#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5k s ARG 2 N 0.00 0.43 0.00 0.03 1.70 -1.26 -5.04 118.95 114.81 2k5k s ARG 2 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 55.73 55.32 2k5k s ARG 2 Cb 0.00 0.20 0.00 0.00 -0.57 0.00 0.00 34.95 34.58 2k5k s ARG 2 CO 0.00 -0.09 0.00 -3.47 -1.08 0.00 0.00 175.30 170.66 2k5k n ASP 3 N 2.21 0.38 -4.24 -2.89 -0.08 -1.26 -4.83 116.55 105.85 2k5k n ASP 3 Ca -0.17 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 52.90 2k5k n ASP 3 Cb 0.57 0.02 -0.12 0.00 2.34 0.00 0.00 41.12 43.93 2k5k n ASP 3 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 2k5k s MET 4 N -1.09 1.00 0.09 -0.67 -1.94 -1.26 -5.06 119.30 110.38 2k5k s MET 4 Ca 0.00 -1.10 -0.21 0.00 -1.71 0.00 0.00 55.69 52.67 2k5k s MET 4 Cb 0.00 -1.10 -0.10 0.00 2.01 0.00 0.00 34.83 35.64 2k5k s MET 4 CO 0.00 0.25 1.68 1.79 -0.01 0.00 0.00 175.02 178.73 2k5k h THR 5 N 4.04 1.11 0.00 2.05 1.35 -2.04 -3.45 112.91 115.97 2k5k h THR 5 Ca -0.43 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 2k5k h THR 5 Cb 1.19 1.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 2k5k h THR 5 CO 0.42 0.10 0.00 -0.62 -0.25 0.00 0.00 175.52 175.17 2k5k n GLU 6 N -4.92 0.00 -2.12 4.72 1.02 -1.26 -4.29 120.64 113.79 2k5k n GLU 6 Ca -0.05 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.68 2k5k n GLU 6 Cb 0.08 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.47 2k5k n GLU 6 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2k5k s GLU 7 N 0.00 4.31 -0.09 3.49 2.02 -1.26 -5.02 118.70 122.15 2k5k s GLU 7 Ca 0.00 2.15 0.03 0.00 0.02 0.00 0.00 54.97 57.17 2k5k s GLU 7 Cb 0.00 -3.20 0.01 0.00 0.10 0.00 0.00 34.13 31.03 2k5k s GLU 7 CO 0.00 -0.43 -0.19 0.99 0.02 0.00 0.00 175.26 175.65 2k5k s THR 8 N 0.78 1.68 0.68 3.63 2.01 -1.26 -5.13 115.64 118.03 2k5k s THR 8 Ca 0.63 -0.79 -0.12 0.00 0.31 0.00 0.00 61.69 61.72 2k5k s THR 8 Cb -0.39 -1.49 0.00 0.00 0.01 0.00 0.00 72.50 70.64 2k5k s THR 8 CO 0.34 0.48 1.06 -0.13 -0.69 0.00 0.00 174.62 175.68 2k5k s ARG 9 N 0.55 2.95 -0.02 4.92 3.00 -1.26 -5.06 118.95 124.03 2k5k s ARG 9 Ca -0.15 1.06 0.05 0.00 0.00 0.00 0.00 55.73 56.68 2k5k s ARG 9 Cb -0.17 -1.99 -0.01 0.00 0.00 0.00 0.00 34.95 32.78 2k5k s ARG 9 CO 0.05 -1.10 -0.15 0.15 0.00 0.00 0.00 175.30 174.25 2k5k s LYS 10 N -4.75 1.33 -0.74 3.54 1.02 -1.26 -4.89 119.74 114.00 2k5k s LYS 10 Ca 0.60 -0.55 -0.07 0.00 0.02 0.00 0.00 55.97 55.97 2k5k s LYS 10 Cb -0.15 -1.26 0.01 0.00 -0.52 0.00 0.00 37.83 35.91 2k5k s LYS 10 CO 0.50 0.30 0.59 -0.25 -0.92 0.00 0.00 175.35 175.58 2k5k n ASP 11 N 2.82 -4.76 -4.54 2.83 8.00 -1.26 -4.81 116.55 114.83 2k5k n ASP 11 Ca -0.15 -0.82 -0.40 0.00 0.71 0.00 0.00 54.79 54.13 2k5k n ASP 11 Cb 0.54 -1.54 0.02 0.00 -0.02 0.00 