#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s6v n THR 2 N 0.00 1.98 -0.73 1.09 -1.04 -1.26 -5.09 114.28 109.23 1s6v n THR 2 Ca 0.00 -5.09 -0.28 0.00 -2.04 0.00 0.00 64.05 56.64 1s6v n THR 2 Cb 0.00 -0.95 -0.04 0.00 -1.82 0.00 0.00 70.33 67.52 1s6v n THR 2 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1s6v n PRO 3 N -0.12 0.00 -2.42 -2.82 -0.02 -1.26 -4.90 135.00 123.46 1s6v n PRO 3 Ca 0.29 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.35 1s6v n PRO 3 Cb 0.52 -0.66 -0.03 0.00 -0.02 0.00 0.00 33.50 33.32 1s6v n PRO 3 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1s6v s LEU 4 N 0.83 4.35 -0.12 2.45 2.96 -1.26 -5.02 118.68 122.86 1s6v s LEU 4 Ca 0.44 1.97 0.02 0.00 -0.22 0.00 0.00 54.13 56.33 1s6v s LEU 4 Cb -0.62 -3.57 0.02 0.00 0.50 0.00 0.00 46.19 42.51 1s6v s LEU 4 CO 0.32 -0.51 -0.16 -0.69 -1.32 0.00 0.00 176.35 173.99 1s6v s VAL 5 N 1.42 1.63 -0.41 1.68 1.01 -1.26 -4.83 120.40 119.64 1s6v s VAL 5 Ca 0.58 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.77 1s6v s VAL 5 Cb -0.28 -1.49 0.07 0.00 0.00 0.00 0.00 36.38 34.68 1s6v s VAL 5 CO 0.27 0.47 0.23 -1.00 0.00 0.00 0.00 175.10 175.07 1s6v s HIS 6 N 1.08 3.34 -0.06 5.22 3.76 -1.26 -5.04 115.29 122.33 1s6v s HIS 6 Ca -0.04 -1.56 -0.18 0.00 -0.15 0.00 0.00 55.06 53.13 1s6v s HIS 6 Cb -0.14 -2.86 -0.05 0.00 1.11 0.00 0.00 32.58 30.63 1s6v s HIS 6 CO -0.04 -0.83 0.50 0.08 -0.85 0.00 0.00 174.74 173.59 1s6v s VAL 7 N 1.41 5.07 0.14 -0.90 1.01 -1.26 -0.18 120.40 125.69 1s6v s VAL 7 Ca 0.03 1.02 -0.30 0.00 0.00 0.00 0.00 61.98 62.72 1s6v s VAL 7 Cb -0.22 -3.83 -0.08 0.00 0.00 0.00 0.00 36.38 32.25 1s6v s VAL 7 CO 0.02 0.40 1.27 0.00 0.00 0.00 0.00 175.10 176.80 1s6v s ALA 8 N 0.04 3.49 -0.24 5.51 0.00 -0.20 -4.85 121.76 125.50 1s6v s ALA 8 Ca 0.27 1.01 -0.02 0.00 0.00 0.00 0.00 51.96 53.22 1s6v s ALA 8 Cb -0.16 -3.47 0.08 0.00 0.00 0.00 0.00 23.12 19.56 1s6v s ALA 8 CO 0.13 -0.49 0.05 0.45 0.00 0.00 0.00 175.76 175.90 1s6v s SER 9 N 0.64 3.47 0.34 0.00 0.15 0.25 -4.69 113.70 113.86 1s6v s SER 9 Ca 0.58 -1.18 -0.29 0.00 0.70 0.00 0.00 55.95 55.76 1s6v s SER 9 Cb -0.34 -0.77 -0.11 0.00 -1.71 0.00 0.00 66.02 63.09 1s6v s SER 9 CO 0.34 -0.34 1.55 -0.69 1.20 0.00 0.00 173.24 175.29 1s6v s VAL 10 N 1.71 2.04 -0.22 4.45 1.01 -1.26 -4.24 120.40 123.89 1s6v s VAL 10 Ca 0.02 0.03 -0.40 0.00 0.00 0.00 0.00 61.98 61.64 1s6v s VAL 10 Cb -0.17 -3.02 -0.16 0.00 0.00 0.00 0.00 36.38 33.02 1s6v s VAL 10 CO -0.15 0.01 1.67 -0.62 0.00 0.00 0.00 175.10 176.01 1s6v n GLU 11 N 1.30 1.11 -1.61 2.72 4.71 -1.26 -4.71 120.64 122.89 1s6v n GLU 11 Ca 0.05 0.41 -0.60 0.00 -0.01 0.00 0.00 57.16 57.01 1s6v n GLU 11 Cb 0.38 -2.07 -0.08 0.00 -1.01 0.00 0.00 31.44 28.66 1s6v n GLU 11 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1s6v n LYS 12 N 4.82 0.40 -0.88 3.49 4.01 -1.26 -1.19 118.16 127.56 1s6v n LYS 12 Ca 0.25 0.15 0.00 0.00 -0.51 0.00 0.00 58.31 58.20 1s6v n LYS 12 Cb 0.13 -1.70 0.00 0.00 -0.51 0.00 0.00 35.03 32.95 1s6v n LYS 12 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1s6v n GLY 13 N 2.71 0.55 3.87 0.72 0.00 -1.26 -5.01 105.19 106.76 1s6v n GLY 13 Ca 0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.88 1s6v n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s6v s ARG 14 N -0.46 3.58 0.10 1.61 1.81 -0.33 -5.08 118.95 120.18 1s6v s ARG 14 Ca 0.00 0.02 0.01 0.00 -1.72 0.00 0.00 55.73 54.04 1s6v s ARG 14 Cb 0.00 -3.18 -0.00 0.00 -0.45 0.00 0.00 34.95 31.31 1s6v s ARG 14 CO 0.00 0.74 0.04 -1.13 -0.68 0.00 0.00 175.30 174.26 1s6v n SER 15 N 1.80 1.06 -0.26 0.23 3.41 -1.26 -4.83 113.62 113.77 1s6v n SER 15 Ca -0.17 -1.54 0.04 0.00 -0.26 0.00 0.00 58.87 56.94 1s6v n SER 15 Cb 0.54 0.25 0.14 0.00 -0.26 0.00 0.00 64.21 64.88 1s6v n SER 15 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1s6v h TYR 16 N 1.17 -0.17 -0.74 7.33 3.20 -2.00 -0.90 116.97 124.86 1s6v h TYR 16 Ca -0.08 0.06 0.05 0.00 3.14 0.00 0.00 58.73 61.90 1s6v h TYR 16 Cb 0.30 0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.72 1s6v h TYR 16 CO 0.00 -0.28 0.49 0.93 -1.64 0.00 0.00 178.16 177.66 1s6v h GLU 17 N 0.06 0.83 -0.24 1.82 3.07 -1.98 -0.49 114.58 117.65 1s6v h GLU 17 Ca 0.40 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.20 1s6v h GLU 17 Cb 0.69 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 1s6v h GLU 17 CO -0.71 0.55 0.09 -0.44 -1.40 0.00 0.00 