#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jto s VAL 2 N 0.00 3.28 1.00 3.15 1.01 -1.26 -1.29 120.40 126.30 1jto s VAL 2 Ca 0.00 -2.97 -0.15 0.00 0.00 0.00 0.00 61.98 58.86 1jto s VAL 2 Cb 0.00 -3.19 0.05 0.00 0.00 0.00 0.00 36.38 33.24 1jto s VAL 2 CO 0.00 -0.83 0.25 0.49 0.00 0.00 0.00 175.10 175.01 1jto n PHE 3 N 3.49 -1.53 -4.05 5.22 3.01 -0.91 -4.98 117.46 117.71 1jto n PHE 3 Ca 0.06 0.20 -0.27 0.00 1.01 0.00 0.00 57.45 58.45 1jto n PHE 3 Cb 0.37 -1.71 -0.05 0.00 -0.01 0.00 0.00 39.48 38.08 1jto n PHE 3 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1jto s GLY 4 N -1.94 1.79 0.08 1.37 0.00 -1.26 -4.89 107.32 102.48 1jto s GLY 4 Ca 0.56 -1.13 -0.20 0.00 0.00 0.00 0.00 44.72 43.95 1jto s GLY 4 CO 0.67 -1.13 1.33 -0.09 0.00 0.00 0.00 173.10 173.88 1jto h ARG 5 N 2.56 -0.16 0.00 2.90 2.43 -1.96 -0.68 114.38 119.46 1jto h ARG 5 Ca -0.47 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 58.66 1jto h ARG 5 Cb 1.19 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 1jto h ARG 5 CO 0.65 -0.11 -0.20 0.00 -1.51 0.00 0.00 179.97 178.80 1jto h GLU 7 N 0.00 -0.08 -0.57 0.00 4.81 -1.74 -1.95 114.58 115.06 1jto h GLU 7 Ca -0.00 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1jto h GLU 7 Cb 0.37 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1jto h GLU 7 CO 0.03 0.13 0.19 1.25 -0.73 0.00 0.00 179.01 179.87 1jto h LEU 8 N -0.27 0.82 -0.66 1.64 5.85 -0.90 -1.45 115.31 120.34 1jto h LEU 8 Ca -0.01 -0.20 0.11 0.00 0.84 0.00 0.00 57.88 58.62 1jto h LEU 8 Cb 0.24 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 40.97 1jto h LEU 8 CO 0.01 0.80 0.24 0.00 -0.34 0.00 0.00 178.44 179.15 1jto h ALA 9 N 1.05 0.87 0.24 1.25 0.00 -1.06 0.20 119.26 121.81 1jto h ALA 9 Ca 0.18 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1jto h ALA 9 Cb 0.27 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1jto h ALA 9 CO -0.01 -0.21 -0.12 0.00 0.00 0.00 0.00 179.25 178.92 1jto h ALA 10 N 1.47 -0.32 0.00 0.00 0.00 -0.99 -1.36 119.26 118.06 1jto h ALA 10 Ca 0.34 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1jto h ALA 10 Cb 0.47 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1jto h ALA 10 CO -0.35 -0.64 -0.04 0.00 0.00 0.00 0.00 179.25 178.21 1jto h ALA 11 N 0.34 1.74 0.13 0.00 0.00 -0.46 -1.94 119.26 119.07 1jto h ALA 11 Ca -0.03 -0.04 -0.29 0.00 0.00 0.00 0.00 54.91 54.55 1jto h ALA 11 Cb 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1jto h ALA 11 CO 0.05 0.06 -1.34 0.52 0.00 0.00 0.00 179.25 178.54 1jto h MET 12 N 0.00 0.27 -0.53 0.00 2.86 -0.43 -3.08 114.93 114.01 1jto h MET 12 Ca -0.00 -0.46 -0.03 0.00 -2.06 0.00 0.00 59.70 57.15 1jto h MET 12 Cb 0.09 0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.89 1jto h MET 12 CO 0.01 1.18 0.20 -0.22 1.06 0.00 0.00 176.91 179.14 1jto h LYS 13 N 0.07 0.77 0.00 1.72 3.64 -0.67 -1.10 116.57 121.00 1jto h LYS 13 Ca -0.17 -0.12 -0.04 0.00 -1.27 0.00 0.00 60.65 59.05 1jto h LYS 13 Cb 1.99 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 33.67 1jto h LYS 13 CO 0.19 0.64 -0.18 -0.09 -2.27 0.00 0.00 179.45 177.75 1jto h ARG 14 N 0.76 0.00 -0.66 1.90 2.43 -1.39 -1.92 114.38 115.50 1jto h ARG 14 Ca 0.18 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1jto h ARG 14 Cb 0.16 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1jto h ARG 14 CO -0.02 0.18 0.02 0.72 -1.51 0.00 0.00 179.97 179.36 1jto n HIS 15 N -3.76 1.80 -2.24 2.20 8.25 -0.45 -4.93 115.22 116.08 1jto n HIS 15 Ca -0.02 -0.64 -0.21 0.00 -0.26 0.00 0.00 57.72 56.59 1jto n HIS 15 Cb 0.28 -0.46 -0.03 0.00 1.12 0.00 0.00 29.99 30.90 1jto n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jto n GLY 16 N 0.48 0.00 0.21 -1.41 0.00 -0.72 -4.87 105.19 98.89 1jto n GLY 16 Ca 0.24 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.40 1jto n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1jto h LEU 17 N 0.00 0.00 -9.18 0.99 3.38 -1.67 -3.40 115.31 105.43 1jto h LEU 17 Ca -0.48 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 56.94 1jto h LEU 17 Cb 1.