#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vnd n SER 2 N 0.00 0.93 -3.42 0.00 7.64 -1.26 -4.64 113.62 112.86 1vnd n SER 2 Ca 0.00 -2.39 -0.27 0.00 1.01 0.00 0.00 58.87 57.23 1vnd n SER 2 Cb 0.00 -0.32 -0.08 0.00 -1.01 0.00 0.00 64.21 62.80 1vnd n SER 2 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1vnd n ASP 3 N -0.08 3.04 0.00 6.43 8.00 -1.26 -4.98 116.55 127.69 1vnd n ASP 3 Ca 0.07 -3.28 0.00 0.00 0.71 0.00 0.00 54.79 52.29 1vnd n ASP 3 Cb 0.89 -0.67 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 1vnd n ASP 3 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vnd n GLY 4 N 1.07 -0.90 0.98 0.44 0.00 -1.26 -5.08 105.19 100.44 1vnd n GLY 4 Ca 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 46.02 46.22 1vnd n GLY 4 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1vnd n LEU 5 N 0.00 0.84 -4.45 0.99 4.77 -1.26 -4.94 117.00 112.94 1vnd n LEU 5 Ca 0.00 0.11 -0.44 0.00 -0.03 0.00 0.00 56.01 55.65 1vnd n LEU 5 Cb 0.00 -0.26 -0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1vnd n LEU 5 CO 0.00 -0.49 1.29 -2.16 -1.33 0.00 0.00 177.39 174.70 1vnd s PRO 6 N -2.04 4.07 -1.24 3.23 0.04 -1.26 -4.92 135.00 132.88 1vnd s PRO 6 Ca -0.02 -2.61 -0.09 0.00 0.04 0.00 0.00 61.00 58.32 1vnd s PRO 6 Cb 0.00 -4.99 0.19 0.00 0.04 0.00 0.00 34.50 29.74 1vnd s PRO 6 CO 0.03 -1.70 1.73 0.27 0.04 0.00 0.00 177.00 177.36 1vnd n ASN 7 N 5.35 5.30 0.10 6.66 0.23 -1.26 -3.74 115.26 127.89 1vnd n ASN 7 Ca 0.34 -3.13 0.00 0.00 -0.53 0.00 0.00 54.58 51.27 1vnd n ASN 7 Cb 0.43 -1.46 0.00 0.00 -2.08 0.00 0.00 39.78 36.66 1vnd n ASN 7 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 1vnd n LYS 8 N 3.79 0.00 -3.53 -3.83 2.85 -1.26 -3.64 118.16 112.54 1vnd n LYS 8 Ca 0.37 0.00 -0.23 0.00 -1.05 0.00 0.00 58.31 57.40 1vnd n LYS 8 Cb 0.37 0.00 -0.14 0.00 -0.65 0.00 0.00 35.03 34.61 1vnd n LYS 8 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1vnd s LYS 9 N -2.00 0.17 0.03 -1.58 1.02 -1.25 -4.78 119.74 111.36 1vnd s LYS 9 Ca 0.00 -0.10 0.04 0.00 0.02 0.00 0.00 55.97 55.92 1vnd s LYS 9 Cb 0.00 -1.31 -0.02 0.00 -0.52 0.00 0.00 37.83 35.98 1vnd s LYS 9 CO 0.00 -0.80 -0.11 -0.98 -0.92 0.00 0.00 175.35 172.55 1vnd s ARG 10 N 2.22 0.73 0.00 1.68 1.70 -1.25 -4.89 118.95 119.14 1vnd s ARG 10 Ca 0.06 -0.67 0.00 0.00 -0.47 0.00 0.00 55.73 54.65 1vnd s ARG 10 Cb -0.16 -0.67 0.00 0.00 -0.57 0.00 0.00 34.95 33.55 1vnd s ARG 10 CO -0.20 0.16 0.00 1.63 -1.08 0.00 0.00 175.30 175.81 1vnd n LYS 11 N 1.93 0.00 0.02 3.89 4.76 -1.26 -4.32 118.16 123.19 1vnd n LYS 11 Ca -0.19 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.13 1vnd n LYS 11 