#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n5n s ALA 2 N 0.00 3.17 -0.27 -5.12 0.00 -1.26 -5.07 121.76 113.21 1n5n s ALA 2 Ca 0.00 -0.87 -0.19 0.00 0.00 0.00 0.00 51.96 50.90 1n5n s ALA 2 Cb 0.00 -1.35 -0.02 0.00 0.00 0.00 0.00 23.12 21.74 1n5n s ALA 2 CO 0.00 0.59 0.58 0.42 0.00 0.00 0.00 175.76 177.35 1n5n s ILE 3 N -0.89 5.01 0.42 0.00 -1.09 -1.26 -4.40 121.20 118.99 1n5n s ILE 3 Ca 0.14 0.97 -0.07 0.00 -2.23 0.00 0.00 60.65 59.46 1n5n s ILE 3 Cb -0.11 -3.90 -0.05 0.00 -1.58 0.00 0.00 42.46 36.82 1n5n s ILE 3 CO 0.03 0.02 0.74 -0.76 -1.23 0.00 0.00 174.94 173.75 1n5n s LEU 4 N 2.43 3.77 0.22 2.97 1.43 -1.26 -5.02 118.68 123.22 1n5n s LEU 4 Ca 0.24 0.95 -0.30 0.00 -1.03 0.00 0.00 54.13 53.99 1n5n s LEU 4 Cb -0.15 -3.86 -0.08 0.00 0.03 0.00 0.00 46.19 42.12 1n5n s LEU 4 CO 0.09 -0.45 0.95 0.20 0.23 0.00 0.00 176.35 177.37 1n5n s ASN 5 N -3.64 7.62 -0.24 2.29 0.01 -1.26 -4.97 114.94 114.75 1n5n s ASN 5 Ca 0.48 1.93 -0.10 0.00 -0.71 0.00 0.00 52.86 54.46 1n5n s ASN 5 Cb -0.10 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 38.90 1n5n s ASN 5 CO 0.38 0.12 0.16 -0.63 -1.51 0.00 0.00 177.10 175.62 1n5n s ILE 6 N -0.99 5.34 0.73 0.60 1.01 -1.26 -4.40 121.20 122.23 1n5n s ILE 6 Ca 0.42 0.17 -0.15 0.00 0.00 0.00 0.00 60.65 61.09 1n5n s ILE 6 Cb -0.26 -3.49 0.04 0.00 0.01 0.00 0.00 42.46 38.76 1n5n s ILE 6 CO 0.32 0.34 1.23 -0.76 0.00 0.00 0.00 174.94 176.07 1n5n s LEU 7 N 1.10 3.33 0.01 2.97 1.43 0.57 -4.99 118.68 123.09 1n5n s LEU 7 Ca 0.07 2.43 0.05 0.00 -1.03 0.00 0.00 54.13 55.65 1n5n s LEU 7 Cb -0.14 -4.60 -0.01 0.00 0.03 0.00 0.00 46.19 41.47 1n5n s LEU 7 CO 0.05 -2.33 -0.14 -1.61 0.23 0.00 0.00 176.35 172.54 1n5n s GLU 8 N -3.85 1.08 0.24 1.70 2.02 -1.26 -4.30 118.70 114.33 1n5n s GLU 8 Ca 0.76 -0.60 -0.30 0.00 0.02 0.00 0.00 54.97 54.84 1n5n s GLU 8 Cb -0.31 -1.07 -0.14 0.00 0.10 0.00 0.00 34.13 32.71 1n5n s GLU 8 CO 0.45 0.28 1.18 0.34 0.02 0.00 0.00 175.26 177.53 1n5n n PHE 9 N 2.42 1.55 -1.40 1.61 7.35 0.15 -0.82 117.46 128.32 1n5n n PHE 9 Ca -0.16 0.62 -0.33 0.00 -0.76 0.00 0.00 57.45 56.83 1n5n n PHE 9 Cb 0.55 -2.32 0.08 0.00 0.35 0.00 0.00 39.48 38.14 1n5n n PHE 9 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1n5n n PRO 10 N 1.39 2.75 -1.68 -7.13 -0.04 -1.26 -4.76 135.00 124.27 1n5n n PRO 10 Ca 0.12 -3.37 -0.48 0.00 -0.04 0.00 0.00 63.50 59.73 1n5n n PRO 10 Cb 0.29 -2.27 -0.05 0.00 -0.04 0.00 0.00 33.50 31.43 1n5n n PRO 10 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1n5n n ASP 11 N -0.92 3.48 0.22 3.54 -0.08 -0.00 -4.80 116.55 118.00 1n5n n ASP 11 Ca 0.60 0.98 0.15 0.00 -1.51 0.00 0.00 54.79 55.01 1n5n n ASP 11 Cb 0.77 -1.39 0.73 0.00 2.34 0.00 0.00 41.12 43.57 1n5n n ASP 11 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1n5n h PRO 12 N 8.99 0.00 0.00 -0.67 0.13 -2.01 -1.47 132.00 136.97 1n5n h PRO 12 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1n5n h PRO 12 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1n5n h PRO 12 CO 0.94 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.25 1n5n n ARG 13 N -2.59 0.18 0.01 0.86 1.74 -1.26 -1.04 116.66 114.56 1n5n n ARG 13 Ca -0.01 0.48 0.10 0.00 -0.77 0.00 0.00 57.85 57.66 1n5n n ARG 13 Cb 0.14 -1.89 0.45 0.00 -1.02 0.00 0.00 32.46 30.13 1n5n n ARG 13 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1n5n n LEU 14 N -2.24 0.09 -0.73 0.55 4.77 -0.55 -2.46 117.00 116.42 1n5n n LEU 14 Ca 0.01 0.52 0.12 0.00 -0.03 0.00 0.00 56.01 56.63 1n5n n LEU 14 Cb 0.18 -0.50 0.33 0.00 -2.33 0.00 0.00 43.42 41.11 1n5n n LEU 14 CO 0.17 -0.17 0.76 0.54 -1.33 0.00 0.00 177.39 177.36 1n5n n ARG 15 N -1.59 1.98 -2.47 3.23 5.12 -0.20 -4.38 116.66 118.35 1n5n n ARG 15 Ca 0.05 -1.46 -0.37 0.00 -1.93 0.00 0.00 57.85 54.15 1n5n n ARG 15 Cb 0.25 -1.45 -0.03 0.00 -1.16 0.00 0.00 32.46 30.07 1n5n n ARG 15 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 1n5n s THR 16 N -1.82 3.56 -0.13 0.55 -1.32 -1.03 -4.36 115.64 111.08 1n5n s THR 16 Ca 0.34 1.19 -0.22 0.00 -1.21 0.00 0.00 61.69 61.79 1n5n s THR 16 Cb 0.20 -3.61 -0.03 0.00 -1.51 0.00 0.00 72.50 67.55 1n5n s THR 16 CO 0.30 0.00 0.66 -0.63 -2.21 0.00 0.00 174.62 172.74 1n5n s ILE 17 N -1.63 5.04 0.41 5.08 -1.09 -1.26 -3.64 121.20 124.10 1n5n s ILE 17 Ca 0.59 1.31 -0.24 0.00 -2.23 0.00 0.00 60.65 60.09 1n5n s ILE 17 Cb -0.24 -3.99 -0.09 0.00 -1.58 0.00 0.00 42.46 36.57 1n5n s ILE 17 CO 0.29 0.18 1.07 0.00 -1.23 0.00 0.00 174.94 175.26 1n5n s ALA 18 N 1.34 3.06 0.16 9.38 0.00 0.71 -4.93 121.76 131.46 1n5n s ALA 18 Ca 0.33 0.74 -0.11 0.00 0.00 0.00 0.00 51.96 52.92 1n5n s ALA 18 Cb -0.17 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.60 1n5n s ALA 18 CO 0.14 -0.30 0.50 0.15 0.00 0.00 0.00 175.76 176.24 1n5n s LYS 19 N -2.57 3.84 0.62 0.00 1.02 -0.39 -4.69 119.74 117.56 1n5n s LYS 19 Ca 0.59 0.29 -0.19 0.00 0.02 0.00 0.00 55.97 56.69 1n5n s LYS 19 Cb -0.23 -2.85 -0.02 0.00 -0.52 0.00 0.00 37.83 34.21 1n5n s LYS 19 CO 0.29 0.45 1.28 -2.14 -0.92 0.00 0.00 175.35 174.30 1n5n s PRO 20 N -2.28 2.76 -0.15 -1.68 0.02 -1.26 -0.75 135.00 131.65 1n5n s PRO 20 Ca 0.40 2.02 -0.27 0.00 0.02 0.00 0.00 61.00 63.17 1n5n s PRO 20 Cb -0.13 -1.92 -0.01 0.00 0.02 0.00 0.00 34.50 32.45 1n5n s PRO 20 CO 0.20 -1.43 0.90 0.08 -0.33 0.00 0.00 177.00 176.42 1n5n s VAL 21 N -1.44 4.84 -0.16 3.83 1.01 -1.26 -4.76 120.40 122.47 1n5n s VAL 21 Ca 0.80 1.78 0.21 0.00 0.00 0.00 0.00 61.98 64.77 1n5n s VAL 21 Cb -0.36 -4.20 -0.13 0.00 0.00 0.00 0.00 36.38 31.69 1n5n s VAL 21 CO 0.39 0.02 0.80 -0.62 0.00 0.00 0.00 175.10 175.68 1n5n n GLU 22 N 5.16 0.63 -3.75 2.72 1.02 -1.26 -4.87 120.64 120.28 1n5n n GLU 22 Ca 0.06 0.04 -0.12 0.00 -0.02 