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 1jto h LEU 17 CO 0.59 0.00 1.16 -0.62 0.09 0.00 0.00 178.44 179.66 1jto s ASP 18 N -5.83 6.43 -1.06 -0.43 2.15 -1.26 -1.90 116.67 114.77 1jto s ASP 18 Ca 0.06 2.08 0.00 0.00 0.43 0.00 0.00 52.55 55.12 1jto s ASP 18 Cb 0.07 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 1jto s ASP 18 CO 0.63 -1.14 0.00 0.59 -0.17 0.00 0.00 175.17 175.07 1jto n ASN 19 N 8.03 -4.42 -4.69 -0.34 3.02 0.88 -4.87 115.26 112.87 1jto n ASN 19 Ca 0.19 0.25 -0.42 0.00 -0.03 0.00 0.00 54.58 54.57 1jto n ASN 19 Cb 0.43 -2.80 -0.03 0.00 -0.61 0.00 0.00 39.78 36.78 1jto n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1jto s TYR 20 N -2.30 2.61 -1.63 3.10 5.04 -0.80 -0.90 117.35 122.48 1jto s TYR 20 Ca 0.00 0.57 0.00 0.00 -2.44 0.00 0.00 57.07 55.20 1jto s TYR 20 Cb 0.00 -3.80 0.00 0.00 0.35 0.00 0.00 41.96 38.51 1jto s TYR 20 CO 0.00 -3.12 0.00 0.54 -1.34 0.00 0.00 175.55 171.63 1jto n ARG 21 N 5.62 -1.52 -0.55 4.97 5.12 -1.26 -0.50 116.66 128.54 1jto n ARG 21 Ca 0.15 0.99 0.00 0.00 -1.93 0.00 0.00 57.85 57.05 1jto n ARG 21 Cb 0.42 -5.33 0.00 0.00 -1.16 0.00 0.00 32.46 26.40 1jto n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1jto n GLY 22 N -0.12 0.74 3.56 -0.13 0.00 -0.07 -5.04 105.19 104.13 1jto n GLY 22 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1jto n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jto s TYR 23 N -2.33 3.12 0.61 1.61 2.02 0.35 -4.81 117.35 117.92 1jto s TYR 23 Ca 0.00 0.28 -0.19 0.00 -0.37 0.00 0.00 57.07 56.80 1jto s TYR 23 Cb 0.00 -3.25 -0.03 0.00 -0.40 0.00 0.00 41.96 38.28 1jto s TYR 23 CO 0.00 -0.71 1.23 -1.54 -1.57 0.00 0.00 175.55 172.96 1jto s SER 24 N 1.87 5.05 0.48 2.29 1.04 -1.26 -0.08 113.70 123.08 1jto s SER 24 Ca 0.25 2.45 0.32 0.00 0.48 0.00 0.00 55.95 59.46 1jto s SER 24 Cb -0.14 -2.60 1.43 0.00 0.10 0.00 0.00 66.02 64.81 1jto s SER 24 CO 0.16 -1.69 1.71 0.25 0.98 0.00 0.00 173.24 174.65 1jto h LEU 25 N 0.81 0.18 -1.83 2.42 5.85 -1.90 -1.02 115.31 119.83 1jto h LEU 25 Ca -0.51 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.35 1jto h LEU 25 Cb 1.31 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.36 1jto h LEU 25 CO 0.55 -0.03 0.27 1.23 -0.34 0.00 0.00 178.44 180.12 1jto h GLY 26 N 0.12 0.27 0.89 3.75 0.00 -1.89 -2.35 103.07 103.85 1jto h GLY 26 Ca 0.70 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.92 1jto h GLY 26 CO -0.20 0.06 0.08 3.43 0.00 0.00 0.00 176.54 179.91 1jto h ASN 27 N 0.21 0.42 0.47 0.19 2.35 -1.41 -1.75 115.58 116.05 1jto h ASN 27 Ca 0.18 -0.22 -0.06 0.00 -0.55 0.00 0.00 56.30 55.64 1jto h ASN 27 Cb 0.44 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 1jto h ASN 27 CO -0.03 0.53 -0.30 -0.50 -1.65 0.00 0.00 177.43 175.47 1jto h TRP 28 N 0.29 0.00 0.21 1.19 4.06 -1.58 -0.25 115.95 119.86 1jto h TRP 28 Ca 0.09 0.00 -0.32 0.00 2.06 0.00 0.00 58.89 60.72 1jto h TRP 28 Cb 0.27 0.00 0.03 0.00 -1.00 0.00 0.00 29.16 28.45 1jto h TRP 28 CO 0.01 0.30 -1.44 0.28 -3.56 0.00 0.00 178.44 174.04 1jto h VAL 29 N 0.00 1.32 -0.38 1.49 2.07 -1.44 -2.84 116.25 116.47 1jto h VAL 29 Ca -0.00 -2.80 -0.15 0.00 0.82 0.00 0.00 66.70 64.57 1jto h VAL 29 Cb 0.62 2.99 -0.01 0.00 -1.52 0.00 0.00 31.29 33.38 1jto h VAL 29 CO 0.04 0.84 -0.34 0.00 0.02 0.00 0.00 177.57 178.12 1jto h ALA 31 N 0.87 0.43 -1.00 0.00 0.00 -1.14 -2.72 119.26 115.69 1jto h ALA 31 Ca 0.07 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1jto h ALA 31 Cb 0.92 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 1jto h ALA 31 CO 0.08 -0.00 0.66 0.00 0.00 0.00 0.00 179.25 180.00 1jto h ALA 32 N 1.01 1.30 -0.31 0.00 0.00 -1.36 -0.88 119.26 119.01 1jto h ALA 32 Ca 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1jto h ALA 32 Cb 0.13 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1jto h ALA 32 CO -0.01 0.64 0.11 -0.22 0.00 0.00 0.00 179.25 179.76 1jto h LYS 33 N 1.34 0.48 -0.00 0.00 1.63 -1.15 -0.65 116.57 118.21 1jto h LYS 33 Ca 0.38 -0.10 0.00 0.00 -0.85 0.00 0.00 60.65 60.08 1jto h LYS 33 Cb -0.12 