Cb 0.55 0.00 -0.09 0.00 -1.84 0.00 0.00 35.03 33.65 1vnd n LYS 11 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 1vnd h ARG 12 N 0.00 -0.12 0.00 1.97 2.43 -1.95 -3.49 114.38 113.21 1vnd h ARG 12 Ca 0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1vnd h ARG 12 Cb 0.00 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1vnd h ARG 12 CO 0.00 0.37 0.00 0.54 -1.51 0.00 0.00 179.97 179.37 1vnd n ARG 13 N -4.89 2.56 -2.18 0.20 5.12 -1.26 -5.12 116.66 111.09 1vnd n ARG 13 Ca -0.08 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.43 1vnd n ARG 13 Cb 0.28 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.55 1vnd n ARG 13 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1vnd s VAL 14 N 1.36 3.00 -0.51 1.55 -7.23 -1.26 -4.27 120.40 113.05 1vnd s VAL 14 Ca 0.00 0.90 0.02 0.00 -1.81 0.00 0.00 61.98 61.09 1vnd s VAL 14 Cb 0.00 -3.57 0.13 0.00 0.56 0.00 0.00 36.38 33.50 1vnd s VAL 14 CO 0.00 0.17 0.26 -0.76 -0.31 0.00 0.00 175.10 174.46 1vnd s LEU 15 N -0.80 4.67 0.11 1.32 1.43 -1.26 -4.78 118.68 119.36 1vnd s LEU 15 Ca 0.53 -2.77 0.04 0.00 -1.03 0.00 0.00 54.13 50.90 1vnd s LEU 15 Cb -0.38 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 1vnd s LEU 15 CO 0.44 -0.31 0.11 -0.36 0.23 0.00 0.00 176.35 176.46 1vnd s PHE 16 N 0.06 3.20 0.00 0.29 0.40 -1.26 -4.48 117.98 116.18 1vnd s PHE 16 Ca 0.15 0.05 0.00 0.00 -0.60 0.00 0.00 56.93 56.54 1vnd s PHE 16 Cb -0.23 -1.59 0.00 0.00 0.51 0.00 0.00 43.02 41.71 1vnd s PHE 16 CO -0.02 0.52 0.00 2.41 0.70 0.00 0.00 175.22 178.83 1vnd n THR 17 N 0.14 0.00 1.57 0.64 -1.04 -1.26 -5.03 114.28 109.31 1vnd n THR 17 Ca -0.08 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.02 1vnd n THR 17 Cb 0.53 -0.37 0.42 0.00 -1.82 0.00 0.00 70.33 69.08 1vnd n THR 17 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1vnd n LYS 18 N -0.32 1.39 0.08 -2.82 5.02 -1.26 -2.84 118.16 117.41 1vnd n LYS 18 Ca 0.00 -0.58 -0.20 0.00 -2.02 0.00 0.00 58.31 55.51 1vnd n LYS 18 Cb 0.00 -1.32 -0.15 0.00 -0.02 0.00 0.00 35.03 33.54 1vnd n LYS 18 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vnd h ALA 19 N 3.77 0.17 0.03 7.82 0.00 -1.99 -3.36 119.26 125.71 1vnd h ALA 19 Ca 0.00 -1.08 -0.00 0.00 0.00 0.00 0.00 54.91 53.83 1vnd h ALA 19 Cb 0.25 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1vnd h ALA 19 CO 0.00 1.04 -0.01 1.96 0.00 0.00 0.00 179.25 182.24 1vnd h GLN 20 N 0.09 -0.03 -0.57 0.00 1.08 -1.90 -3.02 115.11 110.76 1vnd h GLN 20 Ca -0.27 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 56.86 1vnd h GLN 20 Cb 2.06 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 29.47 1vnd h GLN 