0.00 41.12 40.12 2k5k n ASP 11 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2k5k n LEU 12 N -2.15 1.73 -4.71 0.64 4.77 -1.26 -4.94 117.00 111.07 2k5k n LEU 12 Ca -0.28 0.90 -0.30 0.00 -0.03 0.00 0.00 56.01 56.30 2k5k n LEU 12 Cb 0.68 -1.26 0.14 0.00 -2.33 0.00 0.00 43.42 40.64 2k5k n LEU 12 CO 0.61 -2.24 0.67 -2.16 -1.33 0.00 0.00 177.39 172.94 2k5k s PRO 13 N -2.04 1.41 0.00 3.23 0.04 -1.26 -4.86 135.00 131.52 2k5k s PRO 13 Ca 0.67 1.10 -0.03 0.00 0.04 0.00 0.00 61.00 62.78 2k5k s PRO 13 Cb -0.52 -1.81 -0.13 0.00 0.04 0.00 0.00 34.50 32.08 2k5k s PRO 13 CO 0.55 -2.21 2.38 -0.35 0.04 0.00 0.00 177.00 177.40 2k5k n PRO 14 N -3.90 1.24 -0.10 0.56 -0.04 -1.26 -4.37 135.00 127.12 2k5k n PRO 14 Ca 0.08 -0.49 -0.11 0.00 -0.04 0.00 0.00 63.50 62.94 2k5k n PRO 14 Cb 0.54 -1.62 -0.03 0.00 -0.04 0.00 0.00 33.50 32.34 2k5k n PRO 14 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2k5k h GLU 15 N 3.09 0.55 -0.01 0.54 4.57 -1.98 0.26 114.58 121.59 2k5k h GLU 15 Ca 0.09 -0.18 -0.25 0.00 -1.18 0.00 0.00 59.36 57.84 2k5k h GLU 15 Cb 1.00 -0.05 0.02 0.00 -0.16 0.00 0.00 28.75 29.56 2k5k h GLU 15 CO 0.20 0.70 -1.00 0.00 -1.18 0.00 0.00 179.01 177.73 2k5k h ALA 16 N 0.83 0.21 -0.40 2.92 0.00 -1.99 -1.84 119.26 118.99 2k5k h ALA 16 Ca 0.09 -0.70 -0.03 0.00 0.00 0.00 0.00 54.91 54.27 2k5k h ALA 16 Cb 0.46 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2k5k h ALA 16 CO 0.02 0.72 0.15 1.25 0.00 0.00 0.00 179.25 181.39 2k5k h LEU 17 N 0.36 0.56 -0.97 0.00 5.85 -1.86 -1.88 115.31 117.36 2k5k h LEU 17 Ca -0.11 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.36 2k5k h LEU 17 Cb 1.65 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.51 2k5k h LEU 17 CO 0.19 0.59 -0.05 -0.09 -0.34 0.00 0.00 178.44 178.74 2k5k h ARG 18 N 0.50 0.69 -0.84 1.25 9.65 -0.53 -2.30 114.38 122.80 2k5k h ARG 18 Ca 0.13 -0.19 0.06 0.00 -1.10 0.00 0.00 59.98 58.88 2k5k h ARG 18 Cb 0.21 -0.08 -0.06 0.00 -1.39 0.00 0.00 29.97 28.65 2k5k h ARG 18 CO -0.01 0.74 0.52 0.00 2.80 0.00 0.00 179.97 184.02 2k5k h ALA 19 N 1.31 1.15 -0.74 2.80 0.00 -0.79 0.24 119.26 123.23 2k5k h ALA 19 Ca 0.12 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2k5k h ALA 19 Cb 0.47 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2k5k h ALA 19 CO 0.02 0.27 0.32 -0.07 0.00 0.00 0.00 179.25 179.80 2k5k h LEU 20 N 0.96 1.00 -0.75 0.00 3.38 -0.83 0.39 115.31 119.45 2k5k h LEU 20 Ca 0.37 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 2k5k h LEU 20 Cb 0.16 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2k5k h LEU 20 CO -0.17 0.88 0.11 0.00 0.09 0.00 0.00 178.44 179.35 2k5k h ALA 21 N 1.16 0.97 -0.41 1.53 0.00 -0.66 -1.10 119.26 120.75 2k5k h ALA 21 Ca 0.25 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 