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.44 1jto h LYS 33 CO -0.09 0.51 -0.29 1.19 -3.45 0.00 0.00 179.45 177.32 1jto n PHE 34 N -4.70 0.00 -0.02 1.91 3.72 -1.05 -1.30 117.46 116.02 1jto n PHE 34 Ca -0.02 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.37 1jto n PHE 34 Cb 0.16 -0.22 -0.01 0.00 -0.94 0.00 0.00 39.48 38.48 1jto n PHE 34 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1jto h GLU 35 N 0.53 0.00 -0.01 -1.08 4.39 -1.05 -3.44 114.58 113.92 1jto h GLU 35 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1jto h GLU 35 Cb 0.47 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1jto h GLU 35 CO 0.00 0.00 -0.17 -1.13 -1.16 0.00 0.00 179.01 176.55 1jto n SER 36 N -3.06 1.51 -1.70 1.42 3.41 -0.30 -4.91 113.62 109.98 1jto n SER 36 Ca -0.02 -1.25 -0.17 0.00 -0.26 0.00 0.00 58.87 57.17 1jto n SER 36 Cb 0.09 0.33 -0.03 0.00 -0.26 0.00 0.00 64.21 64.34 1jto n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1jto n ASN 37 N 0.04 -4.93 -0.07 4.04 5.15 -0.42 -1.90 115.26 117.17 1jto n ASN 37 Ca 0.05 0.11 -0.01 0.00 -0.60 0.00 0.00 54.58 54.14 1jto n ASN 37 Cb 0.26 -3.99 -0.00 0.00 -0.53 0.00 0.00 39.78 35.51 1jto n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1jto n PHE 38 N -3.56 0.00 -3.15 1.20 3.72 -1.20 -4.91 117.46 109.56 1jto n PHE 38 Ca -0.19 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.79 1jto n PHE 38 Cb 0.62 -0.56 -0.07 0.00 -0.94 0.00 0.00 39.48 38.53 1jto n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1jto s ASN 39 N -2.20 6.32 0.28 4.37 3.84 -0.80 -2.15 114.94 124.60 1jto s ASN 39 Ca 0.00 -0.28 0.22 0.00 0.21 0.00 0.00 52.86 53.01 1jto s ASN 39 Cb 0.00 -2.30 1.05 0.00 -0.55 0.00 0.00 41.25 39.44 1jto s ASN 39 CO 0.00 -0.70 1.67 0.35 -2.79 0.00 0.00 177.10 175.63 1jto n THR 40 N 5.73 0.95 0.86 -5.21 -2.24 -0.41 -2.23 114.28 111.73 1jto n THR 40 Ca -0.03 0.47 0.09 0.00 -2.27 0.00 0.00 64.05 62.32 1jto n THR 40 Cb 0.48 -1.43 -0.03 0.00 -2.10 0.00 0.00 70.33 67.25 1jto n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jto n GLN 41 N -2.23 1.31 -1.63 -0.78 6.02 -1.26 -4.18 117.38 114.63 1jto n GLN 41 Ca 0.00 -0.65 -0.48 0.00 -0.01 0.00 0.00 57.00 55.86 1jto n GLN 41 Cb 0.13 -1.37 -0.05 0.00 1.02 0.00 0.00 30.24 29.98 1jto n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jto n ALA 42 N -0.46 0.15 -3.69 -1.58 0.00 -0.95 -4.72 120.51 109.26 1jto n ALA 42 Ca 0.07 0.47 -0.18 0.00 0.00 0.00 0.00 53.44 53.80 1jto n ALA 42 Cb 0.37 -2.19 -0.17 0.00 0.00 0.00 0.00 19.45 17.46 1jto n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1jto s THR 43 N 0.44 -0.16 -0.14 0.00 -4.23 -1.26 -1.64 115.64 108.66 1jto s THR 43 Ca 0.78 0.36 0.02 0.00 -1.18 0.00 0.00 61.69 61.68 1jto s THR 43 Cb -0.80 -0.20 0.01 0.00 1.34 0.00 0.00 72.50 72.84 1jto s THR 43 CO 0.45 0.15 -0.21 0.20 -0.54 0.00 0.00 174.62 174.68 1jto s ASN 44 N 2.03 3.24 0.29 3.99 0.01 -0.54 -4.93 114.94 119.02 1jto s ASN 44 Ca 0.02 -0.57 -0.22 0.00 -0.71 0.00 0.00 52.86 51.38 1jto s ASN 44 Cb -0.12 -1.47 -0.09 0.00 0.41 0.00 0.00 41.25 39.98 1jto s ASN 44 CO -0.04 0.09 0.84 -0.60 -1.51 0.00 0.00 177.10 175.87 1jto s ARG 45 N 0.78 4.38 0.24 -0.60 6.06 -1.26 -0.48 118.95 128.07 1jto s ARG 45 Ca -0.07 1.07 0.10 0.00 -2.50 0.00 0.00 55.73 54.33 1jto s ARG 45 Cb -0.16 -2.77 -0.04 0.00 0.06 0.00 0.00 34.95 32.04 1jto s ARG 45 CO -0.01 0.30 -0.08 -0.80 -2.50 0.00 0.00 175.30 172.22 1jto s ASN 46 N -1.71 4.22 0.50 -2.12 0.01 0.87 -4.95 114.94 111.76 1jto s ASN 46 Ca 0.48 -0.72 0.26 0.00 -0.71 0.00 0.00 52.86 52.17 1jto s ASN 46 Cb -0.17 -0.67 1.35 0.00 0.41 0.00 0.00 41.25 42.17 1jto s ASN 46 CO 0.21 0.04 1.91 0.71 -1.51 0.00 0.00 177.10 178.47 1jto h THR 47 N 2.26 0.64 -0.12 1.60 1.35 -1.98 0.16 112.91 116.83 1jto h THR 47 Ca -0.44 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1jto h THR 47 Cb 1.24 0.