0.00 0.00 57.16 57.12 1n5n n GLU 22 Cb 0.49 -1.72 -0.12 0.00 -0.02 0.00 0.00 31.44 30.07 1n5n n GLU 22 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1n5n s VAL 23 N -3.29 -0.01 -0.72 2.62 0.11 -1.26 -5.09 120.40 112.76 1n5n s VAL 23 Ca -0.04 0.05 -0.19 0.00 -2.93 0.00 0.00 61.98 58.88 1n5n s VAL 23 Cb 0.10 -0.42 0.11 0.00 -1.53 0.00 0.00 36.38 34.64 1n5n s VAL 23 CO 0.83 0.02 0.88 -0.69 -3.33 0.00 0.00 175.10 172.82 1n5n s VAL 24 N 0.63 4.75 0.31 2.04 1.01 -1.26 -4.87 120.40 123.01 1n5n s VAL 24 Ca -0.04 -1.14 0.03 0.00 0.00 0.00 0.00 61.98 60.83 1n5n s VAL 24 Cb -0.05 -4.61 0.03 0.00 0.00 0.00 0.00 36.38 31.75 1n5n s VAL 24 CO -0.04 -1.30 0.26 -0.90 0.00 0.00 0.00 175.10 173.12 1n5n n ASP 25 N 6.50 1.88 0.20 3.32 5.68 -1.26 -4.76 116.55 128.10 1n5n n ASP 25 Ca 0.03 -2.04 0.04 0.00 -0.50 0.00 0.00 54.79 52.32 1n5n n ASP 25 Cb 0.45 -0.05 0.45 0.00 -1.14 0.00 0.00 41.12 40.83 1n5n n ASP 25 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1n5n h ASP 26 N 0.33 0.04 -0.52 -1.12 5.19 -1.98 -0.51 116.42 117.83 1n5n h ASP 26 Ca -0.19 -0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.23 1n5n h ASP 26 Cb 0.72 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 40.19 1n5n h ASP 26 CO 0.30 0.25 0.33 0.00 -3.12 0.00 0.00 179.24 177.00 1n5n h ALA 27 N 1.75 0.67 -0.20 3.45 0.00 -1.97 0.20 119.26 123.15 1n5n h ALA 27 Ca 0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1n5n h ALA 27 Cb 0.40 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1n5n h ALA 27 CO 0.03 0.06 0.06 0.28 0.00 0.00 0.00 179.25 179.68 1n5n h VAL 28 N 0.67 1.20 -0.71 0.00 2.07 -1.75 -1.52 116.25 116.21 1n5n h VAL 28 Ca 0.20 -0.62 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 1n5n h VAL 28 Cb -0.03 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 1n5n h VAL 28 CO -0.07 0.19 0.34 0.03 0.02 0.00 0.00 177.57 178.09 1n5n h ARG 29 N 0.15 1.00 -0.73 1.57 3.08 -0.88 0.83 114.38 119.39 1n5n h ARG 29 Ca 0.06 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 1n5n h ARG 29 Cb 0.25 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 1n5n h ARG 29 CO -0.00 0.77 0.38 1.96 -1.07 0.00 0.00 179.97 182.01 1n5n h GLN 30 N 1.00 1.04 -0.46 0.04 4.20 -0.38 -0.61 115.11 119.95 1n5n h GLN 30 Ca 0.24 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.81 1n5n h GLN 30 Cb 0.10 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 1n5n h GLN 30 CO -0.03 0.79 0.27 1.25 -0.67 0.00 0.00 178.83 180.45 1n5n h LEU 31 N 1.02 0.55 -0.75 1.46 5.85 -0.73 -0.65 115.31 122.06 1n5n h LEU 31 Ca 0.25 -0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.99 1n5n h LEU 31 Cb 0.08 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 1n5n h LEU 31 CO -0.04 0.45 0.42 0.40 -0.34 0.00 0.00 178.44 179.33 1n5n h ILE 32 N 0.61 0.96 -0.57 4.05 2.04 -0.47 0.96 117.51 125.09 1n5n h ILE 32 Ca 0.16 -0.26 -0.06 0.00 1.00 0.00 0.00 64.86 65.70 1n5n h ILE 32 Cb -0.00 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.19 1n5n h ILE 32 CO -0.03 0.14 0.10 0.44 0.00 0.00 0.00 178.15 178.80 1n5n h ASP 33 N 0.76 0.85 0.03 1.72 3.32 -0.74 0.50 116.42 122.85 1n5n h ASP 33 Ca 0.34 -0.18 -0.12 0.00 0.02 0.00 0.00 57.03 57.09 1n5n h ASP 33 Cb 0.24 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1n5n h ASP 33 CO -0.20 0.85 -0.39 0.44 -1.72 0.00 0.00 179.24 178.22 1n5n h ASP 34 N 0.85 0.50 -0.06 6.45 3.32 -0.45 -1.48 116.42 125.57 1n5n h ASP 34 Ca 0.18 -0.22 -0.12 0.00 0.02 0.00 0.00 57.03 56.89 1n5n h ASP 34 Cb 0.37 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1n5n h ASP 34 CO 0.01 0.85 -0.34 0.24 -1.72 0.00 0.00 179.24 178.27 1n5n h MET 35 N 0.40 0.55 -0.32 3.56 2.86 -0.24 0.69 114.93 122.42 1n5n h MET 35 Ca 0.04 -0.25 -0.14 0.00 -2.06 0.00 0.00 59.70 57.29 1n5n h MET 35 Cb 0.87 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.51 1n5n h MET 35 CO 0.07 0.82 -0.36 0.74 1.06 0.00 0.00 176.91 179.24 1n5n h PHE 36 N 0.46 0.87 -0.21 -0.22 0.04 0.23 0.17 116.94 118.28 1n5n h PHE 36 Ca 0.05 -0.24 -0.15 0.00 2.80 0.00 0.00 57.97 60.43 1n5n h PHE 36 Cb 0.82 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.77 1n5n h PHE 36 CO 0.03 0.99 -0.50 1.49 -0.60 0.00 0.00 178.31 179.72 1n5n h GLU 37 N 0.61 0.58 -0.42 1.51 4.57 -0.97 0.19 114.58 120.64 1n5n h GLU 37 Ca 0.06 -0.34 -0.03 0.00 -1.18 0.00 0.00 59.36 57.87 1n5n h GLU 37 Cb 0.89 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.50 1n5n h GLU 37 CO 0.08 0.94 0.14 1.15 -1.18 0.00 0.00 179.01 180.14 1n5n h THR 38 N 0.45 1.22 -0.48 0.32 2.02 -0.62 -0.45 112.91 115.36 1n5n h THR 38 Ca 0.02 -0.70 -0.09 0.00 0.77 0.00 0.00 66.41 66.41 1n5n h THR 38 Cb 1.03 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.31 1n5n h THR 38 CO 0.10 0.25 -0.05 -0.03 0.37 0.00 0.00 175.52 176.16 1n5n h MET 39 N 0.54 0.88 -0.01 6.66 1.85 -0.34 -1.85 114.93 122.66 1n5n h MET 39 Ca 0.14 -0.30 -0.09 0.00 -0.61 0.00 0.00 59.70 58.84 1n5n h MET 39 Cb 0.25 -0.07 -0.01 0.00 0.43 0.00 0.00 31.60 32.20 1n5n h MET 39 CO -0.01 0.94 -0.41 1.88 -0.40 0.00 0.00 176.91 178.91 1n5n h TYR 40 N 0.73 0.01 0.00 1.39 0.05 -0.49 1.00 116.97 119.66 1n5n h TYR 40 Ca 0.13 -0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.87 1n5n h TYR 40 Cb 0.58 -0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.31 1n5n h TYR 40 CO 0.04 0.42 -0.26 0.93 -1.05 0.00 0.00 178.16 178.25 1n5n h GLU 41 N 0.01 0.00 0.15 4.88 4.39 -0.80 -3.38 114.58 119.84 1n5n h GLU 41 Ca -0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 1n5n h GLU 41 Cb 0.73 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.34 1n5n h GLU 41 CO 0.05 0.14 -0.48 0.00 -1.16 0.00 0.00 179.01 177.57 1n5n h ALA 42 N 1.85 -0.98 -2.12 3.43 0.00 -1.19 -3.48 119.26 116.77 1n5n h ALA 42 Ca -0.01 -0.11 -0.46 0.00 0.00 0.00 0.00 54.91 54.33 1n5n h ALA 42 Cb 1.12 0.84 0.01 0.00 0.00 0.00 0.00 17.79 19.76 1n5n h ALA 42 CO 0.02 -1.09 -0.26 -1.25 0.00 0.00 0.00 179.25 176.67 1n5n s PRO 43 N -5.51 3.33 0.22 0.00 0.04 -1.26 -5.14 135.00 126.68 1n5n s PRO 43 Ca -0.15 -0.59 -0.15 0.00 0.04 0.00 0.00 61.00 60.15 1n5n s PRO 43 Cb 0.05 -2.73 0.01 0.00 0.04 0.00 0.00 34.50 31.87 1n5n s PRO 43 CO 0.55 0.12 0.49 0.20 0.04 0.00 0.00 177.00 178.40 1n5n s GLY 44 N -4.08 0.23 0.00 0.56 0.00 0.33 -5.02 107.32 99.34 1n5n s GLY 44 Ca 0.41 -0.58 0.19 0.00 0.00 0.00 0.00 44.72 44.75 1n5n s GLY 44 CO 0.34 -0.47 1.01 0.29 0.00 0.00 0.00 173.10 174.26 1n5n n ILE 45 N -0.35 0.00 -3.69 0.90 -5.35 -1.26 -4.56 119.36 105.06 1n5n n ILE 45 Ca -0.06 -0.35 -0.15 0.00 -0.27 0.00 0.00 62.75 61.92 1n5n n ILE 45 Cb 0.62 1.27 -0.08 0.00 -1.74 0.00 0.00 39.64 39.72 1n5n n ILE 45 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1n5n s GLY 46 N -2.04 -0.28 -0.20 3.28 0.00 -1.26 -0.83 107.32 105.98 1n5n s GLY 46 Ca 0.18 0.63 -0.11 0.00 0.00 0.00 0.00 44.72 45.41 1n5n s GLY 46 CO 0.42 0.37 0.49 -2.27 0.00 0.00 0.00 173.10 172.12 1n5n s LEU 47 N -1.30 -0.34 0.08 0.66 2.96 0.06 -4.86 118.68 115.95 1n5n s LEU 47 Ca -0.13 1.08 0.02 0.00 -0.22 0.00 0.00 54.13 54.88 1n5n s LEU 47 Cb -0.04 1.66 -0.04 0.00 0.50 0.00 0.00 46.19 48.28 1n5n s LEU 47 CO 0.06 -0.21 0.16 0.00 -1.32 0.00 0.00 176.35 175.05 1n5n s ALA 48 N 1.45 3.82 0.46 5.97 0.00 -1.26 -1.23 121.76 130.97 1n5n s ALA 48 Ca -0.09 -0.94 0.22 0.00 0.00 0.00 0.00 51.96 51.14 1n5n s ALA 48 Cb -0.07 -1.65 1.33 0.00 0.00 0.00 0.00 23.12 22.72 1n5n s ALA 48 CO -0.15 0.76 2.08 0.00 0.00 0.00 0.00 175.76 178.45 1n5n h ALA 49 N 3.04 1.53 -0.95 0.00 0.00 -1.37 -0.49 119.26 121.01 1n5n h ALA 49 Ca -0.46 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 54.47 1n5n h ALA 49 Cb 1.17 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.86 1n5n h ALA 49 CO 0.71 0.15 0.61 1.15 0.00 0.00 0.00 179.25 181.86 1n5n h THR 50 N 0.00 0.90 0.00 0.00 2.02 -1.71 0.93 112.91 115.05 1n5n h THR 50 Ca -0.00 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.87 1n5n h THR 50 Cb 0.25 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.60 1n5n h THR 50 CO 0.02 0.16 0.00 1.56 0.37 0.00 0.00 175.52 177.63 1n5n h GLN 51 N 0.89 0.00 -0.39 6.66 4.20 -1.38 -0.28 115.11 124.81 1n5n h GLN 51 Ca 0.47 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.17 1n5n h GLN 51 Cb 0.54 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1n5n h GLN 51 CO -0.23 0.00 0.01 1.33 -0.67 0.00 0.00 178.83 179.27 1n5n n VAL 52 N -2.64 2.50 -2.78 -0.54 0.24 0.17 -0.32 118.33 114.95 1n5n n VAL 52 Ca 0.00 -1.73 -0.18 0.00 -2.04 0.00 0.00 64.34 60.39 1n5n n VAL 52 Cb 0.19 -0.27 0.02 0.00 -1.47 0.00 0.00 33.84 32.31 1n5n n VAL 52 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1n5n n ASN 53 N -0.13 -5.20 -4.07 -1.34 5.15 -0.11 -4.83 115.26 104.73 1n5n n ASN 53 Ca 0.25 -0.20 -0.32 0.00 -0.60 0.00 0.00 54.58 53.71 1n5n n ASN 53 Cb 1.03 -4.08 -0.15 0.00 -0.53 0.00 0.00 39.78 36.04 1n5n n ASN 53 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1n5n s VAL 54 N -3.02 2.12 -1.22 3.44 1.01 -0.31 -5.00 120.40 117.42 1n5n s VAL 54 Ca 0.21 -1.48 -0.07 0.00 0.00 0.00 0.00 61.98 60.64 1n5n s VAL 54 Cb -0.09 -2.17 0.21 0.00 0.00 0.00 0.00 36.38 34.32 1n5n s VAL 54 CO 0.26 0.08 1.85 1.41 0.00 0.00 0.00 175.10 178.70 1n5n n HIS 55 N 4.48 2.67 -4.20 5.22 8.25 -1.26 -2.63 115.22 127.74 1n5n n HIS 55 Ca -0.15 -2.72 -0.14 0.00 -0.26 0.00 0.00 57.72 54.45 1n5n n HIS 55 Cb 0.44 -1.70 -0.10 0.00 1.12 0.00 0.00 29.99 29.75 1n5n n HIS 55 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1n5n s LYS 56 N -1.02 0.92 -1.01 -0.41 1.02 -1.26 -1.27 119.74 116.72 1n5n s LYS 56 Ca 0.40 -1.27 -0.17 0.00 0.02 0.00 0.00 55.97 54.95 1n5n s LYS 56 Cb 0.10 -0.55 0.15 0.00 -0.52 0.00 0.00 37.83 37.02 1n5n s LYS 56 CO 0.01 0.08 1.18 1.03 -0.92 0.00 0.00 175.35 176.72 1n5n s ARG 57 N -3.17 3.76 -0.03 1.68 0.52 0.07 -4.35 118.95 117.42 1n5n s ARG 57 Ca 0.10 -2.10 0.01 0.00 -0.52 0.00 0.00 55.73 53.21 1n5n s ARG 57 Cb -0.01 -4.90 0.02 0.00 0.52 0.00 0.00 34.95 30.58 1n5n s ARG 57 CO -0.00 -1.71 -0.01 0.42 0.02 0.00 0.00 175.30 174.02 1n5n s ILE 58 N 2.01 0.22 -0.05 1.52 1.01 -1.26 -0.61 121.20 124.04 1n5n s ILE 58 Ca 0.34 0.02 0.04 0.00 0.00 0.00 0.00 60.65 61.06 1n5n s ILE 58 Cb -0.05 -0.28 -0.00 0.00 0.01 0.00 0.00 42.46 42.13 1n5n s ILE 58 CO -0.07 0.14 -0.18 -0.69 0.00 0.00 0.00 174.94 174.14 1n5n s VAL 59 N 0.79 1.51 0.17 2.92 1.01 0.17 -1.24 120.40 125.73 1n5n s VAL 59 Ca -0.08 -0.76 0.08 0.00 0.00 0.00 0.00 61.98 61.22 1n5n s VAL 59 Cb -0.11 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 1n5n s VAL 59 CO -0.01 0.43 -0.07 0.68 0.00 0.00 0.00 175.10 176.13 1n5n s VAL 60 N 0.03 3.34 0.11 2.92 -7.23 -0.37 -0.89 120.40 118.31 1n5n s VAL 60 Ca -0.04 -1.55 -0.15 0.00 -1.81 0.00 0.00 61.98 58.42 1n5n s VAL 60 Cb -0.12 -2.65 0.03 0.00 0.56 0.00 0.00 36.38 34.20 1n5n s VAL 60 CO 0.02 -0.08 0.37 -0.32 -0.31 0.00 0.00 175.10 174.79 1n5n s MET 61 N -2.78 1.03 -0.30 4.82 1.75 -0.52 -0.76 119.30 122.54 1n5n s MET 61 Ca 0.25 -0.71 0.01 0.00 -1.25 0.00 0.00 55.69 53.99 1n5n s MET 61 Cb -0.09 0.45 0.19 0.00 2.84 0.00 0.00 34.83 38.22 1n5n s MET 61 CO 0.16 -0.39 0.61 0.34 -0.65 0.00 0.00 175.02 175.09 1n5n s ASP 62 N -2.74 -1.45 0.00 1.11 -1.08 -0.01 -0.51 116.67 111.98 1n5n s ASP 62 Ca 0.02 0.61 0.29 0.00 -0.52 0.00 0.00 52.55 52.96 1n5n s ASP 62 Cb 0.02 2.10 1.29 0.00 -1.46 0.00 0.00 42.92 44.87 1n5n s ASP 62 CO -0.11 -0.27 1.89 0.18 0.52 0.00 