2k5k h ALA 21 Cb 0.17 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2k5k h ALA 21 CO -0.03 0.65 -0.21 0.93 0.00 0.00 0.00 179.25 180.60 2k5k h GLU 22 N 1.00 0.81 -0.10 0.00 5.08 -0.11 -2.25 114.58 119.00 2k5k h GLU 22 Ca 0.20 -0.32 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 2k5k h GLU 22 Cb 0.42 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2k5k h GLU 22 CO 0.01 0.94 -0.16 0.00 -1.00 0.00 0.00 179.01 178.80 2k5k h ALA 23 N 1.06 1.56 -0.36 3.43 0.00 -0.53 -2.34 119.26 122.08 2k5k h ALA 23 Ca 0.10 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 2k5k h ALA 23 Cb 0.72 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2k5k h ALA 23 CO 0.06 0.32 -0.36 1.49 0.00 0.00 0.00 179.25 180.76 2k5k h GLU 24 N 0.15 0.83 0.00 0.00 4.81 -0.66 -2.74 114.58 116.97 2k5k h GLU 24 Ca 0.03 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 2k5k h GLU 24 Cb 0.37 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2k5k h GLU 24 CO 0.02 1.05 0.51 0.93 -0.73 0.00 0.00 179.01 180.80 2k5k h GLU 25 N 0.68 0.00 -3.68 1.92 5.08 -0.88 -3.38 114.58 114.32 2k5k h GLU 25 Ca 0.06 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.25 2k5k h GLU 25 Cb 0.92 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.95 2k5k h GLU 25 CO 0.09 0.00 -0.60 -0.98 -1.00 0.00 0.00 179.01 176.52 2k5k s ARG 26 N -3.52 0.32 0.03 2.33 1.70 -1.03 -5.14 118.95 113.64 2k5k s ARG 26 Ca -0.01 -0.33 -0.05 0.00 -0.47 0.00 0.00 55.73 54.87 2k5k s ARG 26 Cb 0.03 0.13 -0.01 0.00 -0.57 0.00 0.00 34.95 34.53 2k5k s ARG 26 CO 0.11 -0.06 0.09 1.03 -1.08 0.00 0.00 175.30 175.38 2k5k s ARG 27 N -1.02 0.55 0.20 3.89 0.52 -1.26 -4.86 118.95 116.97 2k5k s ARG 27 Ca -0.11 -0.70 -0.11 0.00 -0.52 0.00 0.00 55.73 54.29 2k5k s ARG 27 Cb -0.07 0.21 0.14 0.00 0.52 0.00 0.00 34.95 35.76 2k5k s ARG 27 CO 0.00 -0.13 1.85 -0.09 0.02 0.00 0.00 175.30 176.95 2k5k h ARG 28 N 3.83 0.98 -0.44 3.54 2.43 -1.95 -2.10 114.38 120.66 2k5k h ARG 28 Ca -0.32 -0.08 -0.05 0.00 -0.81 0.00 0.00 59.98 58.72 2k5k h ARG 28 Cb 1.19 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.51 2k5k h ARG 28 CO 0.48 0.68 0.08 0.00 -1.51 0.00 0.00 179.97 179.71 2k5k h ARG 29 N 0.99 0.67 -0.42 0.20 3.08 -1.96 -2.44 114.38 114.50 2k5k h ARG 29 Ca 0.26 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 60.12 2k5k h ARG 29 Cb -0.05 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 2k5k h ARG 29 CO -0.05 0.63 0.01 0.00 -1.07 0.00 0.00 179.97 179.49 2k5k h ALA 30 N 1.44 1.22 0.00 0.04 0.00 -1.77 -1.26 119.26 118.93 2k5k h ALA 30 Ca 0.14 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2k5k h ALA 30 Cb 0.29 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2k5k h ALA 30 CO 0.00 0.52 0.00 1.63 0.00 