20 CO 0.18 0.67 0.06 1.79 -0.95 0.00 0.00 178.83 180.58 1vnd h THR 21 N -0.90 1.25 0.63 -0.54 1.35 -1.81 -3.04 112.91 109.86 1vnd h THR 21 Ca -0.00 -1.01 -0.03 0.00 -0.55 0.00 0.00 66.41 64.82 1vnd h THR 21 Cb 0.72 0.75 -0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1vnd h THR 21 CO 0.01 0.37 -0.37 0.22 -0.25 0.00 0.00 175.52 175.50 1vnd h TYR 22 N 0.88 -0.96 -0.36 4.73 3.20 -1.70 -3.01 116.97 119.74 1vnd h TYR 22 Ca 0.17 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.92 1vnd h TYR 22 Cb 0.44 0.34 -0.01 0.00 1.54 0.00 0.00 36.73 39.03 1vnd h TYR 22 CO 0.03 -0.56 -0.21 0.93 -1.64 0.00 0.00 178.16 176.70 1vnd h GLU 23 N -0.94 0.70 -0.43 1.82 4.39 -1.57 -2.88 114.58 115.68 1vnd h GLU 23 Ca -0.08 -0.27 -0.10 0.00 0.34 0.00 0.00 59.36 59.25 1vnd h GLU 23 Cb 0.75 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.34 1vnd h GLU 23 CO 0.10 0.86 -0.15 -0.07 -1.16 0.00 0.00 179.01 178.59 1vnd h LEU 24 N 0.62 0.79 -0.37 1.33 3.38 -1.61 -3.02 115.31 116.42 1vnd h LEU 24 Ca 0.09 -0.25 -0.15 0.00 0.09 0.00 0.00 57.88 57.66 1vnd h LEU 24 Cb 0.70 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1vnd h LEU 24 CO 0.05 0.94 -0.71 -0.33 0.09 0.00 0.00 178.44 178.49 1vnd h GLU 25 N 0.71 0.00 -0.20 1.13 4.39 -1.50 -3.06 114.58 116.05 1vnd h GLU 25 Ca 0.11 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.73 1vnd h GLU 25 Cb 0.64 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.29 1vnd h GLU 25 CO 0.04 0.71 -0.18 0.00 -1.16 0.00 0.00 179.01 178.42 1vnd h ARG 26 N 0.00 0.47 -0.01 2.33 3.08 -1.51 -3.13 114.38 115.62 1vnd h ARG 26 Ca -0.01 -0.24 -0.11 0.00 0.07 0.00 0.00 59.98 59.69 1vnd h ARG 26 Cb 1.37 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.41 1vnd h ARG 26 CO 0.09 0.81 -0.52 0.00 -1.07 0.00 0.00 179.97 179.29 1vnd h ARG 27 N 0.15 0.02 -0.25 0.04 2.47 -1.63 -3.25 114.38 111.92 1vnd h ARG 27 Ca 0.03 -0.01 -0.12 0.00 -1.26 0.00 0.00 59.98 58.63 1vnd h ARG 27 Cb 0.72 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.03 1vnd h ARG 27 CO 0.05 0.53 -0.34 0.35 0.56 0.00 0.00 179.97 181.11 1vnd h PHE 28 N 0.01 0.64 0.00 3.04 3.57 -1.57 -2.07 116.94 120.55 1vnd h PHE 28 Ca -0.00 -0.17 -0.05 0.00 3.53 0.00 0.00 57.97 61.28 1vnd h PHE 28 Cb 0.92 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.51 1vnd h PHE 28 CO 0.00 0.82 -0.25 0.00 -2.23 0.00 0.00 178.31 176.66 1vnd h ARG 29 N 0.46 0.00 0.00 1.11 2.47 -1.58 -3.29 114.38 113.55 1vnd h ARG 29 Ca 0.05 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.54 1vnd h ARG 29 Cb 0.82 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.10 1vnd h ARG 29 CO 0.07 0.25 -1.78 