0.00 175.17 177.38 1n5n n LEU 63 N 5.42 0.54 -4.91 -1.34 4.77 -1.26 -4.51 117.00 115.72 1n5n n LEU 63 Ca 0.01 -0.06 -0.28 0.00 -0.03 0.00 0.00 56.01 55.65 1n5n n LEU 63 Cb 0.52 -0.13 0.05 0.00 -2.33 0.00 0.00 43.42 41.53 1n5n n LEU 63 CO -0.01 0.10 0.65 -0.94 -1.33 0.00 0.00 177.39 175.86 1n5n s SER 64 N -2.35 5.32 0.38 -1.43 1.04 -1.26 -4.98 113.70 110.42 1n5n s SER 64 Ca 0.33 0.83 0.22 0.00 0.48 0.00 0.00 55.95 57.80 1n5n s SER 64 Cb 0.20 -1.65 0.25 0.00 0.10 0.00 0.00 66.02 64.92 1n5n s SER 64 CO 0.44 -1.33 1.50 -0.33 0.98 0.00 0.00 173.24 174.51 1n5n h GLU 65 N -0.50 0.00 -0.37 4.02 5.08 -2.02 -3.31 114.58 117.48 1n5n h GLU 65 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1n5n h GLU 65 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1n5n h GLU 65 CO 0.62 0.07 0.00 -0.40 -1.00 0.00 0.00 179.01 178.30 1n5n n ASP 66 N -3.06 3.00 -1.91 1.42 5.75 -1.26 -4.96 116.55 115.53 1n5n n ASP 66 Ca 0.03 -1.98 -0.13 0.00 -0.01 0.00 0.00 54.79 52.70 1n5n n ASP 66 Cb 0.56 -0.25 0.02 0.00 -1.03 0.00 0.00 41.12 40.43 1n5n n ASP 66 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1n5n n LYS 67 N 0.64 -3.12 -0.04 0.11 4.01 -1.25 -4.89 118.16 113.62 1n5n n LYS 67 Ca 0.13 0.52 0.05 0.00 -0.51 0.00 0.00 58.31 58.50 1n5n n LYS 67 Cb 0.44 -4.57 0.07 0.00 -0.51 0.00 0.00 35.03 30.46 1n5n n LYS 67 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1n5n n SER 68 N -0.77 2.10 -3.24 4.39 3.41 -1.26 -4.73 113.62 113.53 1n5n n SER 68 Ca -0.05 -1.58 -0.25 0.00 -0.26 0.00 0.00 58.87 56.73 1n5n n SER 68 Cb 0.56 -0.06 -0.07 0.00 -0.26 0.00 0.00 64.21 64.39 1n5n n SER 68 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1n5n n GLU 69 N 0.51 1.15 -2.43 4.33 1.02 -1.26 -5.08 120.64 118.88 1n5n n GLU 69 Ca 0.07 -3.56 -0.35 0.00 -0.02 0.00 0.00 57.16 53.30 1n5n n GLU 69 Cb 0.29 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.23 1n5n n GLU 69 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1n5n s PRO 70 N -1.52 3.64 0.01 3.49 0.04 -1.26 -4.32 135.00 135.08 1n5n s PRO 70 Ca 0.36 1.47 0.01 0.00 0.04 0.00 0.00 61.00 62.88 1n5n s PRO 70 Cb 0.17 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.62 1n5n s PRO 70 CO -0.09 -0.58 -0.04 1.03 0.04 0.00 0.00 177.00 177.36 1n5n s ARG 71 N -3.22 0.34 -0.03 4.56 0.52 0.33 -5.00 118.95 116.45 1n5n s ARG 71 Ca 0.69 -0.32 0.05 0.00 -0.52 0.00 0.00 55.73 55.63 1n5n s ARG 71 Cb -0.20 -0.23 -0.01 0.00 0.52 0.00 0.00 34.95 35.03 1n5n s ARG 71 CO 0.23 0.06 -0.18 0.08 0.02 0.00 0.00 175.30 175.50 1n5n s VAL 72 N -0.52 1.49 -0.08 3.52 1.01 -1.26 -1.44 120.40 123.11 1n5n s VAL 72 Ca -0.03 -0.77 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 1n5n s VAL 72 Cb -0.04 -1.26 0.03 0.00 0.00 0.00 0.00 36.38 35.11 1n5n s VAL 72 CO -0.00 0.42 0.01 -0.36 0.00 0.00 0.00 175.10 175.17 1n5n s PHE 73 N -0.18 0.65 -0.02 5.22 0.40 -0.07 -4.69 117.98 119.30 1n5n s PHE 73 Ca 0.01 -0.20 0.04 0.00 -0.60 0.00 0.00 56.93 56.19 1n5n s PHE 73 Cb -0.10 -0.80 -0.03 0.00 0.51 0.00 0.00 43.02 42.61 1n5n s PHE 73 CO 0.01 -0.35 -0.14 0.42 0.70 0.00 0.00 175.22 175.86 1n5n s ILE 74 N 1.98 3.07 -1.40 0.64 1.01 0.17 -0.66 121.20 126.01 1n5n s ILE 74 Ca 0.04 -0.85 -0.03 0.00 0.00 0.00 0.00 60.65 59.81 1n5n s ILE 74 Cb -0.13 -2.25 0.00 0.00 0.01 0.00 0.00 42.46 40.10 1n5n s ILE 74 CO -0.05 0.50 0.38 0.59 0.00 0.00 0.00 174.94 176.36 1n5n n ASN 75 N 2.00 -0.67 -4.78 3.58 3.02 0.22 0.57 115.26 119.19 1n5n n ASN 75 Ca -0.17 -1.07 -0.33 0.00 -0.03 0.00 0.00 54.58 52.98 1n5n n ASN 75 Cb 0.52 -2.75 0.04 0.00 -0.61 0.00 0.00 39.78 36.98 1n5n n ASN 75 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1n5n s PRO 76 N -6.70 2.98 0.02 3.52 0.04 -1.26 -4.53 135.00 129.06 1n5n s PRO 76 Ca 0.06 1.30 -0.13 0.00 0.04 0.00 0.00 61.00 62.27 1n5n s PRO 76 Cb -0.03 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.55 1n5n s PRO 76 CO 0.91 -1.10 0.28 -1.21 0.04 0.00 0.00 177.00 175.93 1n5n s GLU 77 N -4.15 0.72 0.07 4.56 2.02 -0.06 -5.00 118.70 116.86 1n5n s GLU 77 Ca 0.65 -0.38 -0.00 0.00 0.02 0.00 0.00 54.97 55.26 1n5n s GLU 77 Cb -0.18 0.31 -0.04 0.00 0.10 0.00 0.00 34.13 34.32 1n5n s GLU 77 CO 0.41 -0.21 -0.03 -0.59 0.02 0.00 0.00 175.26 174.85 1n5n s PHE 78 N -1.95 0.65 -0.03 1.61 -0.12 -1.26 -0.60 117.98 116.27 1n5n s PHE 78 Ca -0.09 -1.04 0.00 0.00 -0.05 0.00 0.00 56.93 55.75 1n5n s PHE 78 Cb -0.03 -0.43 0.03 0.00 -0.63 0.00 0.00 43.02 41.95 1n5n s PHE 78 CO 0.00 -0.32 0.00 -2.00 -0.05 0.00 0.00 175.22 172.85 1n5n s GLU 79 N -3.90 0.34 0.43 1.99 2.12 -0.34 -4.94 118.70 114.39 1n5n s GLU 79 Ca 0.10 0.08 -0.26 0.00 0.36 0.00 0.00 54.97 55.25 1n5n s GLU 79 Cb 0.07 -0.54 -0.09 0.00 0.26 0.00 0.00 34.13 33.84 1n5n s GLU 79 CO -0.08 -0.15 1.39 -2.14 -0.54 0.00 0.00 175.26 173.74 1n5n s PRO 80 N 1.12 3.82 0.00 4.30 0.02 -1.26 -0.08 135.00 142.92 1n5n s PRO 80 Ca -0.08 2.33 0.14 0.00 0.02 0.00 0.00 61.00 63.41 1n5n s PRO 80 Cb -0.13 -2.72 0.24 0.00 0.02 0.00 0.00 34.50 31.91 1n5n s PRO 80 CO -0.02 -0.68 1.13 1.28 -0.33 0.00 0.00 177.00 178.38 1n5n n LEU 81 N -0.03 2.66 -3.50 -5.54 4.77 0.44 -4.78 117.00 111.02 1n5n n LEU 81 Ca 0.04 -1.44 -0.12 0.00 -0.03 0.00 0.00 56.01 54.46 1n5n n LEU 81 Cb 0.42 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.34 1n5n n LEU 81 CO 0.58 0.58 0.32 0.28 -1.33 0.00 0.00 177.39 177.82 1n5n s THR 82 N -1.12 0.02 -1.57 -5.08 -1.32 -1.25 -4.99 115.64 100.33 1n5n s THR 82 Ca 0.23 -0.18 0.25 0.00 -1.21 0.00 0.00 61.69 60.78 1n5n s THR 82 Cb 0.14 -1.04 0.10 0.00 -1.51 0.00 0.00 72.50 70.19 1n5n s THR 82 CO 0.19 -0.10 1.36 -0.62 -2.21 0.00 0.00 174.62 173.25 1n5n n GLU 83 N -0.12 0.64 -2.02 7.08 1.02 -1.26 -4.71 120.64 121.28 1n5n