0.00 0.00 179.25 181.40 2k5k n LYS 31 N -4.24 0.27 -2.20 0.00 4.76 -0.92 -4.83 118.16 110.99 2k5k n LYS 31 Ca 0.02 0.09 -0.04 0.00 -2.87 0.00 0.00 58.31 55.51 2k5k n LYS 31 Cb 0.27 -1.50 0.02 0.00 -1.84 0.00 0.00 35.03 31.98 2k5k n LYS 31 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2k5k n ALA 32 N -1.15 -0.69 -3.21 7.82 0.00 -0.48 -5.05 120.51 117.75 2k5k n ALA 32 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.39 2k5k n ALA 32 Cb 0.07 -1.30 -0.05 0.00 0.00 0.00 0.00 19.45 18.17 2k5k n ALA 32 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2k5k s LEU 33 N -3.28 -0.38 0.23 0.00 2.96 -1.21 -5.00 118.68 112.00 2k5k s LEU 33 Ca 0.04 -1.73 -0.06 0.00 -0.22 0.00 0.00 54.13 52.16 2k5k s LEU 33 Cb -0.01 0.93 0.22 0.00 0.50 0.00 0.00 46.19 47.84 2k5k s LEU 33 CO 0.18 -0.18 1.78 -0.78 -1.32 0.00 0.00 176.35 176.03 2k5k h ASP 34 N 6.35 1.01 -3.08 3.68 1.82 -1.87 -3.39 116.42 120.94 2k5k h ASP 34 Ca 0.09 -0.18 -0.03 0.00 -0.39 0.00 0.00 57.03 56.52 2k5k h ASP 34 Cb 1.06 -0.26 0.02 0.00 0.68 0.00 0.00 39.33 40.84 2k5k h ASP 34 CO 0.17 0.93 -0.11 -0.11 -1.61 0.00 0.00 179.24 178.51 2k5k n LEU 35 N -4.26 -2.41 0.24 2.28 7.94 -1.26 -4.95 117.00 114.57 2k5k n LEU 35 Ca 0.06 -0.09 0.16 0.00 -1.11 0.00 0.00 56.01 55.03 2k5k n LEU 35 Cb 0.22 -0.84 0.72 0.00 0.53 0.00 0.00 43.42 44.05 2k5k n LEU 35 CO 0.41 0.02 0.97 1.55 -1.11 0.00 0.00 177.39 179.24 2k5k h PRO 36 N -0.17 0.00 -6.83 1.96 0.13 -2.04 -3.44 132.00 121.61 2k5k h PRO 36 Ca -0.08 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.52 2k5k h PRO 36 Cb 1.04 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.25 2k5k h PRO 36 CO 0.06 0.00 0.84 0.15 -0.23 0.00 0.00 178.00 178.82 2k5k s LYS 37 N -3.65 4.15 0.00 0.86 1.02 -1.26 -4.78 119.74 116.07 2k5k s LYS 37 Ca 0.00 2.53 0.00 0.00 0.02 0.00 0.00 55.97 58.52 2k5k s LYS 37 Cb 0.09 -3.02 0.00 0.00 -0.52 0.00 0.00 37.83 34.38 2k5k s LYS 37 CO 0.44 -0.57 0.00 -1.91 -0.92 0.00 0.00 175.35 172.39 2k5k n GLU 38 N 1.77 0.00 0.22 1.68 2.13 -1.26 -4.91 120.64 120.27 2k5k n GLU 38 Ca 0.06 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.97 2k5k n GLU 38 Cb 0.38 -0.00 0.47 0.00 0.27 0.00 0.00 31.44 32.57 2k5k n GLU 38 CO 0.00 0.00 0.00 -0.84 -0.41 0.00 0.00 177.13 175.88 2k5k h ILE 39 N 0.00 0.73 -3.13 6.31 3.07 -2.02 -3.44 117.51 119.04 2k5k h ILE 39 Ca 0.00 -1.12 -0.46 0.00 1.55 0.00 0.00 64.86 64.83 2k5k h ILE 39 Cb 0.00 1.71 0.10 0.00 -0.27 0.00 0.00 36.82 38.36 2k5k h ILE 39 CO 0.00 0.26 0.22 -0.83 -1.05 0.00 0.00 178.15 176.75 2k5k s GLY 40 N -4.29 1.75 -0.46 0.16 0.00 -1.26 -5.08 107.32 98.13 2k5k s GLY 40 Ca -0.01 -1.34 0.04 0.00 0.00 0.00 0.00 44.72 43.42 2k5k s GLY 40 CO 0.65 -0.78 0.92 0.61 0.00 0.00 0.00 173.10 174.50 2k5k n GLY 41 N -3.08 -0.46 3.80 0.20 0.00 -1.26 -5.12 105.19 99.27 2k5k n GLY 41 Ca 0.13 0.40 -0.35 0.00 0.00 0.00 0.00 46.02 46.20 2k5k n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k5k s ARG 42 N 0.65 4.13 0.29 1.61 0.52 -1.26 -5.02 118.95 119.87 2k5k s ARG 42 Ca 0.30 1.32 -0.29 0.00 -0.52 0.00 0.00 55.73 56.54 2k5k s ARG 42 Cb 0.18 -2.33 -0.10 0.00 0.52 0.00 0.00 34.95 33.23 2k5k s ARG 42 CO -0.18 -0.14 1.16 0.54 0.02 0.00 0.00 175.30 176.70 2k5k s ASN 43 N -1.89 7.13 0.00 0.23 2.20 -1.26 -5.04 114.94 116.31 2k5k s ASN 43 Ca 0.61 2.37 0.00 0.00 -0.94 0.00 0.00 52.86 54.90 2k5k s ASN 43 Cb -0.16 -2.63 0.00 0.00 -2.00 0.00 0.00 41.25 36.46 2k5k s ASN 43 CO 0.20 -0.25 0.00 0.61 -2.94 0.00 0.00 177.10 174.72 2k5k n GLY 44 N 1.16 6.53 3.71 0.45 0.00 -1.26 -5.12 105.19 110.66 2k5k n GLY 44 Ca -0.01 -1.98 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 2k5k n GLY 44 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2k5k n PRO 45 N 0.00 1.73 -2.78 1.61 -0.02 -1.26 -5.01 135.00 129.27 2k5k n PRO 45 Ca 0.00 0.63 -0.04 0.00 -2.02 0.00 0.00 63.50 62.07 2k5k n PRO 45 Cb 0.00 -2.46 0.01 0.00 -0.02 0.00 0.00 33.50 31.03 2k5k n PRO 45 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2k5k s GLU 46 N -2.58 0.97 0.54 -0.52 2.12 -1.26 -5.16 118.70 112.81 2k5k s GLU 46 Ca 0.67 -0.93 -0.22 0.00 0.36 0.00 0.00 54.97 54.86 2k5k s GLU 46 Cb -0.45 -0.04 -0.05 0.00 0.26 0.00 0.00 34.13 33.85 2k5k s GLU 46 CO 0.53 -1.21 1.38 -2.30 -0.54 0.00 0.00 175.26 173.12 2k5k n PRO 47 N 3.00 1.77 -1.00 4.30 -0.02 -1.26 -4.95 135.00 136.84 2k5k n PRO 47 Ca 0.17 0.65 -0.34 0.00 -2.02 0.00 0.00 63.50 61.96 2k5k n PRO 47 Cb 0.57 -2.60 0.12 0.00 -0.02 0.00 0.00 33.50 31.57 2k5k n PRO 47 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2k5k n VAL 48 N -0.95 1.20 -1.30 -1.45 0.31 -1.26 -4.81 118.33 110.06 2k5k n VAL 48 Ca 0.10 -0.21 -0.38 0.00 -0.01 0.00 0.00 64.34 63.84 2k5k n VAL 48 Cb 0.44 -0.93 -0.02 0.00 -0.91 0.00 0.00 33.84 32.42 2k5k n VAL 48 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2k5k n ARG 49 N -2.50 2.63 -4.32 5.55 1.74 -1.26 -4.89 116.66 113.61 2k5k n ARG 49 Ca 0.11 -2.11 -0.34 0.00 -0.77 0.00 0.00 57.85 54.74 2k5k n ARG 49 Cb 0.51 -2.92 -0.09 0.00 -1.02 0.00 0.00 32.46 28.94 2k5k n ARG 49 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 2k5k s PHE 50 N 3.37 3.14 0.15 -1.55 -0.12 -1.26 -5.11 117.98 116.60 2k5k s PHE 50 Ca 0.54 0.16 -0.22 0.00 -0.05 0.00 0.00 56.93 57.35 2k5k s PHE 50 Cb 0.14 -1.74 0.06 0.00 -0.63 0.00 0.00 43.02 40.85 2k5k s PHE 50 CO -0.03 0.47 0.57 0.20 -0.05 0.00 0.00 175.22 176.39 2k5k s GLY 51 N -1.19 -0.56 -0.26 1.99 0.00 -1.26 -5.15 107.32 100.88 2k5k s GLY 51 Ca 0.16 0.41 -0.01 0.00 0.00 0.00 0.00 44.72 45.28 2k5k s GLY 51 CO 