179.01 177.10 1s6v h ASP 18 N 0.85 0.33 0.44 1.42 3.32 -1.56 -1.86 116.42 119.37 1s6v h ASP 18 Ca 0.31 -0.18 -0.12 0.00 0.02 0.00 0.00 57.03 57.06 1s6v h ASP 18 Cb 0.14 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1s6v h ASP 18 CO -0.10 0.42 -0.53 -0.26 -1.72 0.00 0.00 179.24 177.05 1s6v h PHE 19 N 0.22 0.12 -0.04 4.55 -1.00 -1.27 -2.24 116.94 117.30 1s6v h PHE 19 Ca 0.08 -0.04 -0.03 0.00 2.81 0.00 0.00 57.97 60.78 1s6v h PHE 19 Cb 0.19 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.72 1s6v h PHE 19 CO -0.01 0.60 -0.14 0.37 -1.61 0.00 0.00 178.31 177.53 1s6v h GLN 20 N 0.08 0.05 -0.25 1.51 5.75 -0.84 0.14 115.11 121.55 1s6v h GLN 20 Ca -0.00 -0.01 -0.14 0.00 -0.15 0.00 0.00 58.65 58.35 1s6v h GLN 20 Cb 0.96 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.50 1s6v h GLN 20 CO 0.07 0.19 -0.38 0.87 -2.65 0.00 0.00 178.83 176.94 1s6v h LYS 21 N 0.05 0.70 -0.54 1.69 1.57 -0.73 -0.90 116.57 118.40 1s6v h LYS 21 Ca 0.01 -0.42 -0.02 0.00 -1.87 0.00 0.00 60.65 58.36 1s6v h LYS 21 Cb 0.28 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1s6v h LYS 21 CO 0.02 1.03 0.27 0.28 -0.57 0.00 0.00 179.45 180.49 1s6v h VAL 22 N 0.42 1.19 -0.35 0.50 2.07 -1.16 -1.55 116.25 117.37 1s6v h VAL 22 Ca 0.02 -0.53 0.06 0.00 0.82 0.00 0.00 66.70 67.07 1s6v h VAL 22 Cb 0.97 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 1s6v h VAL 22 CO 0.09 0.22 0.00 0.22 0.02 0.00 0.00 177.57 178.11 1s6v h TYR 23 N 0.73 -0.02 -0.39 1.57 3.20 -0.90 -1.15 116.97 120.01 1s6v h TYR 23 Ca 0.19 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 1s6v h TYR 23 Cb 0.09 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1s6v h TYR 23 CO -0.01 -0.06 0.10 -0.91 -1.64 0.00 0.00 178.16 175.64 1s6v h ASN 24 N 0.10 0.52 -0.42 -2.11 4.21 -0.76 0.98 115.58 118.11 1s6v h ASN 24 Ca 0.17 -0.07 -0.15 0.00 1.21 0.00 0.00 56.30 57.46 1s6v h ASN 24 Cb 0.24 -0.13 -0.01 0.00 -1.12 0.00 0.00 38.32 37.29 1s6v h ASN 24 CO -0.29 0.52 -0.34 0.00 -1.29 0.00 0.00 177.43 176.04 1s6v h ALA 25 N 1.55 0.60 -0.26 -0.83 0.00 -0.74 0.98 119.26 120.56 1s6v h ALA 25 Ca 0.13 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 1s6v h ALA 25 Cb 0.21 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1s6v h ALA 25 CO -0.00 0.68 -0.04 0.82 0.00 0.00 0.00 179.25 180.70 1s6v h ILE 26 N 0.80 1.27 -0.70 0.00 2.04 -0.71 -1.65 117.51 118.57 1s6v h ILE 26 Ca 0.08 -1.02 0.02 0.00 1.00 0.00 0.00 64.86 64.94 1s6v h ILE 26 Cb 0.93 1.42 -0.04 0.00 -0.74 0.00 0.00 36.82 38.39 1s6v h ILE 26 CO 0.09 0.32 0.44 0.00 0.00 0.00 0.00 178.15 179.00 1s6v h ALA 27 N 0.78 0.90 -0.29 1.87 0.00 -0.68 0.04 119.26 121.90 1s6v h ALA 27 Ca 0.07 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1s6v h ALA 27 Cb 0.49 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1s6v h ALA 27 CO 0.02 0.24 0.05 -0.07 0.00 0.00 0.00 179.25 179.49 1s6v h LEU 28 N 0.88 0.45 -1.34 0.00 3.38 -0.77 -2.72 115.31 115.19 1s6v h LEU 28 Ca 0.27 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1s6v h LEU 28 Cb -0.02 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1s6v h LEU 28 CO -0.09 0.58 0.28 0.50 0.09 0.00 0.00 178.44 179.80 1s6v h LYS 29 N 0.29 0.73 -0.80 1.13 3.64 -0.83 0.25 116.57 120.99 1s6v h LYS 29 Ca 0.09 -0.08 0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1s6v h LYS 29 Cb 0.32 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.95 1s6v h LYS 29 CO 0.00 0.55 0.53 -0.07 -2.27 0.00 0.00 179.45 178.19 1s6v h LEU 30 N 0.74 0.86 -0.02 5.20 3.38 -0.70 -0.16 115.31 124.61 1s6v h LEU 30 Ca 0.19 -0.01 -0.26 0.00 0.09 0.00 0.00 57.88 57.88 1s6v h LEU 30 Cb 0.03 -0.20 0.02 0.00 0.09 0.00 0.00 40.66 40.60 1s6v h LEU 30 CO -0.03 0.60 -1.06 0.03 0.09 0.00 0.00 178.44 178.07 1s6v h ARG 31 N 1.00 0.63 -0.10 1.13 3.08 -0.94 -3.36 114.38 115.82 1s6v h ARG 31 Ca 0.31 -0.70 -0.11 0.00 0.07 0.00 0.00 59.98 59.56 1s6v h ARG 31 Cb 0.01 0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1s6v h ARG 31 CO -0.09 1.29 -0.35 0.93 -1.07 0.00 0.00 179.97 180.68 1s6v h GLU 32 N 0.34 0.41 -2.66 0.04 4.39 -0.55 -3.33 114.58 113.22 1s6v h GLU 32 Ca -0.13 -0.31 -0.80 0.00 0.34 0.00 0.00 59.36 58.46 1s6v h GLU 32 Cb 1.71 0.06 -0.25 0.00 -0.10 0.00 0.00 28.75 30.17 1s6v h GLU 32 CO 0.20 0.94 1.17 -0.25 -1.16 0.00 0.00 179.01 179.91 1s6v n ASP 33 N -4.38 6.88 -0.14 1.42 8.00 -0.11 -4.73 116.55 123.49 1s6v n ASP 33 Ca -0.08 -3.48 0.14 0.00 0.71 0.00 0.00 54.79 52.08 1s6v n ASP 33 Cb 0.51 -1.26 0.49 0.00 -0.02 0.00 0.00 41.12 40.85 1s6v n ASP 33 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1s6v n ASP 34 N 1.00 0.65 0.23 -2.24 5.75 -1.25 -4.10 116.55 116.59 1s6v n ASP 34 Ca 0.40 -0.60 0.13 0.00 -0.01 0.00 0.00 54.79 54.71 1s6v n ASP 34 Cb 0.29 0.01 0.33 0.00 -1.03 0.00 0.00 41.12 40.73 1s6v n ASP 34 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1s6v h GLU 35 N 0.71 0.00 -6.25 0.11 5.08 -1.90 -3.30 114.58 109.02 1s6v h GLU 35 Ca 0.00 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.68 1s6v h GLU 35 Cb 0.43 0.00 0.07 0.00 0.50 0.00 0.00 28.75 29.75 1s6v h GLU 35 CO 0.00 0.03 0.23 0.98 -1.00 0.00 0.00 179.01 179.25 1s6v n TYR 36 N -3.11 1.14 -3.50 4.33 9.36 -1.26 -1.72 117.16 122.40 1s6v n TYR 36 Ca 0.03 0.74 -0.24 0.00 3.32 0.00 0.00 57.90 61.75 1s6v n TYR 36 Cb 0.47 -2.24 0.05 0.00 -0.63 0.00 0.00 39.34 36.99 1s6v n TYR 36 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1s6v n ASP 37 N 2.06 -5.93 -3.94 2.98 4.64 -1.26 -1.44 116.55 113.66 1s6v n ASP 37 Ca 0.17 -0.88 -0.26 0.00 -1.38 0.00 0.00 54.79 52.44 1s6v n ASP 37 Cb 0.21 -4.15 -0.02 0.00 -1.04 0.00 0.00 41.12 36.12 1s6v n ASP 37 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 1s6v n ASN 38 N -2.88 -0.77 -0.83 1.67 3.02 -1.18 -2.18 115.26 112.10 1s6v n ASN 38 Ca -0.08 -1.02 -0.11 0.00 -0.03 0.00 0.00 54.58 53.34 1s6v n ASN 38 Cb 0.60 -3.01 -0.05 0.00 -0.61 0.00 0.00 39.78 36.71 1s6v n ASN 38 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1s6v n TYR 39 N -4.40 0.00 0.12 3.10 4.02 -0.70 -4.87 117.16 114.43 1s6v n TYR 39 Ca -0.29 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.58 1s6v n TYR 39 Cb 0.68 -2.31 0.11 0.00 -0.02 0.00 0.00 39.34 37.80 1s6v n TYR 39 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 1s6v h ILE 40 N 0.00 1.50 0.00 -0.72 2.04 -1.02 -3.47 117.51 115.83 1s6v h ILE 40 Ca -0.22 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.23 1s6v h ILE 40 Cb 0.91 2.30 0.00 0.00 -0.74 0.00 0.00 36.82 39.29 1s6v h ILE 40 CO 0.32 0.69 0.00 0.61 0.00 0.00 0.00 178.15 179.77 1s6v n GLY 41 N 0.51 -0.98 0.16 5.37 0.00 -0.52 -4.58 105.19 105.15 1s6v n GLY 41 Ca -0.01 -1.66 0.15 0.00 0.00 0.00 0.00 46.02 44.51 1s6v n GLY 41 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1s6v n TYR 42 N -1.07 0.00 0.01 1.61 4.02 -1.26 -4.37 117.16 116.10 1s6v n TYR 42 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.79 1s6v n TYR 42 Cb 0.00 -0.02 -0.04 0.00 -0.02 0.00 0.00 39.34 39.26 1s6v n TYR 42 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1s6v h GLY 43 N 4.95 -0.32 0.95 2.72 0.00 -1.93 -2.11 103.07 107.34 1s6v h GLY 43 Ca 0.00 0.32 0.01 0.00 0.00 0.00 0.00 47.33 47.66 1s6v h GLY 43 CO 0.00 -0.21 0.30 -2.55 0.00 0.00 0.00 176.54 174.08 1s6v h PRO 44 N -0.34 0.58 0.00 4.80 0.11 -1.87 -2.41 132.00 132.87 1s6v h PRO 44 Ca 0.09 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.14 1s6v h PRO 44 Cb 0.48 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.46 1s6v h PRO 44 CO -0.31 0.39 -0.15 -0.24 -0.21 0.00 0.00 178.00 177.48 1s6v h VAL 45 N 0.60 0.97 -0.26 3.15 3.04 -1.80 -0.09 116.25 121.87 1s6v h VAL 45 Ca 0.18 -0.53 -0.14 0.00 -1.01 0.00 0.00 66.70 65.20 1s6v h VAL 45 Cb -0.03 1.30 -0.01 0.00 -2.01 0.00 0.00 31.29 30.54 1s6v h VAL 45 CO -0.06 0.15 -0.40 -0.07 -1.01 0.00 0.00 177.57 176.17 1s6v h LEU 46 N 0.00 0.65 -0.35 3.16 3.38 -0.92 0.14 115.31 121.37 1s6v h LEU 46 Ca -0.00 -0.29 -0.17 0.00 0.09 0.00 0.00 57.88 57.51 1s6v h LEU 46 Cb 0.29 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1s6v h LEU 46 CO 0.02 0.97 -0.46 0.58 0.09 0.00 0.00 178.44 179.65 1s6v h VAL 47 N 0.50 1.27 -0.46 1.22 2.07 -0.77 -1.16 116.25 118.92 1s6v h VAL 47 Ca 0.04 -1.63 -0.07 0.00 0.82 0.00 0.00 66.70 65.86 1s6v h VAL 47 Cb 0.92 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1s6v h VAL 47 CO 0.08 0.54 0.01 -0.09 0.02 0.00 0.00 177.57 178.13 1s6v h ARG 48 N 0.73 0.74 -0.42 1.57 2.43 -0.78 -1.55 114.38 117.11 1s6v h ARG 48 Ca 0.04 -0.19 -0.07 0.00 -0.81 0.00 0.00 59.98 58.96 1s6v h ARG 48 Cb 1.06 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.50 1s6v h ARG 48 CO 0.11 0.74 0.01 1.25 -1.51 0.00 0.00 179.97 180.57 1s6v h LEU 49 N 0.70 0.72 -0.75 3.80 5.85 -0.32 -1.00 115.31 124.30 1s6v h LEU 49 Ca 0.14 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 