n GLU 83 Ca -0.17 -0.44 -0.41 0.00 -0.02 0.00 0.00 57.16 56.12 1n5n n GLU 83 Cb 0.63 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.55 1n5n n GLU 83 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1n5n s GLU 84 N -2.66 4.26 0.15 3.49 0.41 -1.26 -4.92 118.70 118.18 1n5n s GLU 84 Ca 0.18 2.32 0.08 0.00 -0.41 0.00 0.00 54.97 57.15 1n5n s GLU 84 Cb 0.18 -3.02 -0.04 0.00 -1.78 0.00 0.00 34.13 29.47 1n5n s GLU 84 CO 0.61 -0.31 -0.11 -1.64 -0.49 0.00 0.00 175.26 173.32 1n5n s MET 85 N -1.91 2.01 0.17 1.61 -1.94 -1.26 -1.08 119.30 116.91 1n5n s MET 85 Ca 0.50 -1.20 0.09 0.00 -1.71 0.00 0.00 55.69 53.38 1n5n s MET 85 Cb -0.42 -2.18 -0.04 0.00 2.01 0.00 0.00 34.83 34.20 1n5n s MET 85 CO 0.56 0.46 -0.19 -0.51 -0.01 0.00 0.00 175.02 175.33 1n5n s ASP 86 N -2.55 2.81 -0.10 3.03 1.01 -0.08 -4.77 116.67 116.03 1n5n s ASP 86 Ca 0.23 -0.87 0.01 0.00 0.71 0.00 0.00 52.55 52.63 1n5n s ASP 86 Cb -0.10 -0.17 -0.02 0.00 1.01 0.00 0.00 42.92 43.64 1n5n s ASP 86 CO 0.14 -0.01 -0.11 -1.58 0.21 0.00 0.00 175.17 173.81 1n5n s GLN 87 N -2.81 3.03 0.02 8.23 0.74 -1.26 -1.75 119.66 125.86 1n5n s GLN 87 Ca 0.17 -0.65 0.00 0.00 0.05 0.00 0.00 55.36 54.93 1n5n s GLN 87 Cb -0.06 -2.57 -0.01 0.00 1.10 0.00 0.00 33.01 31.46 1n5n s GLN 87 CO 0.07 0.42 -0.03 -0.47 -0.55 0.00 0.00 175.29 174.74 1n5n s TYR 88 N -0.19 0.24 -0.58 1.67 5.04 -0.66 -4.94 117.35 117.94 1n5n s TYR 88 Ca 0.01 -0.35 -0.23 0.00 -2.44 0.00 0.00 57.07 54.06 1n5n s TYR 88 Cb -0.13 -0.17 0.05 0.00 0.35 0.00 0.00 41.96 42.06 1n5n s TYR 88 CO 0.03 -0.11 0.94 -1.14 -1.34 0.00 0.00 175.55 173.92 1n5n s GLN 89 N -0.97 3.26 0.22 4.97 0.74 -1.26 -1.49 119.66 125.12 1n5n s GLN 89 Ca -0.10 -0.45 -0.06 0.00 0.05 0.00 0.00 55.36 54.80 1n5n s GLN 89 Cb -0.07 -4.11 -0.06 0.00 1.10 0.00 0.00 33.01 29.88 1n5n s GLN 89 CO -0.01 -1.57 0.48 -1.21 -0.55 0.00 0.00 175.29 172.43 1n5n s GLU 90 N 3.94 3.66 0.11 1.67 2.02 0.77 -4.67 118.70 126.20 1n5n s GLU 90 Ca 0.27 0.01 0.00 0.00 0.02 0.00 0.00 54.97 55.27 1n5n s GLU 90 Cb -0.14 -2.73 -0.00 0.00 0.10 0.00 0.00 34.13 31.36 1n5n s GLU 90 CO 0.16 0.34 0.01 0.41 0.02 0.00 0.00 175.26 176.20 1n5n n GLY 91 N -0.37 4.01 3.63 -1.39 0.00 -1.26 -1.07 105.19 108.74 1n5n n GLY 91 Ca -0.02 -2.17 -0.11 0.00 0.00 0.00 0.00 46.02 43.72 1n5n n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n5n h LEU 93 N 5.39 0.00 -1.94 0.00 3.38 -1.96 -0.83 115.31 119.36 1n5n h LEU 93 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1n5n h LEU 93 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1n5n h LEU 93 CO 0.09 0.10 0.00 -1.20 0.09 0.00 0.00 178.44 177.52 1n5n n SER 94 N -3.46 2.86 -3.11 -0.43 7.64 -1.26 -4.10 113.62 111.77 1n5n n SER 94 Ca -0.01 -2.14 -0.17 0.00 1.01 0.00 0.00 58.87 57.56 1n5n n SER 94 Cb 0.25 -0.39 -0.01 0.00 -1.01 0.00 0.00 64.21 63.05 1n5n n SER 94 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1n5n n VAL 95 N 0.77 -0.19 -1.76 0.44 0.31 -0.32 0.31 118.33 117.88 1n5n n VAL 95 Ca 0.16 -3.97 -0.41 0.00 -0.01 0.00 0.00 64.34 60.11 1n5n n VAL 95 Cb 0.50 -0.11 -0.01 0.00 -0.91 0.00 0.00 33.84 33.31 1n5n n VAL 95 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1n5n n PRO 96 N 0.44 2.72 -0.35 5.55 -0.04 -1.19 -2.65 135.00 139.48 1n5n n PRO 96 Ca 0.21 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.64 1n5n n PRO 96 Cb 0.65 -2.74 0.00 0.00 -0.04 0.00 0.00 33.50 31.38 1n5n n PRO 96 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1n5n n GLY 97 N 1.56 1.16 3.35 0.55 0.00 -1.26 -5.05 105.19 105.50 1n5n n GLY 97 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 1n5n n GLY 97 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n5n s PHE 98 N -2.92 2.38 -0.08 1.61 0.40 -1.08 -5.10 117.98 113.18 1n5n s PHE 98 Ca 0.00 -0.39 -0.03 0.00 -0.60 0.00 0.00 56.93 55.91 1n5n s PHE 98 Cb 0.00 -1.48 0.05 0.00 0.51 0.00 0.00 43.02 42.09 1n5n s PHE 98 CO 0.00 0.05 0.17 0.71 0.70 0.00 0.00 175.22 176.84 1n5n s TYR 99 N -0.69 -0.20 0.02 0.36 1.51 -1.26 -4.35 117.35 112.73 1n5n s TYR 99 Ca 0.11 0.61 -0.10 0.00 -1.01 0.00 0.00 57.07 56.68 1n5n s TYR 99 Cb -0.10 -0.16 0.01 0.00 -0.11 0.00 0.00 41.96 41.59 1n5n s TYR 99 CO 0.00 -0.24 0.20 -1.21 -1.11 0.00 0.00 175.55 173.19 1n5n s GLU 100 N 1.85 0.62 0.31 -0.62 0.41 -0.23 -4.86 118.70 116.18 1n5n s GLU 100 Ca -0.02 -0.46 -0.29 0.00 -0.41 0.00 0.00 54.97 53.79 1n5n s GLU 100 Cb -0.12 0.26 -0.10 0.00 -1.78 0.00 0.00 34.13 32.39 1n5n s GLU 100 CO -0.06 -0.17 1.25 -0.80 -0.49 0.00 0.00 175.26 174.99 1n5n s ASN 101 N -1.70 6.91 -0.01 -0.19 0.01 -1.26 -0.17 114.94 118.54 1n5n s ASN 101 Ca -0.10 2.57 0.00 0.00 -0.71 0.00 0.00 52.86 54.62 1n5n s ASN 101 Cb -0.04 -2.64 0.01 0.00 0.41 0.00 0.00 41.25 38.99 1n5n s ASN 101 CO -0.00 -0.43 0.01 -0.69 -1.51 0.00 0.00 177.10 174.48 1n5n s VAL 102 N -1.08 -0.02 -0.11 1.60 1.01 -0.56 -4.89 120.40 116.35 1n5n s VAL 102 Ca 0.48 0.09 -0.09 0.00 0.00 0.00 0.00 61.98 62.46 1n5n s VAL 102 Cb -0.38 -0.