0.06 0.09 0.30 0.51 0.00 0.00 0.00 173.10 174.06 2k5k s ASP 52 N -2.75 1.28 -0.11 1.64 -4.77 -1.26 -5.14 116.67 105.57 2k5k s ASP 52 Ca 0.01 -0.46 -0.02 0.00 -3.30 0.00 0.00 52.55 48.78 2k5k s ASP 52 Cb -0.01 0.63 -0.03 0.00 -1.09 0.00 0.00 42.92 42.42 2k5k s ASP 52 CO -0.13 -0.36 -0.02 0.26 0.70 0.00 0.00 175.17 175.62 2k5k s TRP 53 N 2.40 3.07 -0.40 2.11 0.51 -1.26 -5.03 118.94 120.34 2k5k s TRP 53 Ca 0.09 0.00 0.12 0.00 -2.12 0.00 0.00 56.10 54.20 2k5k s TRP 53 Cb -0.14 -1.83 0.39 0.00 -0.81 0.00 0.00 33.47 31.07 2k5k s TRP 53 CO -0.26 0.27 0.88 0.39 -0.51 0.00 0.00 176.95 177.73 2k5k n GLU 54 N 2.63 1.70 -0.16 4.98 1.02 -1.26 -4.92 120.64 124.62 2k5k n GLU 54 Ca -0.18 -3.73 -0.09 0.00 -0.02 0.00 0.00 57.16 53.15 2k5k n GLU 54 Cb 0.53 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 2k5k n GLU 54 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2k5k h LYS 55 N 2.95 0.72 -6.81 3.49 3.64 -2.04 -3.43 116.57 115.08 2k5k h LYS 55 Ca 0.07 -0.14 -0.55 0.00 -1.27 0.00 0.00 60.65 58.76 2k5k h LYS 55 Cb 0.95 -0.11 0.10 0.00 -0.41 0.00 0.00 32.23 32.76 2k5k h LYS 55 CO 0.60 0.67 0.72 0.36 -2.27 0.00 0.00 179.45 179.53 2k5k n LYS 56 N -4.55 2.48 -3.88 1.90 2.85 -1.26 -4.39 118.16 111.31 2k5k n LYS 56 Ca 0.01 0.87 0.00 0.00 -1.05 0.00 0.00 58.31 58.15 2k5k n LYS 56 Cb 0.17 -2.58 0.00 0.00 -0.65 0.00 0.00 35.03 31.97 2k5k n LYS 56 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2k5k n GLY 57 N 1.22 -0.54 0.25 2.58 0.00 -1.26 -4.91 105.19 102.53 2k5k n GLY 57 Ca 0.05 -1.06 -0.09 0.00 0.00 0.00 0.00 46.02 44.92 2k5k n GLY 57 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2k5k h ILE 58 N 0.00 1.24 0.00 -0.61 2.04 -1.99 -2.30 117.51 115.90 2k5k h ILE 58 Ca 0.00 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 64.99 2k5k h ILE 58 Cb 0.00 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 2k5k h ILE 58 CO 0.00 0.31 0.00 0.00 0.00 0.00 0.00 178.15 178.46 2k5k n ALA 59 N -2.39 1.73 -1.23 1.87 0.00 -1.26 -4.83 120.51 114.41 2k5k n ALA 59 Ca 0.01 -0.04 -0.58 0.00 0.00 0.00 0.00 53.44 52.83 2k5k n ALA 59 Cb 0.23 -1.27 -0.12 0.00 0.00 0.00 0.00 19.45 18.29 2k5k n ALA 59 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2k5k n ILE 60 N -1.56 0.00 -3.94 0.00 3.06 -0.87 -4.86 119.36 111.20 2k5k n ILE 60 Ca 0.04 0.00 -0.10 0.00 -2.50 0.00 0.00 62.75 60.18 2k5k n ILE 60 Cb 0.19 -0.49 -0.02 0.00 0.54 0.00 0.00 39.64 39.87 2k5k n ILE 60 CO 0.00 0.00 0.00 1.51 -2.50 0.00 0.00 176.55 175.56 2k5k s ASP 61 N 5.92 0.24 0.00 9.51 1.47 -1.26 -4.97 116.67 127.58 2k5k s ASP 61 Ca 1.18 -1.15 0.00 0.00 1.18 0.00 0.00 52.55 53.76 2k5k s ASP 61 Cb -1.46 0.73 0.00 0.00 -0.34 0.00 0.00 42.92 41.85 2k5k s ASP 61 CO 0.64 -1.43 0.00 0.33 0.68 0.00 0.00 175.17 175.39