0.94 0.56 0.00 0.00 179.97 180.00 1vnd n GLN 30 N -3.24 0.64 -3.58 0.04 -0.06 -1.20 -5.04 117.38 104.94 1vnd n GLN 30 Ca 0.02 0.14 -0.08 0.00 -2.00 0.00 0.00 57.00 55.08 1vnd n GLN 30 Cb 0.54 -1.70 -0.04 0.00 -4.06 0.00 0.00 30.24 24.98 1vnd n GLN 30 CO 0.00 0.00 0.00 1.14 -0.20 0.00 0.00 177.06 178.00 1vnd s GLN 31 N -2.80 0.49 -0.17 3.69 -2.07 -0.78 -5.07 119.66 112.94 1vnd s GLN 31 Ca -0.06 0.03 0.09 0.00 -1.82 0.00 0.00 55.36 53.60 1vnd s GLN 31 Cb 0.08 0.23 -0.16 0.00 -1.09 0.00 0.00 33.01 32.07 1vnd s GLN 31 CO 0.83 -0.17 -0.04 0.54 -1.32 0.00 0.00 175.29 175.13 1vnd n ARG 32 N 0.45 1.10 -4.85 9.60 1.74 -1.26 -3.71 116.66 119.73 1vnd n ARG 32 Ca -0.07 0.04 -0.33 0.00 -0.77 0.00 0.00 57.85 56.73 1vnd n ARG 32 Cb 0.59 -1.39 -0.13 0.00 -1.02 0.00 0.00 32.46 30.50 1vnd n ARG 32 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1vnd s TYR 33 N -2.38 2.74 -0.13 -1.55 1.51 -1.26 -4.96 117.35 111.33 1vnd s TYR 33 Ca -0.15 -0.29 -0.05 0.00 -1.01 0.00 0.00 57.07 55.57 1vnd s TYR 33 Cb 0.05 -1.69 0.06 0.00 -0.11 0.00 0.00 41.96 40.27 1vnd s TYR 33 CO 0.55 0.08 0.27 -0.48 -1.11 0.00 0.00 175.55 174.85 1vnd s LEU 34 N -0.42 -0.24 0.50 -1.29 -0.00 -1.26 -5.16 118.68 110.80 1vnd s LEU 34 Ca 0.05 0.60 -0.00 0.00 -0.00 0.00 0.00 54.13 54.78 1vnd s LEU 34 Cb -0.12 0.72 0.01 0.00 -0.00 0.00 0.00 46.19 46.80 1vnd s LEU 34 CO 0.02 -0.23 0.73 -0.94 -0.00 0.00 0.00 176.35 175.93 1vnd s SER 35 N 2.31 5.60 0.42 1.48 1.04 -1.26 -4.63 113.70 118.67 1vnd s SER 35 Ca 0.00 0.23 0.24 0.00 0.48 0.00 0.00 55.95 56.90 1vnd s SER 35 Cb -0.12 -1.32 1.25 0.00 0.10 0.00 0.00 66.02 65.93 1vnd s SER 35 CO -0.09 -0.90 1.73 0.00 0.98 0.00 0.00 173.24 174.96 1vnd h ALA 36 N 0.21 2.48 -0.08 5.32 0.00 -2.02 -0.31 119.26 124.86 1vnd h ALA 36 Ca -0.45 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 1vnd h ALA 36 Cb 1.27 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1vnd h ALA 36 CO 0.56 -0.95 -0.33 -1.35 0.00 0.00 0.00 179.25 177.19 1vnd h PRO 37 N 0.26 0.15 0.00 0.00 0.11 -1.99 -2.99 132.00 127.54 1vnd h PRO 37 Ca 0.66 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.71 1vnd h PRO 37 Cb 1.91 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 33.01 1vnd h PRO 37 CO -0.30 0.47 -1.83 -0.85 -0.21 0.00 0.00 178.00 175.28 1vnd n GLU 38 N -4.11 0.55 0.08 1.05 0.28 -0.92 -4.20 120.64 113.37 1vnd n GLU 38 Ca -0.01 -0.16 -0.22 0.00 -0.16 0.00 0.00 57.16 56.60 1vnd n GLU 38 Cb 0.40 -1.43 -0.15 0.00 1.43 0.00 0.00 31.44 31.69 1vnd n GLU 38 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 177.13 176.88 1vnd h ARG 39 N 0.00 0.39 0.00 3.44 2.43 -1.15 -3.03 