 2goi h ILE 57 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2goi h ILE 57 Cb 0.00 0.49 0.00 0.00 0.47 0.00 0.00 36.82 37.78 2goi h ILE 57 CO 0.00 0.00 0.00 0.49 -3.07 0.00 0.00 178.15 175.57 2goi n PHE 58 N -3.82 0.03 -3.71 2.19 3.72 -1.26 -4.20 117.46 110.41 2goi n PHE 58 Ca 0.15 -0.36 -0.22 0.00 -0.05 0.00 0.00 57.45 56.97 2goi n PHE 58 Cb 0.94 -0.03 0.04 0.00 -0.94 0.00 0.00 39.48 39.48 2goi n PHE 58 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2goi n GLN 59 N -0.27 -5.25 -2.32 -1.08 1.13 -0.12 -4.89 117.38 104.57 2goi n GLN 59 Ca 0.01 0.64 -0.41 0.00 -1.94 0.00 0.00 57.00 55.30 2goi n GLN 59 Cb 0.20 -5.30 -0.03 0.00 0.11 0.00 0.00 30.24 25.21 2goi n GLN 59 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2goi s ILE 60 N -3.58 3.45 -0.11 5.09 1.01 -0.79 -4.06 121.20 122.21 2goi s ILE 60 Ca 0.13 1.21 -0.20 0.00 0.00 0.00 0.00 60.65 61.78 2goi s ILE 60 Cb -0.06 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 2goi s ILE 60 CO 0.81 0.19 0.57 -0.55 0.00 0.00 0.00 174.94 175.96 2goi s SER 61 N 0.18 6.79 0.00 3.58 0.15 -1.26 -0.43 113.70 122.71 2goi s SER 61 Ca 0.54 0.94 0.06 0.00 0.70 0.00 0.00 55.95 58.19 2goi s SER 61 Cb -0.34 -2.34 0.27 0.00 -1.71 0.00 0.00 66.02 61.90 2goi s SER 61 CO 0.37 -0.08 1.14 -1.54 1.20 0.00 0.00 173.24 174.34 2goi n SER 62 N 3.90 0.00 0.22 5.45 3.41 -0.35 -1.74 113.62 124.51 2goi n SER 62 Ca -0.04 0.40 0.11 0.00 -0.26 0.00 0.00 58.87 59.08 2goi n SER 62 Cb 0.51 -0.43 0.35 0.00 -0.26 0.00 0.00 64.21 64.38 2goi n SER 62 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2goi h ARG 63 N 0.00 0.00 0.00 4.33 3.08 -1.82 -3.42 114.38 116.55 2goi h ARG 63 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2goi h ARG 63 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2goi h ARG 63 CO 0.00 0.14 -0.08 -2.13 -1.07 0.00 0.00 179.97 176.83 2goi n ARG 64 N -3.19 0.20 -0.02 0.04 0.63 -0.99 -4.40 116.66 108.93 2goi n ARG 64 Ca 0.02 0.00 -0.00 0.00 -0.92 0.00 0.00 57.85 56.94 2goi n ARG 64 Cb 0.48 -0.54 -0.05 0.00 0.45 0.00 0.00 32.46 32.81 2goi n ARG 64 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2goi n TRP 65 N -0.97 0.00 -4.23 -0.14 7.02 -0.71 -1.00 117.44 117.42 2goi n TRP 65 Ca 0.00 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.35 2goi n TRP 65 Cb 0.04 -0.23 -0.10 0.00 -2.42 0.00 0.00 31.31 28.60 2goi n TRP 65 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2goi s ARG 67 N -3.94 3.97 0.40 0.00 3.52 0.25 -4.43 118.95 118.73 2goi s ARG 67 Ca 0.24 -0.34 0.04 0.00 -0.13 0.00 0.00 55.73 55.54 2goi s ARG 67 Cb 0.06 -3.26 -0.04 0.00 -1.56 0.00 0.00 34.95 30.15 2goi s ARG 67 CO 0.04 0.22 0.06 0.95 -0.81 0.00 0.00 175.30 175.76 2goi s THR 68 N 0.52 1.09 0.02 4.11 -4.23 -1.26 -0.65 115.64 115.24 2goi s THR 68 Ca 0.04 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.48 2goi s THR 68 Cb -0.13 -2.54 -0.05 0.00 1.34 0.00 0.00 72.50 71.13 2goi s THR 68 CO 0.01 0.00 0.28 -0.76 -0.54 0.00 0.00 174.62 173.61 2goi s LEU 69 N -3.64 4.37 -0.29 4.79 1.43 -1.26 -4.47 118.68 119.60 2goi s LEU 69 Ca 0.26 0.57 0.01 0.00 -1.03 0.00 0.00 54.13 53.94 2goi s LEU 69 Cb 0.05 -2.72 0.19 0.00 0.03 0.00 0.00 46.19 43.75 2goi s LEU 69 CO 0.13 0.24 0.68 0.00 0.23 0.00 0.00 176.35 177.63 2goi s ALA 70 N -1.32 -2.65 -0.93 4.21 0.00 -1.26 -5.00 121.76 114.80 2goi s ALA 70 Ca 0.28 1.29 -0.02 0.00 0.00 0.00 0.00 51.96 53.52 2goi s ALA 70 Cb -0.13 -2.50 0.00 0.00 0.00 0.00 0.00 23.12 20.49 2goi s ALA 70 CO 0.17 -1.74 0.79 0.45 0.00 0.00 0.00 175.76 175.43 2goi n SER 71 N 5.38 -2.85 -4.73 0.00 2.88 -1.26 -5.15 113.62 107.89 2goi n SER 71 Ca 0.04 -0.45 -0.30 0.00 -1.33 0.00 0.00 58.87 56.83 2goi n SER 71 Cb 0.54 -3.97 0.13 0.00 -0.75 0.00 0.00 64.21 60.16 2goi n SER 71 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2goi s ASN 72 N -3.83 3.55 0.02 -3.46 4.22 -1.26 -4.23 114.94 109.94 2goi s ASN 72 Ca 0.11 1.43 -0.29 0.00 -2.14 0.00 0.00 52.86 51.97 2goi s ASN 72 Cb -0.05 -2.11 0.10 0.00 1.28 0.00 0.00 41.25 40.47 2goi s ASN 72 CO 0.55 -2.58 1.14 -0.83 -2.04 0.00 0.00 177.10 173.34 2goi s GLY 73 N -3.50 -0.35 0.60 0.45 0.00 -1.26 -4.95 107.32 98.31 2goi s GLY 73 Ca 0.63 0.65 0.40 0.00 0.00 0.00 0.00 44.72 46.41 2goi s GLY 73 CO 0.56 0.15 2.22 -0.56 0.00 0.00 0.00 173.10 175.48 2goi h PRO 74 N 2.00 0.00 -6.49 2.90 0.13 -1.77 -3.47 132.00 125.30 2goi h PRO 74 Ca -0.25 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.39 2goi h PRO 74 Cb 1.21 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.36 2goi h PRO 74 CO 0.27 0.00 -0.95 -1.71 -0.23 0.00 0.00 178.00 175.38 2goi n ASN 75 N -2.98 -3.76 0.19 1.44 5.15 -0.85 -4.80 115.26 109.65 2goi n ASN 75 Ca -0.02 -1.10 0.05 0.00 -0.60 0.00 0.00 54.58 52.91 2goi n ASN 75 Cb 0.12 -2.82 0.39 0.00 -0.53 0.00 0.00 39.78 36.93 2goi n ASN 75 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2goi h LEU 76 N -2.07 0.00 -0.07 1.20 3.38 -1.01 -0.99 115.31 115.75 2goi h LEU 76 Ca -0.67 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.30 2goi h LEU 76 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2goi h LEU 76 CO 0.53 0.36 -0.03 0.00 0.09 0.00 0.00 178.44 179.39 2goi n ARG 78 N -1.12 -2.08 -3.64 0.00 1.74 -0.38 -5.00 116.66 106.19 2goi n ARG 78 Ca 0.16 0.58 -0.14 0.00 -0.77 0.00 0.00 57.85 57.68 2goi n ARG 78 Cb 0.23 -4.72 -0.08 0.00 -1.02 0.00 0.00 32.46 26.88 2goi n ARG 78 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 2goi s ILE 79 N -3.49 0.00 0.23 0.55 2.07 -1.26 -5.07 121.20 114.23 2goi s ILE 79 Ca 0.39 -0.01 -0.30 0.00 -1.41 0.00 0.00 60.65 59.31 2goi s ILE 79 Cb -0.11 -0.91 -0.10 0.00 0.13 0.00 0.00 42.46 41.47 2goi s ILE 79 CO 0.82 -0.01 1.48 -0.31 -1.91 0.00 0.00 174.94 175.01 2goi s TYR 80 N 0.09 3.02 0.33 3.50 1.51 -1.26 -0.58 117.35 123.95 2goi s TYR 80 Ca -0.02 0.92 0.12 0.00 -1.01 0.00 0.00 57.07 57.08 2goi s TYR 80 Cb -0.04 -3.86 1.00 0.00 -0.11 0.00 0.00 41.96 38.95 2goi s TYR 80 CO 0.02 -2.89 1.68 0.00 -1.11 0.00 0.00 175.55 173.25 2goi h THR 82 N 0.37 0.53 0.00 0.00 1.03 -1.91 0.33 112.91 113.25 2goi h THR 82 Ca 0.69 -0.35 0.00 0.00 -0.01 0.00 0.00 66.41 66.74 2goi h THR 82 Cb 1.51 1.23 0.00 0.00 -1.07 0.00 0.00 68.15 69.81 2goi h THR 82 CO -0.58 0.08 0.00 0.47 -0.01 0.00 0.00 175.52 175.47 2goi n ASP 83 N -3.68 0.71 -0.12 0.00 9.92 -0.36 -2.34 116.55 120.68 2goi n ASP 83 Ca -0.02 0.63 0.12 0.00 -0.53 0.00 0.00 54.79 54.99 2goi n ASP 83 Cb 0.18 -0.80 0.65 0.00 -0.64 0.00 0.00 41.12 40.52 2goi n ASP 83 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2goi n LEU 84 N -2.24 0.37 -1.95 0.64 4.77 0.10 -3.99 117.00 114.70 2goi n LEU 84 Ca 0.03 -0.14 -0.03 0.00 -0.03 0.00 0.00 56.01 55.84 2goi n LEU 84 Cb 0.30 -0.01 0.32 0.00 -2.33 0.00 0.00 43.42 41.70 2goi n LEU 84 CO 0.23 0.07 1.00 0.18 -1.33 0.00 0.00 177.39 177.55 2goi n LEU 85 N -0.62 5.98 -4.84 2.23 4.77 -0.99 -4.14 117.00 119.39 2goi n LEU 85 Ca 0.18 -3.18 -0.33 0.00 -0.03 0.00 0.00 56.01 52.65 2goi n LEU 85 Cb 0.14 -0.73 -0.06 0.00 -2.33 0.00 0.00 43.42 40.44 2goi n LEU 85 CO 0.14 0.79 0.49 0.21 -1.33 0.00 0.00 177.39 177.69 2goi s ASN 86 N -1.05 6.81 0.38 -1.43 3.84 -1.26 -4.44 114.94 117.79 2goi s ASN 86 Ca 0.55 1.40 0.05 0.00 0.21 0.00 0.00 52.86 55.07 2goi s ASN 86 Cb 0.44 -2.42 0.75 0.00 -0.55 0.00 0.00 41.25 39.46 2goi s ASN 86 CO 0.14 -0.27 2.02 0.78 -2.79 0.00 0.00 177.10 176.98 2goi h ASN 87 N 2.09 0.61 -3.46 -4.21 4.21 -1.94 -3.40 115.58 109.48 2goi h ASN 87 Ca -0.48 -0.01 -0.53 0.00 1.21 0.00 0.00 56.30 56.48 2goi h ASN 87 Cb 1.18 -0.15 -0.02 0.00 -1.12 0.00 0.00 38.32 38.21 2goi h ASN 87 CO 0.64 0.43 0.37 -0.62 -1.29 0.00 0.00 177.43 176.96 2goi s ASP 88 N -6.50 7.41 0.00 5.81 -1.08 -1.26 -4.97 116.67 116.07 2goi s ASP 88 Ca -0.09 1.71 0.29 0.00 -0.52 0.00 0.00 52.55 53.94 2goi