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1jto h THR 47 CO 0.58 0.02 0.00 -0.90 -0.25 0.00 0.00 175.52 174.97 1jto n ASP 48 N -4.36 1.51 0.00 5.36 3.85 -1.26 -4.84 116.55 116.81 1jto n ASP 48 Ca 0.16 -2.12 0.00 0.00 -0.71 0.00 0.00 54.79 52.13 1jto n ASP 48 Cb 0.79 -0.39 0.00 0.00 -1.35 0.00 0.00 41.12 40.17 1jto n ASP 48 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1jto n GLY 49 N 0.31 2.87 3.77 6.12 0.00 0.05 -4.96 105.19 113.35 1jto n GLY 49 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1jto n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jto s SER 50 N -1.93 3.91 0.05 1.61 1.04 -1.25 -4.75 113.70 112.37 1jto s SER 50 Ca 0.00 1.29 0.03 0.00 0.48 0.00 0.00 55.95 57.75 1jto s SER 50 Cb 0.00 -1.98 -0.02 0.00 0.10 0.00 0.00 66.02 64.12 1jto s SER 50 CO 0.00 -2.34 -0.10 -0.89 0.98 0.00 0.00 173.24 170.90 1jto s THR 51 N -3.10 0.73 -0.21 2.02 2.01 -1.26 -0.09 115.64 115.73 1jto s THR 51 Ca 0.62 -1.08 -0.06 0.00 0.31 0.00 0.00 61.69 61.48 1jto s THR 51 Cb -0.16 -0.75 -0.03 0.00 0.01 0.00 0.00 72.50 71.58 1jto s THR 51 CO 0.55 -0.28 0.04 -1.81 -0.69 0.00 0.00 174.62 172.42 1jto s ASP 52 N -1.50 5.12 0.12 3.53 1.01 0.37 -1.31 116.67 124.01 1jto s ASP 52 Ca -0.06 -0.13 0.07 0.00 0.71 0.00 0.00 52.55 53.14 1jto s ASP 52 Cb -0.09 -1.89 -0.04 0.00 1.01 0.00 0.00 42.92 41.91 1jto s ASP 52 CO 0.01 0.06 -0.07 -0.31 0.21 0.00 0.00 175.17 175.07 1jto s TYR 53 N 1.03 2.78 0.01 4.23 1.51 -0.00 -1.46 117.35 125.43 1jto s TYR 53 Ca 0.03 -0.14 0.00 0.00 -1.01 0.00 0.00 57.07 55.95 1jto s TYR 53 Cb -0.14 -1.42 0.00 0.00 -0.11 0.00 0.00 41.96 40.29 1jto s TYR 53 CO 0.02 0.46 0.00 0.41 -1.11 0.00 0.00 175.55 175.34 1jto n GLY 54 N 0.45 -1.55 0.28 0.71 0.00 -0.65 -0.96 105.19 103.47 1jto n GLY 54 Ca -0.12 -1.22 0.12 0.00 0.00 0.00 0.00 46.02 44.79 1jto n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1jto h ILE 55 N -0.03 0.78 -0.12 -0.61 6.09 -1.73 -2.20 117.51 119.70 1jto h ILE 55 Ca 0.00 0.00 -0.02 0.00 -1.37 0.00 0.00 64.86 63.47 1jto h ILE 55 Cb 0.03 0.99 -0.01 0.00 0.47 0.00 0.00 36.82 38.29 1jto h ILE 55 CO 0.00 0.00 -0.07 0.18 -3.07 0.00 0.00 178.15 175.19 1jto n LEU 56 N -4.23 3.08 -4.04 2.19 4.77 -1.26 -4.05 117.00 113.46 1jto n LEU 56 Ca -0.03 -3.25 -0.36 0.00 -0.03 0.00 0.00 56.01 52.34 1jto n LEU 56 Cb 0.11 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 40.68 1jto n LEU 56 CO 0.31 0.85 -0.22 0.00 -1.33 0.00 0.00 177.39 177.00 1jto n GLN 57 N -1.08 -0.51 -2.52 3.23 1.13 -0.83 -4.89 117.38 111.91 1jto n GLN 57 Ca 0.20 -0.01 -0.41 0.00 -1.94 0.00 0.00 57.00 54.84 1jto n GLN 57 Cb 0.77 -2.21 -0.04 0.00 0.11 0.00 0.00 30.24 28.88 1jto n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1jto s ILE 58 N -3.89 4.03 0.33 5.09 1.01 -0.14 -4.44 121.20 123.20 1jto s ILE 58 Ca 0.30 1.65 -0.26 0.00 0.00 0.00 0.00 60.65 62.33 1jto s ILE 58 Cb -0.17 -4.05 -0.10 0.00 0.01 0.00 0.00 42.46 38.16 1jto s ILE 58 CO 0.83 0.23 0.97 0.21 0.00 0.00 0.00 174.94 177.18 1jto s ASN 59 N 0.25 7.23 0.00 3.58 3.84 -1.26 -0.82 114.94 127.76 1jto s ASN 59 Ca 0.51 1.90 0.28 0.00 0.21 0.00 0.00 52.86 55.76 1jto s ASN 59 Cb -0.28 -2.58 1.04 0.00 -0.55 0.00 0.00 41.25 38.88 1jto s ASN 59 CO 0.33 -0.15 1.74 -1.54 -2.79 0.00 0.00 177.10 174.69 1jto n SER 60 N 0.48 0.72 0.03 -4.21 3.41 -0.43 -1.82 113.62 111.81 1jto n SER 60 Ca 0.02 -0.74 0.11 0.00 -0.26 0.00 0.00 58.87 58.01 1jto n SER 60 Cb 0.50 0.01 0.04 0.00 -0.26 0.00 0.00 64.21 64.50 1jto n SER 60 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1jto n ARG 61 N -0.79 0.31 0.00 4.33 0.63 -1.26 -4.53 116.66 115.34 1jto n ARG 61 Ca 0.14 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 57.08 1jto n ARG 61 Cb 0.31 -1.61 0.00 0.00 0.45 0.00 0.00 32.46 31.60 1jto n ARG 61 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 1jto n TRP 62 N -2.02 0.00 -0.11 -0.14 7.02 -1.24 -1.32 117.44 119.64 1jto n TRP 62 Ca 0.02 0.00 -0.14 0.00 -1.02 0.00 0.00 57.50 56.36 1jto n TRP 62 Cb 0.44 0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.22 1jto n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1jto n TRP 63 N -2.12 0.00 -4.14 -5.99 7.02 -0.76 0.71 117.44 112.16 1jto n TRP 63 Ca 0.00 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.37 1jto n TRP 63 Cb 