114.38 116.46 1vnd h ARG 39 Ca -0.00 -0.67 -0.03 0.00 -0.81 0.00 0.00 59.98 58.48 1vnd h ARG 39 Cb 0.83 0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 30.63 1vnd h ARG 39 CO 0.00 1.32 -0.14 0.93 -1.51 0.00 0.00 179.97 180.57 1vnd h GLU 40 N -0.15 0.00 0.00 0.20 4.39 -1.77 -2.96 114.58 114.29 1vnd h GLU 40 Ca -0.21 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.31 1vnd h GLU 40 Cb 1.88 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 30.50 1vnd h GLU 40 CO 0.19 0.12 -0.86 1.25 -1.16 0.00 0.00 179.01 178.54 1vnd h HIS 41 N 0.00 0.00 -0.00 4.33 2.76 -1.73 -2.61 115.15 117.89 1vnd h HIS 41 Ca -0.00 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 58.01 1vnd h HIS 41 Cb 1.09 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.03 1vnd h HIS 41 CO 0.00 0.80 -0.74 1.25 -1.30 0.00 0.00 177.93 177.94 1vnd h LEU 42 N 0.00 0.04 0.00 0.26 7.12 -1.50 -2.12 115.31 119.11 1vnd h LEU 42 Ca -0.03 -0.03 -0.16 0.00 0.13 0.00 0.00 57.88 57.79 1vnd h LEU 42 Cb 1.63 -0.01 -0.02 0.00 -0.53 0.00 0.00 40.66 41.73 1vnd h LEU 42 CO 0.10 0.77 -0.79 0.00 -0.13 0.00 0.00 178.44 178.38 1vnd h ALA 43 N 1.23 0.52 0.00 1.25 0.00 -1.55 -2.73 119.26 117.99 1vnd h ALA 43 Ca -0.01 -0.71 -0.15 0.00 0.00 0.00 0.00 54.91 54.04 1vnd h ALA 43 Cb 1.31 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1vnd h ALA 43 CO 0.10 0.95 -1.02 0.77 0.00 0.00 0.00 179.25 180.05 1vnd h SER 44 N 0.00 0.00 0.02 0.00 0.02 -1.51 -0.53 113.55 111.55 1vnd h SER 44 Ca -0.02 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.68 1vnd h SER 44 Cb 1.59 0.00 0.02 0.00 0.14 0.00 0.00 62.40 64.15 1vnd h SER 44 CO 0.10 0.60 -0.97 0.25 -1.14 0.00 0.00 176.83 175.66 1vnd h LEU 45 N 0.00 0.87 0.00 5.07 7.12 -1.44 -3.37 115.31 123.55 1vnd h LEU 45 Ca -0.09 -0.67 -0.00 0.00 0.13 0.00 0.00 57.88 57.25 1vnd h LEU 45 Cb 1.54 -0.26 -0.00 0.00 -0.53 0.00 0.00 40.66 41.40 1vnd h LEU 45 CO 0.06 1.47 -1.85 2.30 -0.13 0.00 0.00 178.44 180.29 1vnd n ILE 46 N -3.86 0.01 -1.15 4.05 -5.35 -1.03 -5.06 119.36 106.98 1vnd n ILE 46 Ca -0.10 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 61.96 1vnd n ILE 46 Cb 0.85 0.07 0.00 0.00 -1.74 0.00 0.00 39.64 38.82 1vnd n ILE 46 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 1vnd n ARG 47 N -2.15 0.00 -2.34 6.28 3.00 -0.87 -4.96 116.66 115.62 1vnd n ARG 47 Ca -0.04 0.33 -0.03 0.00 -0.00 0.00 0.00 57.85 58.11 1vnd n ARG 47 Cb 0.49 -1.15 -0.01 0.00 0.00 0.00 0.00 32.46 31.79 1vnd n ARG 47 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1vnd n LEU 48 N -0.82 0.00 -4.88 6.15 4.77 -0.26 -4.98 117.00 116.97 1vnd n LEU 48 Ca 0.00 -0.48 -0.34 