s ASP 88 Cb 0.18 -2.58 1.29 0.00 -1.46 0.00 0.00 42.92 40.35 2goi s ASP 88 CO 0.75 -0.19 1.90 0.18 0.52 0.00 0.00 175.17 178.32 2goi n LEU 89 N 3.52 0.46 -0.26 -1.34 4.77 -1.26 -4.53 117.00 118.36 2goi n LEU 89 Ca 0.05 -0.01 -0.01 0.00 -0.03 0.00 0.00 56.01 56.01 2goi n LEU 89 Cb 0.50 -0.16 0.11 0.00 -2.33 0.00 0.00 43.42 41.54 2goi n LEU 89 CO 0.52 0.08 1.13 0.07 -1.33 0.00 0.00 177.39 177.86 2goi h LYS 90 N 0.59 0.78 -0.12 3.23 2.10 -1.93 0.47 116.57 121.68 2goi h LYS 90 Ca 0.00 -0.05 -0.11 0.00 -2.00 0.00 0.00 60.65 58.49 2goi h LYS 90 Cb 0.33 -0.18 -0.01 0.00 -0.90 0.00 0.00 32.23 31.47 2goi h LYS 90 CO 0.00 0.52 -0.41 -0.44 -2.00 0.00 0.00 179.45 177.12 2goi h ASP 91 N 0.80 0.28 0.00 7.07 3.32 -1.91 -0.14 116.42 125.84 2goi h ASP 91 Ca 0.32 -0.12 -0.18 0.00 0.02 0.00 0.00 57.03 57.08 2goi h ASP 91 Cb 0.16 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 2goi h ASP 91 CO -0.17 0.66 -0.61 0.28 -1.72 0.00 0.00 179.24 177.68 2goi h SER 92 N 0.22 0.68 -0.11 6.45 0.02 -1.56 -2.67 113.55 116.59 2goi h SER 92 Ca 0.02 -0.39 -0.06 0.00 -0.84 0.00 0.00 61.79 60.52 2goi h SER 92 Cb 0.82 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 2goi h SER 92 CO 0.06 1.13 -0.17 0.40 -1.14 0.00 0.00 176.83 177.12 2goi h ILE 93 N 0.45 1.37 -0.95 3.27 1.08 -0.74 0.86 117.51 122.85 2goi h ILE 93 Ca -0.01 -1.40 0.04 0.00 -0.39 0.00 0.00 64.86 63.10 2goi h ILE 93 Cb 1.18 2.03 -0.06 0.00 -3.07 0.00 0.00 36.82 36.90 2goi h ILE 93 CO 0.12 0.41 0.62 0.58 -0.69 0.00 0.00 178.15 179.18 2goi h VAL 94 N -0.10 1.15 0.00 1.67 2.07 -1.04 0.56 116.25 120.56 2goi h VAL 94 Ca 0.01 -0.41 -0.21 0.00 0.82 0.00 0.00 66.70 66.91 2goi h VAL 94 Cb 0.73 -0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 2goi h VAL 94 CO 0.04 0.22 -0.91 0.00 0.02 0.00 0.00 177.57 176.94 2goi h ALA 96 N 0.86 0.77 -0.51 0.00 0.00 -0.37 0.49 119.26 120.50 2goi h ALA 96 Ca -0.06 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2goi h ALA 96 Cb 1.54 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.13 2goi h ALA 96 CO 0.15 0.66 0.32 0.52 0.00 0.00 0.00 179.25 180.90 2goi h MET 97 N 0.84 0.69 0.54 0.00 2.86 -0.71 0.14 114.93 119.29 2goi h MET 97 Ca 0.12 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 2goi h MET 97 Cb 0.73 -0.15 0.01 0.00 0.06 0.00 0.00 31.60 32.24 2goi h MET 97 CO 0.06 0.47 -0.26 0.87 1.06 0.00 0.00 176.91 179.11 2goi h LYS 98 N 0.70 -0.70 -0.52 1.72 6.56 -0.81 -3.25 116.57 120.27 2goi h LYS 98 Ca 0.19 0.05 0.10 0.00 -1.06 0.00 0.00 60.65 59.93 2goi h LYS 98 Cb -0.04 0.16 -0.09 0.00 -0.57 0.00 0.00 32.23 31.68 