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1n5n s VAL 102 CO 0.49 0.04 0.20 -1.81 0.00 0.00 0.00 175.10 174.02 1n5n s ASP 103 N 0.43 6.46 0.08 3.32 -0.00 -1.26 -1.65 116.67 124.05 1n5n s ASP 103 Ca -0.04 0.54 -0.09 0.00 -0.00 0.00 0.00 52.55 52.97 1n5n s ASP 103 Cb -0.05 -2.12 -0.00 0.00 -0.00 0.00 0.00 42.92 40.75 1n5n s ASP 103 CO -0.01 0.34 0.19 -0.13 -0.00 0.00 0.00 175.17 175.56 1n5n s ARG 104 N -0.76 0.82 0.34 8.23 0.52 -0.71 -4.96 118.95 122.42 1n5n s ARG 104 Ca 0.16 -0.90 -0.27 0.00 -0.52 0.00 0.00 55.73 54.21 1n5n s ARG 104 Cb -0.13 0.33 -0.13 0.00 0.52 0.00 0.00 34.95 35.55 1n5n s ARG 104 CO 0.05 -0.25 1.01 -2.30 0.02 0.00 0.00 175.30 173.83 1n5n n PRO 105 N 0.08 1.39 0.21 3.54 -0.02 -1.26 -0.90 135.00 138.04 1n5n n PRO 105 Ca -0.16 0.49 0.11 0.00 -2.02 0.00 0.00 63.50 61.92 1n5n n PRO 105 Cb 0.62 -1.93 0.28 0.00 -0.02 0.00 0.00 33.50 32.45 1n5n n PRO 105 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1n5n h GLN 106 N 1.85 0.00 -3.47 -0.52 4.20 -1.39 -3.44 115.11 112.35 1n5n h GLN 106 Ca -0.42 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.10 1n5n h GLN 106 Cb 1.34 0.00 -0.26 0.00 0.30 0.00 0.00 27.48 28.86 1n5n h GLN 106 CO 0.59 0.14 -0.58 0.21 -0.67 0.00 0.00 178.83 178.53 1n5n s LYS 107 N -3.31 0.17 0.08 1.46 2.20 -1.26 -4.07 119.74 115.00 1n5n s LYS 107 Ca 0.04 0.10 -0.09 0.00 -0.36 0.00 0.00 55.97 55.66 1n5n s LYS 107 Cb 0.07 0.08 0.00 0.00 -1.51 0.00 0.00 37.83 36.47 1n5n s LYS 107 CO 0.66 -0.03 0.20 0.14 -0.36 0.00 0.00 175.35 175.96 1n5n s VAL 108 N -0.10 0.13 -0.24 4.02 -7.23 -0.13 -0.42 120.40 116.43 1n5n s VAL 108 Ca -0.02 -1.07 -0.09 0.00 -1.81 0.00 0.00 61.98 58.99 1n5n s VAL 108 Cb -0.02 -1.22 -0.04 0.00 0.56 0.00 0.00 36.38 35.67 1n5n s VAL 108 CO 0.00 -0.59 0.11 -0.60 -0.31 0.00 0.00 175.10 173.71 1n5n s ARG 109 N -3.50 3.87 0.09 4.82 3.52 0.88 0.02 118.95 128.64 1n5n s ARG 109 Ca 0.02 -0.37 -0.13 0.00 -0.13 0.00 0.00 55.73 55.11 1n5n s ARG 109 Cb 0.03 -3.41 -0.06 0.00 -1.56 0.00 0.00 34.95 29.95 1n5n s ARG 109 CO -0.09 -0.03 0.47 0.42 -0.81 0.00 0.00 175.30 175.26 1n5n s ILE 110 N 1.25 4.96 -0.01 4.11 1.01 0.61 -1.20 121.20 131.94 1n5n s ILE 110 Ca 0.06 0.75 0.06 0.00 0.00 0.00 0.00 60.65 61.52 1n5n s ILE 110 Cb -0.14 -3.72 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 1n5n s ILE 110 CO 0.05 0.36 -0.19 -0.54 0.00 0.00 0.00 174.94 174.62 1n5n s LYS 111 N -1.66 1.49 0.29 2.79 1.02 0.23 -0.57 119.74 123.32 1n5n s LYS 111 Ca 0.32 -0.68 -0.19 0.00 0.02 0.00 0.00 55.97 55.44 1n5n s LYS 111 Cb -0.15 -1.45 0.06 0.00 -0.52 0.00 0.00 37.83 35.76 1n5n s LYS 111 CO 0.17 0.39 0.87 0.00 -0.92 0.00 0.00 175.35 175.87 1n5n s ALA 112 N -0.47 -1.15 0.02 5.17 0.00 -0.72 -0.88 121.76 123.74 1n5n s ALA 112 Ca 0.07 -0.48 -0.01 0.00 0.00 0.00 0.00 51.96 51.54 1n5n s ALA 112 Cb -0.07 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.73 1n5n s ALA 112 CO -0.01 -1.02 0.18 -0.51 0.00 0.00 0.00 175.76 174.41 1n5n s LEU 113 N -3.13 4.32 0.00 0.00 1.43 0.19 -0.46 118.68 121.03 1n5n s LEU 113 Ca 0.16 0.29 -0.00 0.00 -1.03 0.00 0.00 54.13 53.55 1n5n s LEU 113 Cb -0.04 -2.73 0.01 0.00 0.03 0.00 0.00 46.19 43.46 1n5n s LEU 113 CO 0.08 0.22 0.07 -0.90 0.23 0.00 0.00 176.35 176.06 1n5n n ASP 114 N 0.68 0.07 0.01 2.29 5.68 0.66 -0.66 116.55 125.28 1n5n n ASP 114 Ca -0.09 -1.06 0.07 0.00 -0.50 0.00 0.00 54.79 53.22 1n5n n ASP 114 Cb 0.52 -0.05 0.33 0.00 -1.14 0.00 0.00 41.12 40.78 1n5n n ASP 114 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1n5n n ARG 115 N -1.14 0.02 -0.02 0.11 1.85 -1.26 -0.22 116.66 116.00 1n5n n ARG 115 Ca 0.01 0.27 0.10 0.00 -1.00 0.00 0.00 57.85 57.22 1n5n n ARG 115 Cb 0.04 -1.53 0.09 0.00 -1.05 0.00 0.00 32.46 30.01 1n5n n ARG 115 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1n5n n ASP 116 N -1.57 2.69 0.00 2.89 8.00 -1.26 -4.91 116.55 122.39 1n5n n ASP 116 Ca 0.03 -1.82 0.00 0.00 0.71 0.00 0.00 54.79 53.71 1n5n n ASP 116 Cb 0.17 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 1n5n n ASP 116 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1n5n n GLY 117 N 1.11 0.68 3.82 0.44 0.00 0.70 -4.90 105.19 107.04 1n5n n GLY 117 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1n5n n GLY 117 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1n5n s ASN 118 N -2.11 6.99 0.23 1.61 0.01 -1.26 -4.69 114.94 115.74 1n5n s ASN 118 Ca 0.00 1.18 -0.30 0.00 -0.71 0.00 0.00 52.86 53.04 1n5n s ASN 118 Cb 0.00 -2.33 -0.09 0.00 0.41 0.00 0.00 41.25 39.24 1n5n s ASN 118 CO 0.00 0.28 1.04 -2.16 -1.51 0.00 0.00 177.10 174.75 1n5n s PRO 119 N -1.14 4.71 0.22 -0.60 0.04 -1.26 -0.25 135.00 136.72 1n5n s PRO 119 Ca 0.28 1.66 -0.08 0.00 0.04 0.00 0.00 61.00 62.90 1n5n s PRO 119 Cb -0.19 -3.25 -0.02 0.00 0.04 0.00 0.00 34.50 31.09 1n5n s PRO 119 CO 0.18 0.29 0.32 -0.59 0.04 0.00 0.00 177.00 177.24 1n5n s PHE 120 N -0.91 0.65 0.33 0.56 -0.71 0.39 -4.91 117.98 113.38 1n5n s PHE 120 Ca 0.44 -0.97 0.05 0.00 -1.04 0.00 0.00 56.93 55.42 1n5n s PHE 120 Cb -0.29 -0.11 -0.07 0.00 -1.21 0.00 0.00 43.02 41.34 1n5n s PHE 120 CO 0.36 -0.83 0.01 -1.83 -1.34 0.00 0.00 175.22 171.60 1n5n s GLU 121 N -4.06 1.68 -0.28 1.99 -1.05 -1.26 -1.75 118.70 113.97 1n5n s GLU 121 Ca 0.28 -1.91 -0.20 0.00 -0.15 0.00 0.00 54.97 52.98 1n5n s GLU 121 Cb 0.03 -1.11 0.10 0.00 -0.44 0.00 0.00 34.13 32.71 1n5n s GLU 121 CO 0.09 -0.09 0.83 -2.00 0.95 0.00 0.00 175.26 175.04 1n5n s GLU 122 N -3.80 0.62 0.08 -4.83 2.12 0.27 -4.97 118.70 108.19 1n5n s GLU 122 Ca 0.34 0.92 -0.25 0.00 0.36 0.00 0.00 54.97 56.35 1n5n s GLU 122 Cb 0.07 0.21 -0.06 0.00 0.26 0.00 0.00 34.13 34.61 1n5n s GLU 122 CO 0.15 -0.11 0.76 0.08 -0.54 0.00 0.00 175.26 175.60 1n5n s VAL 123 N 1.02 4.63 -0.03 3.70 1.01 -1.26 -0.28 120.40 129.18 1n5n s VAL 123 Ca -0.05 1.63 0.05 0.00 0.00 0.00 0.00 61.98 63.62 1n5n s VAL 123 Cb -0.05 -4.11 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 1n5n s VAL 123 CO -0.11 0.42 -0.18 0.00 0.00 0.00 0.00 175.10 175.22 1n5n s ALA 124 N -0.41 1.57 0.33 5.51 0.00 0.10 -4.94 121.76 123.93 1n5n s ALA 124 Ca 0.37 -0.78 0.04 0.00 0.00 0.00 0.00 51.96 51.59 1n5n s ALA 124 Cb -0.21 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 1n5n s ALA 124 CO 0.24 0.35 0.14 0.39 0.00 0.00 0.00 175.76 176.88 1n5n n GLU 125 N 2.81 0.58 0.00 0.00 1.02 -1.26 -0.96 120.64 122.84 1n5n n GLU 125 Ca -0.16 -2.83 0.00 0.00 -0.02 0.00 0.00 