0.00 -0.03 0.00 0.00 56.01 55.17 1vnd n LEU 48 Cb 0.38 0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 41.66 1vnd n LEU 48 CO 0.00 -0.08 0.02 0.42 -1.33 0.00 0.00 177.39 176.42 1vnd s THR 49 N -2.12 5.18 0.65 -5.08 -4.23 -1.26 -4.67 115.64 104.11 1vnd s THR 49 Ca 0.05 0.24 0.40 0.00 -1.18 0.00 0.00 61.69 61.20 1vnd s THR 49 Cb 0.00 -3.62 0.41 0.00 1.34 0.00 0.00 72.50 70.64 1vnd s THR 49 CO 0.04 0.23 2.29 -0.65 -0.54 0.00 0.00 174.62 175.99 1vnd h PRO 50 N 3.51 0.00 0.02 3.99 0.11 -1.93 -3.04 132.00 134.66 1vnd h PRO 50 Ca -0.48 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.36 1vnd h PRO 50 Cb 1.19 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 1vnd h PRO 50 CO 0.68 0.00 -1.49 0.00 -0.21 0.00 0.00 178.00 176.98 1vnd h THR 51 N 0.00 1.13 0.02 -1.15 1.03 -1.96 -2.95 112.91 109.03 1vnd h THR 51 Ca 0.01 -2.91 -0.26 0.00 -0.01 0.00 0.00 66.41 63.24 1vnd h THR 51 Cb 0.11 2.59 -0.03 0.00 -1.07 0.00 0.00 68.15 69.74 1vnd h THR 51 CO -0.00 0.68 -1.36 0.06 -0.01 0.00 0.00 175.52 174.89 1vnd h GLN 52 N 0.01 0.05 -0.39 0.00 3.07 -1.60 -2.95 115.11 113.30 1vnd h GLN 52 Ca -0.20 -0.08 -0.13 0.00 0.09 0.00 0.00 58.65 58.32 1vnd h GLN 52 Cb 1.94 0.03 -0.01 0.00 0.08 0.00 0.00 27.48 29.52 1vnd h GLN 52 CO 0.10 0.84 -0.29 -0.24 0.09 0.00 0.00 178.83 179.34 1vnd h VAL 53 N 0.01 1.28 -0.47 1.86 3.04 -1.69 -2.60 116.25 117.68 1vnd h VAL 53 Ca -0.15 -1.44 0.06 0.00 -1.01 0.00 0.00 66.70 64.16 1vnd h VAL 53 Cb 1.90 1.28 -0.05 0.00 -2.01 0.00 0.00 31.29 32.41 1vnd h VAL 53 CO 0.12 0.48 0.18 0.11 -1.01 0.00 0.00 177.57 177.44 1vnd h LYS 54 N 0.71 0.35 -0.00 4.17 1.79 -1.58 -2.98 116.57 119.03 1vnd h LYS 54 Ca 0.08 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1vnd h LYS 54 Cb 0.83 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.41 1vnd h LYS 54 CO 0.07 0.23 -0.26 -0.89 -1.08 0.00 0.00 179.45 177.52 1vnd n ILE 55 N -4.99 0.00 0.01 1.86 5.41 -1.11 -2.22 119.36 118.32 1vnd n ILE 55 Ca 0.04 -0.01 -0.18 0.00 1.00 0.00 0.00 62.75 63.59 1vnd n ILE 55 Cb 0.17 -0.06 -0.09 0.00 -0.71 0.00 0.00 39.64 38.95 1vnd n ILE 55 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 176.55 176.30 1vnd h TRP 56 N 0.13 0.93 0.00 1.39 7.01 -1.39 -3.17 115.95 120.86 1vnd h TRP 56 Ca 0.00 -0.47 0.00 0.00 2.11 0.00 0.00 58.89 60.53 1vnd h TRP 56 Cb 0.48 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.42 1vnd h TRP 56 CO 0.00 1.29 -0.45 0.74 -2.79 0.00 0.00 178.44 177.23 1vnd h PHE 57 N 0.31 0.00 0.00 2.65 0.04 -1.59 -3.03 116.94 115.32 1vnd h PHE 57 Ca -0.09 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.54 1vnd h PHE 57 Cb 1.47 