2goi h LYS 98 CO -0.04 -0.42 -0.07 0.82 -2.06 0.00 0.00 179.45 177.68 2goi h ILE 99 N -0.87 0.52 0.00 1.86 2.04 -0.44 -2.29 117.51 118.34 2goi h ILE 99 Ca -0.07 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.77 2goi h ILE 99 Cb 0.61 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2goi h ILE 99 CO 0.12 0.01 0.00 1.33 0.00 0.00 0.00 178.15 179.61 2goi n VAL 100 N -5.32 1.24 0.74 1.67 0.24 0.46 -0.82 118.33 116.55 2goi n VAL 100 Ca 0.06 0.51 0.13 0.00 -2.04 0.00 0.00 64.34 62.99 2goi n VAL 100 Cb 0.28 -1.46 0.49 0.00 -1.47 0.00 0.00 33.84 31.68 2goi n VAL 100 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2goi n GLN 101 N -1.96 0.14 -1.31 7.34 6.02 -0.86 -3.96 117.38 122.80 2goi n GLN 101 Ca 0.00 0.15 -0.30 0.00 -0.01 0.00 0.00 57.00 56.85 2goi n GLN 101 Cb 0.08 -1.68 0.13 0.00 1.02 0.00 0.00 30.24 29.79 2goi n GLN 101 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2goi s GLU 102 N -3.07 1.38 0.57 -1.09 0.41 -0.00 -4.92 118.70 111.98 2goi s GLU 102 Ca 0.11 0.72 0.33 0.00 -0.41 0.00 0.00 54.97 55.72 2goi s GLU 102 Cb 0.14 -1.83 1.74 0.00 -1.78 0.00 0.00 34.13 32.41 2goi s GLU 102 CO 0.54 -2.13 2.16 -1.35 -0.49 0.00 0.00 175.26 173.99 2goi h PRO 103 N -1.46 0.00 0.00 0.39 0.11 -1.87 -2.49 132.00 126.68 2goi h PRO 103 Ca -0.49 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 2goi h PRO 103 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 2goi h PRO 103 CO 0.56 0.06 -0.28 -0.07 -0.21 0.00 0.00 178.00 178.06 2goi h LEU 104 N 0.00 0.00 0.00 2.35 3.38 -1.90 -3.49 115.31 115.64 2goi h LEU 104 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2goi h LEU 104 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2goi h LEU 104 CO 0.01 0.28 0.00 0.61 0.09 0.00 0.00 178.44 179.43 2goi n GLY 105 N 0.94 2.53 0.26 0.83 0.00 -0.94 -1.97 105.19 106.84 2goi n GLY 105 Ca 0.02 -0.39 0.17 0.00 0.00 0.00 0.00 46.02 45.82 2goi n GLY 105 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2goi h LEU 106 N 0.00 0.00 0.00 0.99 4.07 -1.92 -2.80 115.31 115.65 2goi h LEU 106 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2goi h LEU 106 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 2goi h LEU 106 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.97 2goi n GLY 107 N -0.12 -0.53 0.22 0.83 0.00 -0.83 -1.74 105.19 103.02 2goi n GLY 107 Ca 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 46.02 46.06 2goi n GLY 107 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2goi h TYR 108 N 0.00 0.00 -3.47 1.61 3.20 -1.67 -3.42 116.97 113.22 2goi h TYR 108 Ca 0.00 0.00 -0.60 0.00 3.14 0.00 0.00 58.73 61.27 2goi h TYR 108 Cb 0.06 0.00 -0.11 0.00 1.54 0.00 0.00 36.73 38.22 2goi h TYR 108 CO 0.00 0.20 -0.00 -1.58 -1.64 0.00 0.00 178.16 175.14 2goi s TRP 109 N -4.49 3.36 0.22 -3.82 0.51 -0.71 -4.96 118.94 109.04 2goi s TRP 109 Ca -0.04 0.78 -0.09 0.00 -2.12 0.00 0.00 56.10 54.64 2goi s TRP 109 Cb 0.15 -2.70 0.21 0.00 -0.81 0.00 0.00 33.47 30.32 2goi s TRP 109 CO 0.68 -0.15 1.87 1.49 -0.51 0.00 0.00 176.95 180.34 2goi h GLU 110 N 7.55 0.99 -0.92 4.98 4.81 -1.87 -0.91 114.58 129.20 2goi h GLU 110 Ca -0.32 -0.06 0.11 0.00 -0.13 0.00 0.00 59.36 58.96 2goi h GLU 110 Cb 1.15 -0.22 -0.07 0.00 0.63 0.00 0.00 28.75 30.24 2goi h GLU 110 CO 0.74 0.65 0.59 0.00 -0.73 0.00 0.00 179.01 180.27 2goi h ALA 111 N 1.32 1.64 0.03 2.92 0.00 -1.93 0.21 119.26 123.46 2goi h ALA 111 Ca 0.31 0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.97 2goi h ALA 111 Cb -0.03 -0.19 0.02 0.00 0.00 0.00 0.00 17.79 17.58 2goi h ALA 111 CO -0.10 0.14 -1.06 2.35 0.00 0.00 0.00 179.25 180.58 2goi h TRP 112 N 0.88 0.86 -0.44 0.00 7.01 -1.67 -1.99 115.95 120.60 2goi h TRP 112 Ca 0.44 -0.49 -0.02 0.00 2.11 0.00 0.00 58.89 60.93 2goi h TRP 112 Cb 0.49 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.44 2goi h TRP 112 CO -0.00 1.33 0.20 0.00 -2.79 0.00 0.00 178.44 177.17 2goi h ARG 113 N 0.30 0.65 0.00 2.65 3.08 -0.50 0.09 114.38 120.65 2goi h ARG 113 Ca -0.13 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.82 2goi h ARG 113 Cb 1.72 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.66 2goi h ARG 113 CO 0.20 0.57 -0.20 0.72 -1.07 0.00 0.00 179.97 180.19 2goi n HIS 114 N -4.64 0.12 -0.13 3.04 8.25 0.68 -4.10 115.22 118.45 2goi n HIS 114 Ca 0.01 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2goi n HIS 114 Cb 0.13 -0.47 0.00 0.00 1.12 0.00 0.00 29.99 30.77 2goi n HIS 114 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2goi n HIS 115 N -1.61 0.00 0.00 4.41 8.25 -0.75 -4.94 115.22 120.58 2goi n HIS 115 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 2goi n HIS 115 Cb 0.35 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.46 2goi n HIS 115 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2goi s GLN 117 N -1.47 3.91 -1.00 0.00 0.74 -0.04 -3.83 119.66 117.96 2goi s GLN 117 Ca 0.00 1.17 0.00 0.00 0.05 0.00 0.00 55.36 56.58 2goi s GLN 117 Cb 0.00 -2.12 0.00 0.00 1.10 0.00 0.00 33.01 31.99 2goi s GLN 117 CO 0.00 -0.32 0.00 0.41 -0.55 0.00 0.00 175.29 174.83 2goi n GLY 118 N -0.79 0.68 3.21 2.59 0.00 -1.26 -4.92 105.19 104.69 2goi n GLY 118 Ca 0.08 