0.34 -0.87 -0.10 0.00 -2.42 0.00 0.00 31.31 28.26 1jto n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1jto s ASN 65 N -2.73 5.09 0.00 0.00 2.47 -1.04 -4.23 114.94 114.50 1jto s ASN 65 Ca 0.07 -0.08 0.05 0.00 0.42 0.00 0.00 52.86 53.32 1jto s ASN 65 Cb 0.02 -1.86 0.14 0.00 -1.45 0.00 0.00 41.25 38.11 1jto s ASN 65 CO -0.04 0.14 1.08 -0.90 -3.72 0.00 0.00 177.10 173.65 1jto n ASP 66 N 3.75 2.35 0.00 -4.21 5.68 -1.26 -0.92 116.55 121.94 1jto n ASP 66 Ca -0.17 -1.91 0.00 0.00 -0.50 0.00 0.00 54.79 52.21 1jto n ASP 66 Cb 0.52 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.40 1jto n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jto n GLY 67 N 0.05 1.34 0.41 6.12 0.00 -1.26 -4.79 105.19 107.06 1jto n GLY 67 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.12 1jto n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1jto n ARG 68 N -2.00 0.59 -3.98 1.61 1.85 -1.26 -4.97 116.66 108.50 1jto n ARG 68 Ca 0.00 -1.82 -0.31 0.00 -1.00 0.00 0.00 57.85 54.72 1jto n ARG 68 Cb 0.00 -0.91 -0.14 0.00 -1.05 0.00 0.00 32.46 30.35 1jto n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1jto s THR 69 N -1.30 2.45 -0.14 8.89 2.01 -1.26 -4.91 115.64 121.38 1jto s THR 69 Ca 0.17 -2.51 -0.35 0.00 0.31 0.00 0.00 61.69 59.31 1jto s THR 69 Cb 0.16 -2.77 -0.12 0.00 0.01 0.00 0.00 72.50 69.78 1jto s THR 69 CO -0.00 -0.65 1.90 -0.81 -0.69 0.00 0.00 174.62 174.37 1jto n PRO 70 N 4.06 1.97 -0.07 4.92 -0.04 -1.26 -2.00 135.00 142.58 1jto n PRO 70 Ca 0.04 0.71 0.00 0.00 -0.04 0.00 0.00 63.50 64.21 1jto n PRO 70 Cb 0.40 -2.59 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 1jto n PRO 70 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1jto n GLY 71 N 4.59 0.74 3.60 0.55 0.00 -1.26 -5.02 105.19 108.39 1jto n GLY 71 Ca 0.25 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.69 1jto n GLY 71 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1jto n SER 72 N 0.00 1.93 0.23 1.61 2.88 -0.85 -4.80 113.62 114.63 1jto n SER 72 Ca 0.00 0.90 0.13 0.00 -1.33 0.00 0.00 58.87 58.57 1jto n SER 72 Cb 0.00 -1.09 0.35 0.00 -0.75 0.00 0.00 64.21 62.72 1jto n SER 72 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1jto h ARG 73 N 8.20 0.00 -6.79 -1.46 -0.00 -1.41 -3.48 114.38 109.45 1jto h ARG 73 Ca -0.37 0.00 -0.56 0.00 -0.50 0.00 0.00 59.98 58.55 1jto h ARG 73 Cb 1.34 0.00 -0.12 0.00 0.00 0.00 0.00 29.97 31.19 1jto h ARG 73 CO 1.00 0.05 -0.94 -1.71 0.00 0.00 0.00 179.97 178.37 1jto n ASN 74 N -3.13 -0.14 0.28 7.04 4.05 -1.14 -4.85 115.26 117.37 1jto n ASN 74 Ca 0.02 -1.15 0.17 0.00 0.45 0.00 0.00 54.58 54.08 1jto n ASN 74 Cb 0.46 -2.31 0.95 0.00 1.23 0.00 0.00 39.78 40.11 1jto n ASN 74 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1jto h LEU 75 N -1.87 0.00 -1.89 1.20 3.38 0.32 -0.00 115.31 116.45 1jto h LEU 75 Ca -0.65 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.32 1jto h LEU 75 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1jto h LEU 75 CO 0.65 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.18 1jto n ASN 77 N 0.95 -0.17 -3.74 0.00 5.15 -0.02 -4.92 115.26 112.52 1jto n ASN 77 Ca 0.17 -1.08 -0.12 0.00 -0.60 0.00 0.00 54.58 52.95 1jto n ASN 77 Cb 0.45 -1.33 -0.07 0.00 -0.53 0.00 0.00 39.78 38.30 1jto n ASN 77 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 1jto s ILE 78 N -4.07 0.08 0.68 -1.44 2.07 -1.26 -5.10 121.20 112.16 1jto s ILE 78 Ca 0.10 -0.62 -0.12 0.00 -1.41 0.00 0.00 60.65 58.59 1jto s ILE 78 Cb -0.05 -0.92 0.00 0.00 0.13 0.00 0.00 42.46 41.62 1jto s ILE 78 CO 0.83 -0.34 1.07 -2.84 -1.91 0.00 0.00 174.94 171.74 1jto s PRO 79 N -2.44 2.93 0.15 3.50 0.02 -1.26 -2.49 135.00 135.41 1jto s PRO 79 Ca -0.06 1.06 -0.02 0.00 0.02 0.00 0.00 61.00 62.00 1jto s PRO 79 Cb -0.01 -1.99 -0.04 0.00 0.02 0.00 0.00 34.50 32.49 1jto s PRO 79 CO -0.03 -1.11 1.35 0.00 -0.33 0.00 0.00 177.00 176.89 1jto h SER 81 N 0.22 0.00 0.59 0.00 4.64 -1.93 0.32 113.55 117.39 1jto h SER 81 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1jto h SER 81 Cb 1.