58.52 1s6v h LEU 49 Cb 0.41 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1s6v h LEU 49 CO 0.02 0.85 0.30 0.00 -0.34 0.00 0.00 178.44 179.26 1s6v h ALA 50 N 0.90 0.98 -0.26 1.25 0.00 -0.91 -1.20 119.26 120.01 1s6v h ALA 50 Ca 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1s6v h ALA 50 Cb 0.47 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1s6v h ALA 50 CO 0.02 0.60 0.14 2.35 0.00 0.00 0.00 179.25 182.36 1s6v h TRP 51 N 1.08 0.35 -0.02 0.00 -0.00 -1.08 -2.30 115.95 113.98 1s6v h TRP 51 Ca 0.25 -0.01 -0.11 0.00 -0.00 0.00 0.00 58.89 59.02 1s6v h TRP 51 Cb 0.21 -0.11 -0.01 0.00 -0.00 0.00 0.00 29.16 29.24 1s6v h TRP 51 CO 0.02 0.30 -0.52 0.45 -0.00 0.00 0.00 178.44 178.69 1s6v h HIS 52 N 0.30 0.08 0.00 2.65 3.86 -0.90 0.60 115.15 121.75 1s6v h HIS 52 Ca 0.09 -0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.23 1s6v h HIS 52 Cb 0.06 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 1s6v h HIS 52 CO -0.03 0.57 -0.20 1.79 0.86 0.00 0.00 177.93 180.91 1s6v h THR 53 N 0.05 0.38 0.00 2.45 1.35 -1.20 -3.21 112.91 112.72 1s6v h THR 53 Ca -0.00 -1.36 -0.33 0.00 -0.55 0.00 0.00 66.41 64.17 1s6v h THR 53 Cb 0.93 2.04 -0.06 0.00 -1.73 0.00 0.00 68.15 69.34 1s6v h THR 53 CO 0.07 0.20 -2.00 -1.20 -0.25 0.00 0.00 175.52 172.34 1s6v n SER 54 N -3.19 0.51 0.00 5.36 7.64 -0.87 -3.43 113.62 119.63 1s6v n SER 54 Ca 0.02 0.24 0.05 0.00 1.01 0.00 0.00 58.87 60.18 1s6v n SER 54 Cb 0.56 0.39 0.22 0.00 -1.01 0.00 0.00 64.21 64.37 1s6v n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1s6v n GLY 55 N 1.64 -0.66 0.00 0.23 0.00 0.21 -2.46 105.19 104.15 1s6v n GLY 55 Ca -0.24 -0.04 0.15 0.00 0.00 0.00 0.00 46.02 45.89 1s6v n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1s6v n THR 56 N -1.35 0.00 -1.76 2.61 -2.24 -1.25 -4.65 114.28 105.64 1s6v n THR 56 Ca 0.04 -0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.42 1s6v n THR 56 Cb 0.08 -0.49 0.02 0.00 -2.10 0.00 0.00 70.33 67.84 1s6v n THR 56 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 1s6v n TRP 57 N -1.35 2.67 -3.93 4.78 -0.00 -1.03 -4.08 117.44 114.50 1s6v n TRP 57 Ca 0.12 0.44 -0.30 0.00 -0.00 0.00 0.00 57.50 57.75 1s6v n TRP 57 Cb 0.27 -2.45 -0.15 0.00 -0.00 0.00 0.00 31.31 28.98 1s6v n TRP 57 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 1s6v s ASP 58 N -0.51 4.02 0.66 5.87 -1.08 -0.41 -4.70 116.67 120.51 1s6v s ASP 58 Ca 0.62 -1.38 0.41 0.00 -0.52 0.00 0.00 52.55 51.69 1s6v s ASP 58 Cb -0.45 -1.21 2.28 0.00 -1.46 0.00 0.00 42.92 42.08 1s6v s ASP 58 CO 0.57 -0.28 2.32 0.07 0.52 0.00 0.00 175.17 178.37 1s6v h LYS 59 N 7.92 0.00 0.00 4.34 2.10 -1.75 0.19 116.57 129.36 1s6v h LYS 59 Ca -0.15 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.39 1s6v h LYS 59 Cb 1.06 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.37 1s6v h LYS 59 CO 0.44 0.00 -0.50 0.45 -2.00 0.00 0.00 179.45 177.84 1s6v h HIS 60 N 0.00 0.00 0.00 0.07 3.86 -1.95 -3.34 115.15 113.79 1s6v h HIS 60 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1s6v h HIS 60 Cb 0.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.53 1s6v h HIS 60 CO 0.00 0.50 0.00 -0.40 0.86 0.00 0.00 177.93 178.89 1s6v n ASP 61 N -3.74 0.39 -2.87 2.45 5.68 -1.04 -5.03 116.55 112.40 1s6v n ASP 61 Ca -0.01 -1.16 -0.21 0.00 -0.50 0.00 0.00 54.79 52.92 1s6v n ASP 61 Cb 0.55 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.54 1s6v n ASP 61 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1s6v n ASN 62 N -0.08 -5.28 -4.93 -1.12 5.15 0.03 -4.44 115.26 104.59 1s6v n ASN 62 Ca 0.00 -0.18 -0.25 0.00 -0.60 0.00 0.00 54.58 53.55 1s6v n ASN 62 Cb 0.36 -4.34 -0.00 0.00 -0.53 0.00 0.00 39.78 35.27 1s6v n ASN 62 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1s6v s THR 63 N -3.02 4.88 0.00 -0.44 -4.23 -1.23 -4.89 115.64 106.71 1s6v s THR 63 Ca 0.21 -0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.55 1s6v s THR 63 Cb -0.10 -3.82 0.00 0.00 1.34 0.00 0.00 72.50 69.92 1s6v s THR 63 CO 0.26 -0.66 0.00 0.61 -0.54 0.00 0.00 174.62 174.29 1s6v n GLY 64 N -2.04 -0.72 0.00 3.99 0.00 -1.26 -1.29 105.19 103.88 1s6v n GLY 64 Ca -0.02 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1s6v n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s6v n GLY 65 N 0.00 0.34 0.25 -0.02 0.00 -1.26 -4.62 105.19 99.88 1s6v n GLY 65 Ca 0.00 -1.88 0.15 0.00 0.00 0.00 0.00 46.02 44.29 