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.46 2goi n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2goi s ARG 119 N -3.53 1.01 -0.13 1.61 0.52 -1.25 -5.13 118.95 112.05 2goi s ARG 119 Ca 0.00 -1.47 -0.26 0.00 -0.52 0.00 0.00 55.73 53.48 2goi s ARG 119 Cb 0.00 -0.18 -0.02 0.00 0.52 0.00 0.00 34.95 35.28 2goi s ARG 119 CO 0.00 -0.12 0.87 0.34 0.02 0.00 0.00 175.30 176.41 2goi s ASP 120 N -3.12 7.06 0.00 0.23 2.15 -1.26 -4.95 116.67 116.77 2goi s ASP 120 Ca 0.21 1.29 0.02 0.00 0.43 0.00 0.00 52.55 54.50 2goi s ASP 120 Cb 0.06 -2.48 0.01 0.00 -0.30 0.00 0.00 42.92 40.21 2goi s ASP 120 CO 0.01 -0.37 0.49 0.18 -0.17 0.00 0.00 175.17 175.32 2goi n LEU 121 N 4.93 1.01 0.25 -1.34 4.32 -1.26 -4.66 117.00 120.26 2goi n LEU 121 Ca 0.05 -0.93 0.11 0.00 -0.02 0.00 0.00 56.01 55.22 2goi n LEU 121 Cb 0.49 0.00 0.67 0.00 -1.62 0.00 0.00 43.42 42.96 2goi n LEU 121 CO 0.49 0.24 0.95 0.77 -1.22 0.00 0.00 177.39 178.62 2goi h SER 122 N 0.32 0.00 -1.16 -1.43 4.64 -1.95 0.33 113.55 114.30 2goi h SER 122 Ca 0.00 0.00 0.34 0.00 -0.47 0.00 0.00 61.79 61.66 2goi h SER 122 Cb 0.07 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.06 2goi h SER 122 CO 0.00 0.14 0.75 0.44 -0.87 0.00 0.00 176.83 177.29 2goi h ASP 123 N 0.00 0.34 0.96 4.97 3.32 -1.97 -1.33 116.42 122.72 2goi h ASP 123 Ca -0.00 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2goi h ASP 123 Cb 0.33 0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.94 2goi h ASP 123 CO 0.02 -0.03 0.00 -0.50 -1.72 0.00 0.00 179.24 177.01 2goi h TRP 124 N 0.25 0.00 -0.00 4.55 4.06 -1.28 -2.19 115.95 121.33 2goi h TRP 124 Ca 0.69 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.64 2goi h TRP 124 Cb 1.98 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 30.14 2goi h TRP 124 CO -0.00 0.00 -0.12 1.33 -3.56 0.00 0.00 178.44 176.08 2goi n VAL 125 N -2.47 0.00 -1.66 1.49 0.24 -0.71 -4.85 118.33 110.38 2goi n VAL 125 Ca 0.02 -0.44 -0.47 0.00 -2.04 0.00 0.00 64.34 61.42 2goi n VAL 125 Cb 0.29 1.03 -0.04 0.00 -1.47 0.00 0.00 33.84 33.65 2goi n VAL 125 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2goi n ASP 126 N -0.62 2.77 -3.23 -1.34 8.00 -0.59 -2.93 116.55 118.61 2goi n ASP 126 Ca 0.01 1.10 -0.16 0.00 0.71 0.00 0.00 54.79 56.46 2goi n ASP 126 Cb 0.08 -1.39 0.08 0.00 -0.02 0.00 0.00 41.12 39.87 2goi n ASP 126 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2goi n GLY 127 N 2.96 -0.30 0.09 0.44 0.00 -1.26 -4.99 105.19 102.13 2goi n GLY 127 Ca 0.16 0.06 -0.09 0.00 0.00 0.00 0.00 46.02 46.15 2goi n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32