57.16 54.15 1n5n n GLU 125 Cb 0.53 1.68 0.00 0.00 -0.02 0.00 0.00 31.44 33.63 1n5n n GLU 125 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1n5n n GLY 126 N -0.31 1.92 0.21 0.62 0.00 -1.26 -1.90 105.19 104.47 1n5n n GLY 126 Ca -0.03 -0.49 0.03 0.00 0.00 0.00 0.00 46.02 45.54 1n5n n GLY 126 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1n5n h LEU 127 N 0.00 0.03 -0.42 0.99 6.46 -1.98 -2.05 115.31 118.33 1n5n h LEU 127 Ca 0.00 -0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.72 1n5n h LEU 127 Cb 0.00 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 39.90 1n5n h LEU 127 CO 0.00 0.31 0.13 0.25 -0.62 0.00 0.00 178.44 178.51 1n5n h LEU 128 N 0.03 0.61 -0.64 2.25 5.85 -1.85 0.52 115.31 122.07 1n5n h LEU 128 Ca 0.00 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.52 1n5n h LEU 128 Cb 0.51 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1n5n h LEU 128 CO 0.04 0.66 0.41 0.00 -0.34 0.00 0.00 178.44 179.21 1n5n h ALA 129 N 0.98 0.82 -0.47 1.25 0.00 -0.91 0.17 119.26 121.10 1n5n h ALA 129 Ca 0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1n5n h ALA 129 Cb 0.27 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1n5n h ALA 129 CO -0.00 0.27 0.26 0.28 0.00 0.00 0.00 179.25 180.06 1n5n h VAL 130 N 0.87 1.16 -0.07 0.00 2.07 -1.08 -2.89 116.25 116.32 1n5n h VAL 130 Ca 0.23 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 1n5n h VAL 130 Cb -0.07 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1n5n h VAL 130 CO -0.05 0.17 -0.03 0.00 0.02 0.00 0.00 177.57 177.68 1n5n h ILE 132 N -0.22 1.10 -0.06 0.00 6.09 -1.02 0.17 117.51 123.56 1n5n h ILE 132 Ca 0.02 -0.25 -0.03 0.00 -1.37 0.00 0.00 64.86 63.23 1n5n h ILE 132 Cb 0.46 0.72 -0.00 0.00 0.47 0.00 0.00 36.82 38.47 1n5n h ILE 132 CO 0.01 0.10 -0.09 1.56 -3.07 0.00 0.00 178.15 176.66 1n5n h GLN 133 N 0.39 0.17 -0.31 2.19 4.20 -1.26 -0.23 115.11 120.26 1n5n h GLN 133 Ca 0.10 -0.10 0.05 0.00 0.06 0.00 0.00 58.65 58.77 1n5n h GLN 133 Cb 0.02 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.76 1n5n h GLN 133 CO -0.02 0.66 -0.01 1.25 -0.67 0.00 0.00 178.83 180.04 1n5n h HIS 134 N -0.30 -0.04 -0.28 2.96 2.76 -0.52 0.34 115.15 120.06 1n5n h HIS 134 Ca 0.01 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.07 1n5n h HIS 134 Cb 0.64 0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.65 1n5n h HIS 134 CO 0.10 -0.06 -0.35 0.93 -1.30 0.00 0.00 177.93 177.25 1n5n h GLU 135 N 0.08 0.63 -0.76 5.26 4.39 -0.63 -2.66 114.58 120.89 1n5n h GLU 135 Ca 0.15 -0.30 -0.05 0.00 0.34 0.00 0.00 59.36 59.50 1n5n h GLU 135 Cb 0.20 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.81 1n5n h GLU 135 CO -0.26 0.89 0.28 0.00 -1.16 0.00 0.00 179.01 178.76 1n5n h ASP 137 N 1.12 0.82 -0.76 0.00 3.32 -0.69 -0.82 116.42 119.41 1n5n h ASP 137 Ca 0.25 0.04 0.07 0.00 0.02 0.00 0.00 57.03 57.41 1n5n h ASP 137 Cb 0.25 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.61 1n5n h ASP 137 CO -0.02 0.45 0.43 0.45 -1.72 0.00 0.00 179.24 178.84 1n5n h HIS 138 N 0.89 0.79 0.00 4.55 3.86 -0.94 0.23 115.15 124.53 1n5n h HIS 138 Ca 0.46 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.69 1n5n h HIS 138 Cb 0.51 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.73 1n5n h HIS 138 CO -0.00 0.35 0.00 -0.07 0.86 0.00 0.00 177.93 179.07 1n5n h LEU 139 N 0.76 0.00 -3.16 2.43 3.38 -0.90 -0.78 115.31 117.04 1n5n h LEU 139 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1n5n h LEU 139 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1n5n h LEU 139 CO -0.21 0.00 0.00 0.59 0.09 0.00 0.00 178.44 178.91 1n5n n ASN 140 N -2.69 4.55 -0.42 -0.43 3.02 0.56 -0.21 115.26 119.64 1n5n n ASN 140 Ca -0.01 -2.51 -0.05 0.00 -0.03 0.00 0.00 54.58 51.99 1n5n n ASN 140 Cb 0.15 -0.55 -0.02 0.00 -0.61 0.00 0.00 39.78 38.76 1n5n n ASN 140 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1n5n n GLY 141 N 0.83 0.69 3.66 7.41 0.00 -0.30 -4.79 105.19 112.69 1n5n n GLY 141 Ca 0.24 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 1n5n n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n5n s LYS 142 N -2.68 2.42 0.18 1.61 1.02 0.15 -4.52 119.74 117.91 1n5n s LYS 142 Ca 0.00 -0.98 0.08 0.00 0.02 0.00 0.00 55.97 55.10 1n5n s LYS 142 Cb 0.00 -2.43 -0.04 0.00 -0.52 0.00 0.00 37.83 34.84 1n5n s LYS 142 CO 0.00 0.50 -0.17 -0.51 -0.92 0.00 0.00 175.35 174.25 1n5n s LEU 143 N -2.55 2.47 0.33 3.17 1.43 -1.26 -3.11 118.68 119.16 1n5n s LEU 143 Ca 0.26 -0.90 0.26 0.00 -1.03 0.00 0.00 54.13 52.71 1n5n s LEU 143 Cb -0.11 -0.77 1.10 0.00 0.03 0.00 0.00 46.19 46.44 1n5n s LEU 143 CO 0.18 -0.08 1.78 2.19 0.23 0.00 0.00 176.35 180.65 1n5n h PHE 144 N 3.06 0.00 0.00 0.29 -5.15 -1.96 0.45 116.94 113.63 1n5n h PHE 144 Ca -0.41 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.36 1n5n h PHE 144 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.38 1n5n h PHE 144 CO 0.69 0.00 0.00 -0.39 -2.00 0.00 0.00 178.31 176.61 1n5n h VAL 145 N 0.00 0.00 0.00 0.88 -1.51 -1.97 -2.22 116.25 111.44 1n5n h VAL 145 Ca 0.00 -0.35 -0.01 0.00 -1.23 0.00 0.00 66.70 65.12 1n5n h VAL 145 Cb 0.37 1.18 -0.00 0.00 -2.13 0.00 0.00 31.29 30.71 1n5n h VAL 145 CO 0.00 0.00 -0.04 0.44 -1.23 0.00 0.00 177.57 176.74 1n5n h ASP 146 N 0.00 0.00 0.74 4.19 3.32 -1.31 -2.08 116.42 121.28 1n5n h ASP 146 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1n5n h ASP 146 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1n5n h ASP 146 CO 0.00 0.04 -0.15 -1.22 -1.72 0.00 0.00 179.24 176.19 1n5n n TYR 147 N -3.25 0.00 -2.50 4.55 4.01 -0.83 -4.95 117.16 114.19 1n5n n TYR 147 Ca -0.01 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.50 1n5n n TYR 