1s6v n GLY 65 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1s6v h SER 66 N 0.00 0.00 -0.41 1.61 4.64 -1.74 -3.39 113.55 114.27 1s6v h SER 66 Ca 0.00 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.40 1s6v h SER 66 Cb 0.00 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.00 1s6v h SER 66 CO 0.00 0.00 -0.30 0.22 -0.87 0.00 0.00 176.83 175.88 1s6v h TYR 67 N 0.00 -0.81 0.00 4.77 3.20 -1.85 -3.12 116.97 119.16 1s6v h TYR 67 Ca 0.00 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1s6v h TYR 67 Cb 0.72 0.42 0.00 0.00 1.54 0.00 0.00 36.73 39.41 1s6v h TYR 67 CO 0.00 -0.36 -0.01 0.41 -1.64 0.00 0.00 178.16 176.56 1s6v n GLY 68 N -1.41 -1.56 2.86 1.82 0.00 -1.26 -2.99 105.19 102.65 1s6v n GLY 68 Ca 0.02 -0.08 -0.20 0.00 0.00 0.00 0.00 46.02 45.76 1s6v n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s6v n GLY 69 N 1.44 -0.38 0.00 -0.02 0.00 -1.18 -2.14 105.19 102.91 1s6v n GLY 69 Ca 0.07 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.19 1s6v n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1s6v n THR 70 N -4.38 0.81 0.31 2.61 -2.24 -1.26 -2.69 114.28 107.43 1s6v n THR 70 Ca -0.10 0.20 0.20 0.00 -2.27 0.00 0.00 64.05 62.07 1s6v n THR 70 Cb 0.61 -0.92 0.95 0.00 -2.10 0.00 0.00 70.33 68.86 1s6v n THR 70 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1s6v h TYR 71 N 0.00 0.00 0.00 4.78 3.20 -1.93 -0.17 116.97 122.84 1s6v h TYR 71 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1s6v h TYR 71 Cb 0.25 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.52 1s6v h TYR 71 CO 0.00 0.01 0.00 2.89 -1.64 0.00 0.00 178.16 179.42 1s6v n ARG 72 N -3.14 0.17 -3.42 1.82 1.85 -1.10 -3.54 116.66 109.31 1s6v n ARG 72 Ca -0.01 0.45 -0.34 0.00 -1.00 0.00 0.00 57.85 56.94 1s6v n ARG 72 Cb 0.19 -1.86 -0.06 0.00 -1.05 0.00 0.00 32.46 29.69 1s6v n ARG 72 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1s6v s PHE 73 N -3.33 3.56 0.25 2.89 0.08 -0.08 -4.92 117.98 116.42 1s6v s PHE 73 Ca 0.03 0.96 -0.11 0.00 0.12 0.00 0.00 56.93 57.93 1s6v s PHE 73 Cb 0.09 -2.30 0.35 0.00 -0.57 0.00 0.00 43.02 40.59 1s6v s PHE 73 CO 0.34 0.41 1.59 -0.22 -0.10 0.00 0.00 175.22 177.24 1s6v h LYS 74 N 3.34 -0.01 -0.34 0.44 3.64 -1.86 0.07 116.57 121.85 1s6v h LYS 74 Ca -0.48 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 58.97 1s6v h LYS 74 Cb 1.19 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.94 1s6v h LYS 74 CO 0.67 -0.00 -0.14 -0.22 -2.27 0.00 0.00 179.45 177.49 1s6v h LYS 75 N -0.01 -0.07 0.10 1.90 3.64 -1.94 0.55 116.57 120.75 1s6v h LYS 75 Ca 0.39 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.51 1s6v h LYS 75 Cb 0.61 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1s6v h LYS 75 CO -0.86 -0.05 -1.23 1.49 -2.27 0.00 0.00 179.45 176.54 1s6v h GLU 76 N -0.07 0.22 -0.85 1.90 4.81 -1.72 -2.92 114.58 115.94 1s6v h GLU 76 Ca 0.17 -0.38 0.01 0.00 -0.13 0.00 0.00 59.36 59.03 1s6v h GLU 76 Cb 0.33 0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 1s6v h GLU 76 CO -0.39 1.17 0.56 0.35 -0.73 0.00 0.00 179.01 179.97 1s6v h PHE 77 N 0.06 1.06 -0.01 0.92 3.57 -0.63 -2.10 116.94 119.81 1s6v h PHE 77 Ca -0.12 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.40 1s6v h PHE 77 Cb 1.94 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 40.32 1s6v h PHE 77 CO 0.05 0.66 -0.00 0.09 -2.23 0.00 0.00 178.31 176.88 1s6v n ASN 78 N -4.41 1.20 -4.62 0.41 3.02 0.15 -4.84 115.26 106.16 1s6v n ASN 78 Ca 0.10 -1.39 -0.51 0.00 -0.03 0.00 0.00 54.58 52.74 1s6v n ASN 78 Cb 0.03 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.15 1s6v n ASN 78 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1s6v n ASP 79 N -0.07 2.09 -0.14 6.41 -0.08 -0.79 -4.80 116.55 119.18 1s6v n ASP 79 Ca 0.20 1.10 0.15 0.00 -1.51 0.00 0.00 54.79 54.73 1s6v n ASP 79 Cb 0.31 -1.24 0.51 0.00 2.34 0.00 0.00 41.12 43.04 1s6v n ASP 79 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1s6v h PRO 80 N 5.37 0.38 0.00 -0.67 0.11 -1.91 0.53 132.00 135.81 1s6v h PRO 80 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1s6v h PRO 80 Cb 1.32 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1s6v h PRO 80 CO 0.83 0.25 0.00 0.77 -0.21 0.00 0.00 178.00 179.64 1s6v h SER 81 N 0.39 0.00 -0.57 -2.05 0.02 -1.94 -2.42 113.55 106.98 1s6v h SER 81 Ca 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.30 1s6v h SER 81 Cb 0.80 