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.60 1vnd h PHE 57 CO 0.11 0.00 -1.00 0.37 -0.60 0.00 0.00 178.31 177.19 1vnd h GLN 58 N 0.00 0.00 0.14 1.51 4.15 -1.56 -3.38 115.11 115.97 1vnd h GLN 58 Ca 0.00 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.09 1vnd h GLN 58 Cb 0.86 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.55 1vnd h GLN 58 CO 0.00 0.44 -1.73 -0.91 -1.93 0.00 0.00 178.83 174.70 1vnd h ASN 59 N 0.00 0.48 0.40 -0.69 4.21 -1.65 -3.42 115.58 114.91 1vnd h ASN 59 Ca -0.09 -0.91 -0.06 0.00 1.21 0.00 0.00 56.30 56.46 1vnd h ASN 59 Cb 1.52 -0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 38.56 1vnd h ASN 59 CO 0.06 1.76 -0.26 0.45 -1.29 0.00 0.00 177.43 178.15 1vnd h HIS 60 N -0.05 0.00 -0.67 1.19 3.86 -1.70 -3.38 115.15 114.41 1vnd h HIS 60 Ca -0.36 0.00 -0.71 0.00 -1.16 0.00 0.00 60.37 58.14 1vnd h HIS 60 Cb 1.97 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 30.38 1vnd h HIS 60 CO 0.10 0.26 2.99 2.89 0.86 0.00 0.00 177.93 185.04 1vnd n ARG 61 N -3.93 4.10 0.00 2.45 1.85 -1.26 -4.10 116.66 115.78 1vnd n ARG 61 Ca -0.02 -2.94 0.00 0.00 -1.00 0.00 0.00 57.85 53.90 1vnd n ARG 61 Cb 0.34 -2.75 0.00 0.00 -1.05 0.00 0.00 32.46 29.00 1vnd n ARG 61 CO 0.00 0.00 0.00 0.98 -0.01 0.00 0.00 177.63 178.60 1vnd n TYR 62 N 2.80 -0.71 -2.90 2.89 9.36 -1.26 -5.02 117.16 122.32 1vnd n TYR 62 Ca 0.67 0.03 -0.40 0.00 3.32 0.00 0.00 57.90 61.52 1vnd n TYR 62 Cb 0.25 0.20 0.00 0.00 -0.63 0.00 0.00 39.34 39.17 1vnd n TYR 62 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1vnd n LYS 63 N -2.19 4.65 -1.51 2.98 4.01 -1.26 -4.92 118.16 119.92 1vnd n LYS 63 Ca 0.00 -4.62 -0.31 0.00 -0.51 0.00 0.00 58.31 52.87 1vnd n LYS 63 Cb 0.00 -2.47 -0.17 0.00 -0.51 0.00 0.00 35.03 31.89 1vnd n LYS 63 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1vnd n THR 64 N 0.71 -0.01 -0.42 -0.18 -2.24 -1.26 -4.93 114.28 105.94 1vnd n THR 64 Ca 0.34 -0.31 -0.14 0.00 -2.27 0.00 0.00 64.05 61.66 1vnd n THR 64 Cb 0.31 -0.60 0.08 0.00 -2.10 0.00 0.00 70.33 68.02 1vnd n THR 64 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1vnd n LYS 65 N 7.33 1.73 -3.94 -0.78 5.02 -1.26 -4.98 118.16 121.28 1vnd n LYS 65 Ca 0.63 -1.63 -0.22 0.00 -2.02 0.00 0.00 58.31 55.07 1vnd n LYS 65 Cb 0.15 -1.64 -0.02 0.00 -0.02 0.00 0.00 35.03 33.50 1vnd n LYS 65 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1vnd s ARG 66 N -1.82 3.44 0.00 1.97 1.70 -1.26 -4.99 118.95 118.00 1vnd s ARG 66 Ca 0.31 -0.71 0.22 0.00 -0.47 0.00 0.00 55.73 55.09 1vnd s ARG 66 Cb 0.26 -2.89 0.36 0.00 -0.57 0.00 0.00 34.95 32.11 1vnd s ARG 66 CO 0.04 0.43 1.34 0.00 -1.08 0.00 