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 1jto h SER 81 CO 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.11 1jto h ALA 82 N 1.68 1.00 -0.01 5.18 0.00 -1.93 -2.64 119.26 122.54 1jto h ALA 82 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1jto h ALA 82 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1jto h ALA 82 CO -0.00 0.00 -0.04 1.28 0.00 0.00 0.00 179.25 180.49 1jto n LEU 83 N -2.47 1.38 -1.43 0.00 4.77 0.11 -3.83 117.00 115.53 1jto n LEU 83 Ca 0.01 -0.44 0.11 0.00 -0.03 0.00 0.00 56.01 55.66 1jto n LEU 83 Cb 0.19 -0.02 0.34 0.00 -2.33 0.00 0.00 43.42 41.60 1jto n LEU 83 CO 0.19 0.23 0.79 0.18 -1.33 0.00 0.00 177.39 177.45 1jto n LEU 84 N 0.00 4.20 -4.80 2.23 4.77 -0.99 -3.92 117.00 118.49 1jto n LEU 84 Ca 0.18 -2.12 -0.33 0.00 -0.03 0.00 0.00 56.01 53.71 1jto n LEU 84 Cb 0.35 -0.52 -0.01 0.00 -2.33 0.00 0.00 43.42 40.91 1jto n LEU 84 CO 0.18 0.95 0.72 -0.55 -1.33 0.00 0.00 177.39 177.35 1jto s SER 85 N -0.98 6.02 0.44 -1.43 0.15 -1.25 -4.45 113.70 112.20 1jto s SER 85 Ca 0.50 1.84 0.30 0.00 0.70 0.00 0.00 55.95 59.30 1jto s SER 85 Cb 0.28 -2.54 1.32 0.00 -1.71 0.00 0.00 66.02 63.36 1jto s SER 85 CO 0.31 -1.00 1.90 0.28 1.20 0.00 0.00 173.24 175.93 1jto h SER 86 N 0.85 0.00 -3.23 5.45 0.02 -1.94 -3.38 113.55 111.32 1jto h SER 86 Ca -0.48 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 59.79 1jto h SER 86 Cb 1.22 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 63.58 1jto h SER 86 CO 0.58 0.00 0.08 -0.62 -1.14 0.00 0.00 176.83 175.73 1jto s ASP 87 N -5.02 6.23 0.00 3.07 3.68 -1.26 -4.93 116.67 118.44 1jto s ASP 87 Ca 0.01 -0.91 0.08 0.00 2.13 0.00 0.00 52.55 53.86 1jto s ASP 87 Cb 0.09 -2.30 0.44 0.00 -1.45 0.00 0.00 42.92 39.70 1jto s ASP 87 CO 0.46 -0.92 0.95 2.30 0.13 0.00 0.00 175.17 178.08 1jto n ILE 88 N 5.64 0.17 -0.11 4.11 -5.35 -1.26 -4.05 119.36 118.51 1jto n ILE 88 Ca -0.06 0.04 -0.10 0.00 -0.27 0.00 0.00 62.75 62.36 1jto n ILE 88 Cb 0.45 -0.92 -0.05 0.00 -1.74 0.00 0.00 39.64 37.39 1jto n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1jto h THR 89 N 0.00 0.13 -0.79 7.28 2.02 -1.92 0.49 112.91 120.11 1jto h THR 89 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 1jto h THR 89 Cb 0.01 0.13 -0.06 0.00 -1.74 0.00 0.00 68.15 66.49 1jto h THR 89 CO 0.00 0.00 0.48 0.00 0.37 0.00 0.00 175.52 176.37 1jto h ALA 90 N 0.42 1.08 -0.53 6.16 0.00 -1.85 -0.59 119.26 123.95 1jto h ALA 90 Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1jto h ALA 90 Cb 0.58 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1jto h ALA 90 CO -0.55 0.20 0.22 0.77 0.00 0.00 0.00 179.25 179.89 1jto h SER 91 N 0.87 0.72 -0.53 0.00 0.02 -1.57 -1.71 113.55 111.35 1jto h SER 91 Ca 0.35 -0.16 -0.06 0.00 -0.84 0.00 0.00 61.79 61.07 1jto h SER 91 Cb 0.18 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1jto h SER 91 CO -0.18 0.69 0.08 0.58 -1.14 0.00 0.00 176.83 176.86 1jto h VAL 92 N 0.71 1.25 -0.14 2.27 2.07 -0.45 0.30 116.25 122.27 1jto h VAL 92 Ca 0.18 -0.97 0.02 0.00 0.82 0.00 0.00 66.70 66.75 1jto h VAL 92 Cb 0.18 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1jto h VAL 92 CO -0.02 0.35 -0.01 0.78 0.02 0.00 0.00 177.57 178.69 1jto h ASN 93 N 0.76 -0.08 -0.12 0.57 2.35 -0.91 0.49 115.58 118.65 1jto h ASN 93 Ca 0.16 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.93 1jto h ASN 93 Cb 0.42 0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1jto h ASN 93 CO 0.01 -0.02 0.04 0.00 -1.65 0.00 0.00 177.43 175.81 1jto h ALA 95 N 0.85 2.34 -0.03 0.00 0.00 -0.01 0.15 119.26 122.56 1jto h ALA 95 Ca 0.04 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.69 1jto h ALA 95 Cb 0.22 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1jto h ALA 95 CO -0.00 -0.68 -0.93 0.87 0.00 0.00 0.00 179.25 178.50 1jto h LYS 96 N 0.00 0.58 -0.21 0.00 1.57 -0.36 -2.83 116.57 115.32 1jto h LYS 96 Ca 0.24 -0.58 -0.05 0.00 -1.87 0.00 0.00 60.65 58.39 1jto h LYS 96 Cb 1.08 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 1jto h LYS 96 CO -0.00 1.20 -0.05 -0.22 -0.57 0.00 0.00 179.45 179.80 1jto h LYS 97 N 0.35 