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.34 1s6v h SER 81 CO -0.10 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.18 1s6v n ASN 82 N -3.02 4.57 -4.70 3.07 3.02 0.18 -5.00 115.26 113.39 1s6v n ASN 82 Ca -0.02 -2.51 -0.42 0.00 -0.03 0.00 0.00 54.58 51.60 1s6v n ASN 82 Cb 0.11 -0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 38.70 1s6v n ASN 82 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s6v s ALA 83 N -1.96 3.81 0.00 5.41 0.00 -0.91 -1.31 121.76 126.80 1s6v s ALA 83 Ca 0.48 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.93 1s6v s ALA 83 Cb 0.32 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1s6v s ALA 83 CO 0.21 -1.17 0.00 0.41 0.00 0.00 0.00 175.76 175.22 1s6v n GLY 84 N 4.19 2.57 0.01 0.00 0.00 -1.26 -4.81 105.19 105.90 1s6v n GLY 84 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.25 1s6v n GLY 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s6v n LEU 85 N 0.00 0.06 0.16 0.99 4.77 -0.42 -2.23 117.00 120.32 1s6v n LEU 85 Ca 0.00 0.52 0.06 0.00 -0.03 0.00 0.00 56.01 56.56 1s6v n LEU 85 Cb 0.00 -0.51 0.54 0.00 -2.33 0.00 0.00 43.42 41.12 1s6v n LEU 85 CO 0.00 -0.34 1.08 1.56 -1.33 0.00 0.00 177.39 178.35 1s6v h GLN 86 N 0.00 0.20 -0.66 3.23 7.50 -1.91 -1.08 115.11 122.39 1s6v h GLN 86 Ca 0.00 -0.02 -0.06 0.00 0.50 0.00 0.00 58.65 59.07 1s6v h GLN 86 Cb 0.20 -0.04 -0.03 0.00 0.05 0.00 0.00 27.48 27.66 1s6v h GLN 86 CO 0.00 0.16 0.16 -0.91 -1.50 0.00 0.00 178.83 176.74 1s6v h ASN 87 N 0.21 0.99 -0.34 1.46 2.35 -1.85 0.12 115.58 118.52 1s6v h ASN 87 Ca 0.05 -0.20 -0.10 0.00 -0.55 0.00 0.00 56.30 55.51 1s6v h ASN 87 Cb 0.03 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 1s6v h ASN 87 CO -0.01 0.95 -0.16 1.23 -1.65 0.00 0.00 177.43 177.79 1s6v h GLY 88 N 1.06 0.77 0.94 2.83 0.00 -1.45 -1.84 103.07 105.39 1s6v h GLY 88 Ca 0.21 -0.70 0.01 0.00 0.00 0.00 0.00 47.33 46.86 1s6v h GLY 88 CO 0.00 0.63 0.25 -2.75 0.00 0.00 0.00 176.54 174.68 1s6v h PHE 89 N 0.49 0.47 -0.43 5.60 3.57 -0.69 -2.17 116.94 123.79 1s6v h PHE 89 Ca 0.08 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 1s6v h PHE 89 Cb 0.70 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 1s6v h PHE 89 CO 0.06 0.28 0.15 -0.22 -2.23 0.00 0.00 178.31 176.35 1s6v h LYS 90 N 0.51 0.62 -0.55 1.11 3.64 -0.70 -2.20 116.57 119.00 1s6v h LYS 90 Ca 0.16 -0.09 -0.07 0.00 -1.27 0.00 0.00 60.65 59.37 1s6v h LYS 90 Cb -0.02 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 1s6v h LYS 90 CO -0.06 0.53 0.05 0.35 -2.27 0.00 0.00 179.45 178.05 1s6v h PHE 91 N 0.61 0.96 0.00 1.91 3.57 -0.75 -3.01 116.94 120.24 1s6v h PHE 91 Ca 0.15 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1s6v h PHE 91 Cb 0.16 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.64 1s6v h PHE 91 CO 0.01 0.85 -0.21 1.28 -2.23 0.00 0.00 178.31 178.01 1s6v n LEU 92 N -4.22 0.43 0.06 0.59 4.77 -0.87 -4.24 117.00 113.52 1s6v n LEU 92 Ca 0.03 0.37 -0.11 0.00 -0.03 0.00 0.00 56.01 56.27 1s6v n LEU 92 Cb 0.29 -0.35 -0.04 0.00 -2.33 0.00 0.00 43.42 40.99 1s6v n LEU 92 CO 0.42 -0.03 0.70 -0.08 -1.33 0.00 0.00 177.39 177.07 1s6v h GLU 93 N 0.00 -0.36 0.00 3.23 4.22 -1.31 0.13 114.58 120.49 1s6v h GLU 93 Ca 0.00 0.02 -0.04 0.00 0.08 0.00 0.00 59.36 59.43 1s6v h GLU 93 Cb 0.60 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 1s6v h GLU 93 CO 0.00 -0.24 -0.18 -1.00 -2.18 0.00 0.00 179.01 175.41 1s6v h PRO 94 N -0.38 0.00 -0.23 0.92 0.13 -1.76 0.11 132.00 130.79 1s6v h PRO 94 Ca 0.06 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.14 1s6v h PRO 94 Cb 0.46 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.58 1s6v h PRO 94 CO -0.22 0.18 -0.04 0.82 -0.23 0.00 0.00 178.00 178.51 1s6v h ILE 95 N 0.00 1.28 -0.23 -3.56 1.08 -1.55 -0.40 117.51 114.13 1s6v h ILE 95 Ca -0.00 -1.01 -0.05 0.00 -0.39 0.00 0.00 64.86 63.40 1s6v h ILE 95 Cb 0.34 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 35.56 1s6v h ILE 95 CO 0.02 0.31 -0.10 -0.74 -0.69 0.00 0.00 178.15 176.96 1s6v h HIS 96 N 0.18 0.38 -0.21 1.37 2.76 0.33 -0.87 115.15 119.09 1s6v h HIS 96 Ca 0.06 -0.04 -0.10 0.00 -2.20 0.00 0.00 60.37 58.08 1s6v h HIS 96 Cb 0.49 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.33 1s6v h HIS 96 CO 0.05 0.46 -0.31 0.87 -1.30 0.00 0.00 177.93 177.69 1s6v h LYS 97 N 0.34 0.43 -0.12 5.26 1.57 -0.42 -0.30 116.57 123.32 1s6v h LYS 97 Ca 0.07 -0.18 -0.16 0.00 -1.87 0.00 0.00 60.65 58.51 1s6v h LYS 97 Cb 0.39 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1s6v h LYS 97 CO 0.02 0.70 -0.62 1.49 -0.57 0.00 0.00 179.45 180.47 1s6v h GLU 98 N 0.37 0.43 -2.16 3.15 4.81 -0.31 -3.33 114.58 117.53 1s6v h GLU 98 Ca 0.05 -0.30 -0.59 0.00 -0.13 0.00 0.00 59.36 58.39 1s6v h GLU 98 Cb 0.74 0.05 -0.41 0.00 0.63 0.00 0.00 28.75 29.75 1s6v h GLU 98 CO 0.06 0.91 -0.72 1.19 -0.73 0.00 0.00 179.01 179.72 1s6v n PHE 99 N -3.90 2.82 0.23 0.92 3.01 -0.40 -4.93 117.46 115.20 1s6v n PHE 99 Ca -0.03 -4.01 0.14 0.00 1.01 0.00 0.00 57.45 54.55 1s6v n PHE 99 Cb 0.64 -0.51 0.74 0.00 -0.01 0.00 0.00 39.48 40.34 1s6v n PHE 99 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1s6v h PRO 100 N 3.95 0.00 0.00 -1.08 0.13 -1.18 -2.58 132.00 131.23 1s6v h PRO 100 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1s6v h PRO 100 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 1s6v h PRO 100 CO 0.75 0.00 0.00 0.11 -0.23 0.00 0.00 178.00 178.63 1s6v h TRP 101 N 0.00 0.00 -3.89 1.56 5.08 -1.92 -3.46 115.95 113.33 1s6v h TRP 101 Ca 0.00 0.00 -0.47 0.00 1.08 0.00 0.00 58.89 59.50 1s6v h TRP 101 Cb 0.16 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.31 1s6v h TRP 101 CO 0.00 0.00 0.36 -1.50 -1.28 0.00 0.00 178.44 176.02 1s6v s ILE 102 N -3.39 4.09 0.59 0.12 2.07 -0.97 -4.92 121.20 118.79 1s6v s ILE 102 Ca 0.05 1.73 -0.16 0.00 -1.41 0.00 0.00 60.65 60.86 1s6v s ILE 102 Cb 0.07 -3.96 -0.04 0.00 0.13 0.00 0.00 42.46 38.66 1s6v s ILE 102 CO 0.61 0.14 1.06 -0.94 -1.91 0.00 0.00 174.94 173.90 1s6v s SER 103 N -1.56 5.83 0.22 4.50 1.04 -1.26 -4.89 113.70 117.57 1s6v s SER 103 Ca 0.51 1.81 -0.09 0.00 0.48 0.00 0.00 55.95 58.66 1s6v s SER 103 Cb -0.20 -2.53 0.23 0.00 0.10 0.00 0.00 66.02 63.62 1s6v s SER 103 CO 0.25 -1.14 1.84 0.28 0.98 0.00 0.00 173.24 175.46 1s6v h SER 104 N 0.49 0.71 -0.58 7.02 0.02 -1.91 -0.34 113.55 118.96 1s6v h SER 104 Ca -0.47 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.41 1s6v h SER 104 Cb 1.22 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.60 1s6v h SER 104 CO 0.58 0.48 0.04 1.23 -1.14 0.00 0.00 176.83 178.02 1s6v h GLY 105 N 0.85 1.08 1.04 -3.77 0.00 -1.80 1.00 103.07 101.47 1s6v h GLY 105 Ca 0.31 -0.76 -0.07 0.00 0.00 0.00 0.00 47.33 46.81 1s6v h GLY 105 CO -0.14 0.70 0.15 -0.55 0.00 0.00 0.00 176.54 176.70 1s6v h ASP 106 N 0.90 0.99 -0.35 0.19 3.45 -1.69 -2.10 116.42 117.80 1s6v h ASP 106 Ca 0.17 -0.24 -0.08 0.00 0.43 0.00 0.00 57.03 57.31 1s6v h ASP 106 Cb 0.49 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 38.99 1s6v h ASP 106 CO 0.02 0.97 -0.11 0.25 -1.57 0.00 0.00 179.24 178.80 1s6v h LEU 107 N 0.96 0.70 -0.57 1.55 5.85 -0.65 0.11 115.31 123.26 1s6v h LEU 107 Ca 0.20 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 1s6v h LEU 107 Cb 0.38 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1s6v h LEU 107 CO 0.00 0.92 0.24 -0.26 -0.34 0.00 0.00 178.44 179.01 1s6v h PHE 108 N 0.48 0.84 -0.19 1.25 0.04 -0.78 -0.43 116.94 118.16 1s6v h PHE 108 Ca 0.08 -0.06 -0.19 0.00 2.80 0.00 0.00 57.97 60.61 1s6v h PHE 108 Cb 0.63 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.52 1s6v h PHE 108 CO 0.05 0.67 -0.64 0.66 -0.60 0.00 0.00 178.31 178.45 1s6v h SER 109 N 0.77 0.78 -0.19 2.17 4.64 -1.35 -2.98 113.55 117.40 1s6v h SER 109 Ca 0.19 -0.46 -0.05 0.00 -0.47 0.00 0.00 61.79 61.00 1s6v h SER 109 Cb 0.17 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 1s6v h SER 109 CO -0.02 1.23 -0.03 0.25 -0.87 0.00 0.00 176.83 177.38 1s6v h LEU 110 N 0.50 0.46 -0.69 5.97 5.85 -0.62 -2.26 115.31 124.51 1s6v h LEU 110 Ca -0.01 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.65 1s6v h LEU 110 Cb 1.23 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 1s6v h LEU 110 CO 0.13 0.55 0.43 1.23 -0.34 0.00 0.00 178.44 180.43 1s6v h GLY 111 N 0.83 0.99 0.95 3.75 0.00 -0.93 0.06 103.07 108.72 1s6v h GLY 111 Ca 0.10 -0.32 -0.04 0.00 0.00 0.00 0.00 47.33 47.07 1s6v h GLY 111 CO 0.01 0.27 0.13 -1.33 0.00 0.00 0.00 176.54 175.62 1s6v h GLY 112 N 0.83 0.72 0.98 4.60 0.00 -1.31 -1.30 103.07 107.60 1s6v h GLY 112 Ca 0.28 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 47.18 1s6v h GLY 112 CO -0.11 0.40 0.19 -2.08 0.00 0.00 0.00 176.54 174.93 1s6v h VAL 113 N 0.55 1.10 -0.68 4.60 2.07 -1.10 -1.07 116.25 121.72 1s6v h VAL 113 Ca 0.14 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 1s6v h VAL 113 Cb 0.27 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1s6v h VAL 113 CO -0.00 0.09 0.23 0.74 0.02 0.00 0.00 177.57 178.65 1s6v h THR 114 N 0.39 1.25 -0.41 2.57 2.02 -0.90 -2.21 112.91 115.62 1s6v h THR 114 Ca 0.11 -0.84 -0.01 0.00 0.77 0.00 0.00 66.41 66.44 1s6v h THR 114 Cb -0.01 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 66.90 1s6v h THR 114 CO -0.02 0.33 0.23 0.00 0.37 0.00 0.00 175.52 176.43 1s6v h ALA 115 N 1.10 0.53 -0.26 6.16 0.00 -0.90 0.65 119.26 126.54 1s6v h ALA 115 Ca 0.22 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1s6v h ALA 115 Cb 0.