0.00 175.30 176.03 1vnd n ALA 67 N -1.27 2.42 -1.72 7.88 0.00 -1.21 -4.54 120.51 122.06 1vnd n ALA 67 Ca -0.08 -0.93 -0.36 0.00 0.00 0.00 0.00 53.44 52.07 1vnd n ALA 67 Cb 0.56 -0.82 0.05 0.00 0.00 0.00 0.00 19.45 19.25 1vnd n ALA 67 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1vnd n GLN 68 N 1.40 2.82 -2.33 0.00 6.02 -1.26 -4.65 117.38 119.39 1vnd n GLN 68 Ca 0.18 -3.53 -0.27 0.00 -0.01 0.00 0.00 57.00 53.36 1vnd n GLN 68 Cb 0.59 -2.28 0.01 0.00 1.02 0.00 0.00 30.24 29.58 1vnd n GLN 68 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1vnd n ASN 69 N -0.70 4.98 -4.71 1.08 6.94 -1.26 -5.00 115.26 116.60 1vnd n ASN 69 Ca 0.56 -3.73 -0.42 0.00 -0.02 0.00 0.00 54.58 50.97 1vnd n ASN 69 Cb 0.48 -0.48 -0.03 0.00 -2.36 0.00 0.00 39.78 37.39 1vnd n ASN 69 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 1vnd s GLU 70 N -3.59 4.13 0.35 -3.83 2.12 -1.26 -3.67 118.70 112.94 1vnd s GLU 70 Ca 0.49 2.62 -0.16 0.00 0.36 0.00 0.00 54.97 58.28 1vnd s GLU 70 Cb 0.41 -3.32 -0.09 0.00 0.26 0.00 0.00 34.13 31.38 1vnd s GLU 70 CO -0.15 -0.80 0.78 -1.59 -0.54 0.00 0.00 175.26 172.96 1vnd s LYS 71 N 1.93 4.02 0.00 4.30 0.00 -1.26 -5.05 119.74 123.68 1vnd s LYS 71 Ca 0.78 0.74 0.00 0.00 0.00 0.00 0.00 55.97 57.49 1vnd s LYS 71 Cb -0.48 -2.38 0.00 0.00 0.00 0.00 0.00 37.83 34.97 1vnd s LYS 71 CO 0.34 0.10 0.00 0.41 0.00 0.00 0.00 175.35 176.20 1vnd n GLY 72 N -0.51 0.81 2.72 0.59 0.00 -1.24 -5.11 105.19 102.45 1vnd n GLY 72 Ca 0.04 -0.48 -0.24 0.00 0.00 0.00 0.00 46.02 45.34 1vnd n GLY 72 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1vnd s TYR 73 N -2.61 0.57 -0.97 1.61 1.13 -1.24 -4.99 117.35 110.85 1vnd s TYR 73 Ca 0.00 -0.26 -0.00 0.00 -1.41 0.00 0.00 57.07 55.40 1vnd s TYR 73 Cb 0.00 -0.78 0.32 0.00 -1.10 0.00 0.00 41.96 40.40 1vnd s TYR 73 CO 0.00 -0.39 1.65 -0.85 -2.51 0.00 0.00 175.55 173.45 1vnd n GLU 74 N 5.17 4.99 0.00 -3.49 0.00 -1.26 -4.90 120.64 121.16 1vnd n GLU 74 Ca -0.07 -4.68 0.00 0.00 0.00 0.00 0.00 57.16 52.41 1vnd n GLU 74 Cb 0.49 -2.44 0.00 0.00 0.00 0.00 0.00 31.44 29.49 1vnd n GLU 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1vnd n GLY 75 N 0.10 1.49 2.88 -1.84 0.00 -1.26 -4.80 105.19 101.77 1vnd n GLY 75 Ca 0.42 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 45.52 1vnd n GLY 75 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1vnd s HIS 76 N 0.00 -0.76 -2.00 1.61 5.65 -1.26 -5.10 115.29 113.43 1vnd s HIS 76 Ca 0.00 -0.21 0.12 0.00 0.25 0.00 0.00 55.06 55.22 1vnd s HIS 76 Cb 0.00 -0.22 0.73 0.00 -1.18 0.00 0.00 32.58 31.90 1vnd s HIS 76 CO 0.00 -1.00 1.16 -2.30 -0.65 0.00 0.00 174.74 171.95