147 Cb 0.21 -0.37 0.06 0.00 -0.31 0.00 0.00 39.34 38.92 1n5n n TYR 147 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1n5n s LEU 148 N -2.89 3.10 0.84 7.72 1.43 -0.78 -5.03 118.68 123.06 1n5n s LEU 148 Ca 0.16 0.08 -0.13 0.00 -1.03 0.00 0.00 54.13 53.22 1n5n s LEU 148 Cb 0.19 -2.82 0.06 0.00 0.03 0.00 0.00 46.19 43.64 1n5n s LEU 148 CO 0.56 -1.38 0.89 -1.54 0.23 0.00 0.00 176.35 175.11 1n5n n SER 149 N -2.59 -0.19 0.20 2.29 3.41 -1.26 -4.74 113.62 110.74 1n5n n SER 149 Ca 0.09 0.50 0.07 0.00 -0.26 0.00 0.00 58.87 59.28 1n5n n SER 149 Cb 0.60 -1.38 0.34 0.00 -0.26 0.00 0.00 64.21 63.51 1n5n n SER 149 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n5n h THR 150 N -1.10 0.71 0.01 6.66 1.03 -1.96 -1.91 112.91 116.35 1n5n h THR 150 Ca -0.45 -1.43 -0.21 0.00 -0.01 0.00 0.00 66.41 64.32 1n5n h THR 150 Cb 1.30 1.92 -0.01 0.00 -1.07 0.00 0.00 68.15 70.30 1n5n h THR 150 CO 0.42 0.31 -0.91 -0.07 -0.01 0.00 0.00 175.52 175.26 1n5n h LEU 151 N 0.00 0.31 -0.21 0.00 3.38 -2.00 -1.47 115.31 115.32 1n5n h LEU 151 Ca -0.00 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1n5n h LEU 151 Cb 0.90 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1n5n h LEU 151 CO 0.04 1.07 0.01 0.50 0.09 0.00 0.00 178.44 180.15 1n5n h LYS 152 N 0.13 0.37 -0.89 1.13 3.64 -1.84 -1.96 116.57 117.15 1n5n h LYS 152 Ca -0.05 -0.11 0.09 0.00 -1.27 0.00 0.00 60.65 59.30 1n5n h LYS 152 Cb 1.55 -0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 33.26 1n5n h LYS 152 CO 0.14 0.55 0.54 -0.09 -2.27 0.00 0.00 179.45 178.33 1n5n h ARG 153 N 0.14 0.91 -0.21 1.90 2.43 -1.31 0.11 114.38 118.34 1n5n h ARG 153 Ca 0.06 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.08 1n5n h ARG 153 Cb 0.38 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1n5n h ARG 153 CO 0.01 0.60 -0.31 0.22 -1.51 0.00 0.00 179.97 178.98 1n5n h ASP 154 N 0.93 0.43 -0.23 -3.80 -0.00 -1.06 0.72 116.42 113.41 1n5n h ASP 154 Ca 0.41 -0.16 -0.06 0.00 -0.00 0.00 0.00 57.03 57.23 1n5n h ASP 154 Cb 0.30 -0.12 -0.01 0.00 -0.00 0.00 0.00 39.33 39.51 1n5n h ASP 154 CO -0.22 0.72 -0.07 0.08 -0.00 0.00 0.00 179.24 179.75 1n5n h ARG 155 N 0.37 0.46 -0.43 0.28 0.11 -0.59 0.42 114.38 115.00 1n5n h ARG 155 Ca 0.05 -0.18 -0.03 0.00 0.10 0.00 0.00 59.98 59.92 1n5n h ARG 155 Cb 0.72 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 31.76 1n5n h ARG 155 CO 0.06 0.70 0.16 0.82 0.10 0.00 0.00 179.97 181.81 1n5n h ILE 156 N 0.19 1.20 -0.41 0.08 2.04 -0.45 0.31 117.51 120.48 1n5n h ILE 156 Ca 0.06 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.28 1n5n h ILE 156 Cb 0.54 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 1n5n h ILE 156 CO 0.03 0.23 0.27 -0.09 0.00 0.00 0.00 178.15 178.58 1n5n h ARG 157 N 0.54 0.55 -0.37 2.37 2.43 0.70 -1.33 114.38 119.28 1n5n h ARG 157 Ca 0.14 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 1n5n h ARG 157 Cb 0.20 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1n5n h ARG 157 CO -0.01 0.38 -0.01 0.87 -1.51 0.00 0.00 179.97 179.69 1n5n h LYS 158 N 0.56 0.58 -0.53 0.20 1.57 0.21 0.38 116.57 119.53 1n5n h LYS 158 Ca 0.15 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1n5n h LYS 158 Cb -0.05 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 1n5n h LYS 158 CO -0.03 0.61 0.20 0.87 -0.57 0.00 0.00 179.45 180.53 1n5n h LYS 159 N 0.55 0.80 -0.19 3.15 1.57 -0.61 -1.45 116.57 120.40 1n5n h LYS 159 Ca 0.12 -0.15 -0.15 0.00 -1.87 0.00 0.00 60.65 58.59 1n5n h LYS 159 Cb 0.36 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1n5n h LYS 159 CO 0.01 0.71 -0.53 -0.07 -0.57 0.00 0.00 179.45 179.01 1n5n h LEU 160 N 0.72 0.59 -0.95 2.94 3.38 -0.86 -1.48 115.31 119.65 1n5n h LEU 160 Ca 0.18 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1n5n h LEU 160 Cb 0.21 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1n5n h LEU 160 CO -0.01 1.00 0.26 -0.33 0.09 0.00 0.00 178.44 179.46 1n5n h GLU 161 N 0.42 1.02 -0.00 1.13 5.08 -0.74 0.26 114.58 121.75 1n5n h GLU 161 Ca 0.01 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1n5n h GLU 161 Cb 1.06 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 1n5n h GLU 161 CO 0.10 0.84 0.00 -0.22 -1.00 0.00 0.00 179.01 178.73 1n5n h LYS 162 N 1.00 0.00 -0.95 2.33 3.64 -1.02 -1.03 116.57 120.55 1n5n h LYS 162 Ca 0.23 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.62 1n5n h LYS 162 Cb 0.21 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.98 1n5n h LYS 162 CO -0.02 0.13 0.63 1.96 -2.27 0.00 0.00 179.45 179.89 1n5n h GLN 163 N -0.13 1.26 -0.36 1.90 4.20 -0.66 -0.44 115.11 120.88 1n5n h GLN 163 Ca 0.00 -0.08 -0.10 0.00 0.06 0.00 0.00 58.65 58.53 1n5n h GLN 163 Cb 0.13 -0.28 -0.02 0.00 0.30 0.00 0.00 27.48 27.61 1n5n h GLN 163 CO -0.00 0.83 -0.19 0.45 -0.67 0.00 0.00 178.83 179.25 1n5n h HIS 164 N 1.29 0.75 -0.10 2.96 3.86 0.04 -1.41 115.15 122.54 1n5n h HIS 164 Ca 0.35 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.41 1n5n h HIS 164 Cb -0.15 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.13 1n5n h HIS 164 CO 0.00 0.82 0.06 0.00 0.86 0.00 0.00 177.93 179.67 1n5n h ARG 165 N 0.60 0.13 0.00 2.45 3.08 -0.08 -2.70 114.38 117.86 1n5n h ARG 165 Ca 0.09 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1n5n h ARG 165 Cb 0.66 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1n5n h ARG 165 CO 0.05 0.11 0.00 1.96 -1.07 0.00 0.00 179.97 181.02 1n5n h GLN 166 N 0.11 0.00 -0.02 0.04 4.20 -0.83 -3.51 115.11 115.10 1n5n h GLN 166 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1n5n h GLN 166 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1n5n h GLN 166 CO -0.01 0.00 0.00 1.04 -0.67 0.00 0.00 178.83 179.19