0.40 -0.98 3.15 3.64 -0.42 -1.15 116.57 121.55 1jto h LYS 97 Ca -0.09 -0.15 0.18 0.00 -1.27 0.00 0.00 60.65 59.31 1jto h LYS 97 Cb 1.57 -0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 33.27 1jto h LYS 97 CO 0.17 0.65 0.61 0.82 -2.27 0.00 0.00 179.45 179.43 1jto h ILE 98 N 0.12 0.75 0.14 2.00 2.04 -1.32 -0.85 117.51 120.39 1jto h ILE 98 Ca 0.05 -0.26 -0.24 0.00 1.00 0.00 0.00 64.86 65.41 1jto h ILE 98 Cb 0.50 -0.06 0.03 0.00 -0.74 0.00 0.00 36.82 36.55 1jto h ILE 98 CO 0.02 0.14 -1.04 0.58 0.00 0.00 0.00 178.15 177.85 1jto h VAL 99 N 0.74 1.39 0.00 1.67 2.07 -1.26 -3.25 116.25 117.61 1jto h VAL 99 Ca 0.54 -2.47 0.00 0.00 0.82 0.00 0.00 66.70 65.58 1jto h VAL 99 Cb 0.86 2.93 0.00 0.00 -1.52 0.00 0.00 31.29 33.56 1jto h VAL 99 CO -0.31 0.73 0.00 -1.54 0.02 0.00 0.00 177.57 176.47 1jto n SER 100 N -3.97 0.00 -0.28 0.57 3.41 -0.46 -2.58 113.62 110.32 1jto n SER 100 Ca -0.14 0.12 0.10 0.00 -0.26 0.00 0.00 58.87 58.69 1jto n SER 100 Cb 0.90 -0.35 0.45 0.00 -0.26 0.00 0.00 64.21 64.95 1jto n SER 100 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1jto n ASP 101 N -1.35 0.83 0.00 4.04 2.03 -0.35 -4.88 116.55 116.87 1jto n ASP 101 Ca 0.09 -1.57 0.00 0.00 0.52 0.00 0.00 54.79 53.83 1jto n ASP 101 Cb 0.21 -0.05 0.00 0.00 -0.72 0.00 0.00 41.12 40.55 1jto n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1jto n GLY 102 N 0.95 0.75 0.09 0.27 0.00 -1.07 -4.94 105.19 101.25 1jto n GLY 102 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 1jto n GLY 102 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1jto h ASN 103 N 0.00 0.18 -3.46 1.61 2.35 -1.66 -3.50 115.58 111.10 1jto h ASN 103 Ca 0.00 -0.18 0.04 0.00 -0.55 0.00 0.00 56.30 55.61 1jto h ASN 103 Cb 0.00 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1jto h ASN 103 CO 0.00 1.10 -0.05 0.61 -1.65 0.00 0.00 177.43 177.44 1jto n GLY 104 N 1.29 -1.95 0.00 2.83 0.00 -1.23 -3.75 105.19 102.38 1jto n GLY 104 Ca -0.03 -1.37 0.09 0.00 0.00 0.00 0.00 46.02 44.71 1jto n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1jto n MET 105 N -1.02 0.96 0.20 1.61 2.81 -1.26 -2.92 117.12 117.50 1jto n MET 105 Ca 0.00 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 55.95 1jto n MET 105 Cb 0.07 -1.30 0.41 0.00 -0.71 0.00 0.00 33.22 31.69 1jto n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1jto h ASN 106 N 0.00 0.00 -0.93 7.83 2.35 -1.99 -2.88 115.58 119.96 1jto h ASN 106 Ca 0.00 0.00 0.26 0.00 -0.55 0.00 0.00 56.30 56.01 1jto h ASN 106 Cb 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 1jto h ASN 106 CO 0.00 0.33 0.65 0.00 -1.65 0.00 0.00 177.43 176.77 1jto h ALA 107 N 1.67 2.74 -2.09 -0.83 0.00 -1.66 -3.35 119.26 115.74 1jto h ALA 107 Ca -0.00 -0.02 -0.65 0.00 0.00 0.00 0.00 54.91 54.23 1jto h ALA 107 Cb 0.73 0.05 -0.15 0.00 0.00 0.00 0.00 17.79 18.42 1jto h ALA 107 CO 0.04 -1.02 0.18 -1.58 0.00 0.00 0.00 179.25 176.88 1jto s TRP 108 N -5.07 3.01 0.17 0.00 0.51 -1.09 -4.94 118.94 111.54 1jto s TRP 108 Ca -0.06 -0.17 -0.16 0.00 -2.12 0.00 0.00 56.10 53.59 1jto s TRP 108 Cb 0.22 -3.53 0.11 0.00 -0.81 0.00 0.00 33.47 29.46 1jto s TRP 108 CO 0.78 -1.00 1.67 0.28 -0.51 0.00 0.00 176.95 178.17 1jto h VAL 109 N 5.90 0.60 -0.97 4.03 2.07 -1.87 -1.51 116.25 124.50 1jto h VAL 109 Ca -0.26 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.31 1jto h VAL 109 Cb 1.09 0.58 -0.06 0.00 -1.52 0.00 0.00 31.29 31.37 1jto h VAL 109 CO 0.95 0.00 0.63 0.00 0.02 0.00 0.00 177.57 179.17 1jto h ALA 110 N 1.41 1.43 -0.53 1.67 0.00 -1.92 -1.30 119.26 120.03 1jto h ALA 110 Ca 0.20 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1jto h ALA 110 Cb 0.31 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1jto h ALA 110 CO -0.41 0.43 0.20 2.35 0.00 0.00 0.00 179.25 181.82 1jto h TRP 111 N 1.14 0.82 -0.20 0.00 7.01 -1.59 0.16 115.95 123.28 1jto h TRP 111 Ca 0.41 -0.07 -0.09 0.00 2.11 0.00 0.00 58.89 61.26 1jto h TRP 111 Cb 0.15 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 1jto h TRP 111 CO -0.00 0.68 -0.26 -0.09 -2.79 0.00 0.00 178.44 175.98 1jto h ARG 112 N 0.72 0.38 0.00 2.65 2.43 -0.77 0.11 114.38 119.90 1jto h ARG 112 Ca 0.17 -0.14 -0.14 0.00 -0.81 0.00 0.00 59.98 59.06 1jto h ARG 112 Cb 0.22 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 1jto h ARG 112 CO -0.01 0.62 -1.33 -0.91 -1.51 0.00 0.00 179.97 176.83 1jto h ASN 113 N 0.34 0.00 0.00 -3.80 2.35 -1.01 -3.40 115.58 110.06 1jto h ASN 113 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1jto h ASN 113 Cb 0.64 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.01 1jto h ASN 113 CO 0.05 0.50 0.00 0.54 -1.65 0.00 0.00 177.43 176.86 1jto n ARG 114 N -2.87 4.55 0.00 0.81 5.12 0.53 -4.91 116.66 119.90 1jto n ARG 114 Ca -0.08 -0.11 0.00 0.00 -1.93 0.00 0.00 57.85 55.73 1jto n ARG 114 Cb 0.80 -0.58 0.00 0.00 -1.16 0.00 0.00 32.46 31.52 1jto n ARG 114 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1jto n LYS 116 N -2.94 0.88 -0.69 0.00 4.81 0.16 -1.09 118.16 119.29 1jto n LYS 116 Ca 0.00 0.32 0.00 0.00 -0.87 0.00 0.00 58.31 57.76 1jto n LYS 116 Cb 0.43 -1.93 0.00 0.00 0.02 0.00 0.00 35.03 33.55 1jto n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jto n GLY 117 N 2.48 1.45 3.94 3.14 0.00 -1.26 -4.95 105.19 110.00 1jto n GLY 117 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 1jto n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jto s THR 118 N -3.62 2.36 -1.30 2.61 -4.23 -0.25 -4.99 115.64 106.21 1jto s THR 118 Ca 0.00 -1.24 -0.18 0.00 -1.18 0.00 0.00 61.69 59.09 1jto s THR 118 Cb 0.00 -2.60 0.06 0.00 1.34 0.00 0.00 72.50 71.30 1jto s THR 118 CO 0.00 0.00 1.77 -0.67 -0.54 0.00 0.00 174.62 175.18 1jto n ASP 119 N -1.81 4.83 0.27 3.99 2.03 -1.26 -4.77 116.55 119.83 1jto n ASP 119 Ca 0.06 -2.91 0.15 0.00 0.52 0.00 0.00 54.79 52.61 1jto n ASP 119 Cb 0.62 -1.74 0.88 0.00 -0.72 0.00 0.00 41.12 40.16 1jto n ASP 119 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 1jto h VAL 120 N 5.50 0.54 0.00 5.18 -1.51 -1.92 -1.99 116.25 122.06 1jto h VAL 120 Ca 0.45 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.92 1jto h VAL 120 Cb 0.86 0.96 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1jto h VAL 120 CO 1.48 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.82 1jto n GLN 121 N -3.88 0.03 0.24 5.19 1.13 -1.26 -1.26 117.38 117.56 1jto n GLN 121 Ca -0.02 0.35 0.10 0.00 -1.94 0.00 0.00 57.00 55.49 1jto n GLN 121 Cb 0.14 -1.56 0.59 0.00 0.11 0.00 0.00 30.24 29.52 1jto n GLN 121 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1jto h ALA 122 N 2.32 1.28 0.00 -1.58 0.00 -1.75 -2.53 119.26 117.00 1jto h ALA 122 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1jto h ALA 122 Cb 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1jto h ALA 122 CO 0.00 0.24 0.00 0.91 0.00 0.00 0.00 179.25 180.40 1jto n TRP 123 N -3.73 0.00 -0.07 0.00 7.02 -0.39 -3.42 117.44 116.84 1jto n TRP 123 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 1jto n TRP 123 Cb 0.30 -0.48 0.00 0.00 -2.42 0.00 0.00 31.31 28.71 1jto n TRP 123 CO 0.00 0.00 0.00 0.44 -2.02 0.00 0.00 177.69 176.11 1jto n ILE 124 N -1.48 0.00 -2.46 -0.99 -5.35 -0.98 -4.85 119.36 103.24 1jto n ILE 124 Ca 0.04 -0.27 -0.41 0.00 -0.27 0.00 0.00 62.75 61.84 1jto n ILE 124 Cb 0.17 1.07 -0.04 0.00 -1.74 0.00 0.00 39.64 39.10 1jto n ILE 124 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1jto s ARG 125 N -0.46 4.58 0.00 6.28 1.70 -1.03 -2.41 118.95 127.61 1jto s ARG 125 Ca 0.00 1.79 0.00 0.00 -0.47 0.00 0.00 55.73 57.05 1jto s ARG 125 Cb 0.00 -3.24 0.00 0.00 -0.57 0.00 0.00 34.95 31.14 1jto s ARG 125 CO 0.00 0.07 0.00 0.41 -1.08 0.00 0.00 175.30 174.70 1jto n GLY 126 N 1.80 0.89 3.72 3.88 0.00 -1.26 -5.01 105.19 109.21 1jto n GLY 126 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1jto n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jto s ARG 128 N -1.46 3.48 0.00 0.00 6.06 -1.26 -5.14 118.95 120.63 1jto s ARG 128 Ca 0.19 -0.93 0.00 0.00 -2.50 0.00 0.00 55.73 52.49 1jto s ARG 128 Cb -0.12 -5.15 0.00 0.00 0.06 0.00 0.00 34.95 29.75 1jto s ARG 128 CO 0.10 -2.25 0.30 1.28 -2.50 0.00 0.00 175.30 172.23