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1s6v h ALA 115 CO -0.01 0.04 0.16 0.28 0.00 0.00 0.00 179.25 179.73 1s6v h VAL 116 N 0.54 1.09 -0.62 0.00 2.07 -0.92 -2.22 116.25 116.18 1s6v h VAL 116 Ca 0.15 -0.19 -0.06 0.00 0.82 0.00 0.00 66.70 67.41 1s6v h VAL 116 Cb 0.04 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 1s6v h VAL 116 CO -0.02 0.08 0.15 1.56 0.02 0.00 0.00 177.57 179.36 1s6v h GLN 117 N 0.33 1.00 0.00 1.57 4.20 -1.16 0.22 115.11 121.27 1s6v h GLN 117 Ca 0.09 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.56 1s6v h GLN 117 Cb -0.00 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.65 1s6v h GLN 117 CO -0.02 0.91 0.00 0.39 -0.67 0.00 0.00 178.83 179.44 1s6v n GLU 118 N -4.32 0.01 -0.90 1.46 -0.58 0.20 -1.74 120.64 114.76 1s6v n GLU 118 Ca 0.04 0.12 0.01 0.00 -0.42 0.00 0.00 57.16 56.91 1s6v n GLU 118 Cb 0.25 -1.51 0.34 0.00 -0.57 0.00 0.00 31.44 29.95 1s6v n GLU 118 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1s6v n MET 119 N -1.52 4.05 -1.78 3.49 2.81 -0.85 -4.90 117.12 118.43 1s6v n MET 119 Ca 0.05 -3.10 -0.08 0.00 -1.81 0.00 0.00 57.70 52.76 1s6v n MET 119 Cb 0.26 -2.19 -0.02 0.00 -0.71 0.00 0.00 33.22 30.57 1s6v n MET 119 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1s6v n GLN 120 N 0.08 -0.64 -0.84 0.03 3.00 -0.71 -0.15 117.38 118.14 1s6v n GLN 120 Ca 0.33 0.57 -0.09 0.00 -0.01 0.00 0.00 57.00 57.81 1s6v n GLN 120 Cb 1.25 -4.50 0.06 0.00 0.00 0.00 0.00 30.24 27.05 1s6v n GLN 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1s6v n GLY 121 N -1.40 -0.63 3.77 1.08 0.00 0.73 -4.71 105.19 104.03 1s6v n GLY 121 Ca -0.09 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 43.84 1s6v n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1s6v s PRO 122 N -3.76 2.23 0.23 1.61 0.04 -1.26 -4.63 135.00 129.46 1s6v s PRO 122 Ca 0.24 1.11 -0.30 0.00 0.04 0.00 0.00 61.00 62.10 1s6v s PRO 122 Cb -0.01 -1.90 -0.09 0.00 0.04 0.00 0.00 34.50 32.55 1s6v s PRO 122 CO 0.17 -1.64 1.16 0.15 0.04 0.00 0.00 177.00 176.87 1s6v s LYS 123 N -4.92 4.55 -0.29 4.56 -0.14 -1.26 -4.34 119.74 117.89 1s6v s LYS 123 Ca 0.61 1.86 0.03 0.00 -1.36 0.00 0.00 55.97 57.10 1s6v s LYS 123 Cb -0.17 -3.21 0.08 0.00 -1.68 0.00 0.00 37.83 32.85 1s6v s LYS 123 CO 0.56 0.04 -0.02 0.42 -0.76 0.00 0.00 175.35 175.59 1s6v s ILE 124 N -0.60 2.04 0.30 2.17 1.01 -1.26 -4.80 121.20 120.05 1s6v s ILE 124 Ca 0.49 -1.86 -0.29 0.00 0.00 0.00 0.00 60.65 58.99 1s6v s ILE 124 Cb -0.33 -2.34 -0.13 0.00 0.01 0.00 0.00 42.46 39.67 1s6v s ILE 124 CO 0.39 -0.32 1.21 -2.65 0.00 0.00 0.00 174.94 173.57 1s6v n PRO 125 N 4.42 1.79 -4.18 2.79 -0.02 -1.26 -4.80 135.00 133.74 1s6v n PRO 125 Ca -0.05 0.63 -0.16 0.00 -2.02 0.00 0.00 63.50 61.90 1s6v n PRO 125 Cb 0.42 -2.15 -0.14 0.00 -0.02 0.00 0.00 33.50 31.61 1s6v n PRO 125 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1s6v s TRP 126 N -0.84 0.56 0.01 6.00 -0.00 0.10 -4.77 118.94 120.00 1s6v s TRP 126 Ca 0.60 -0.15 0.08 0.00 -0.00 0.00 0.00 56.10 56.63 1s6v s TRP 126 Cb -0.64 -0.35 -0.03 0.00 -0.00 0.00 0.00 33.47 32.45 1s6v s TRP 126 CO 0.59 -0.02 -0.23 1.03 -0.00 0.00 0.00 176.95 178.32 1s6v s ARG 127 N -0.31 2.06 0.51 5.86 0.52 -1.26 -0.46 118.95 125.87 1s6v s ARG 127 Ca 0.01 -0.96 0.05 0.00 -0.52 0.00 0.00 55.73 54.30 1s6v s ARG 127 Cb -0.03 -2.10 0.03 0.00 0.52 0.00 0.00 34.95 33.37 1s6v s ARG 127 CO -0.00 0.55 0.70 0.00 0.02 0.00 0.00 175.30 176.57 1s6v s ALA 128 N -0.75 4.22 0.00 2.13 0.00 -1.26 -4.81 121.76 121.29 1s6v s ALA 128 Ca 0.12 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.52 1s6v s ALA 128 Cb -0.10 -1.84 0.00 0.00 0.00 0.00 0.00 23.12 21.18 1s6v s ALA 128 CO 0.01 -0.60 0.00 0.41 0.00 0.00 0.00 175.76 175.59 1s6v n GLY 129 N -2.15 0.94 3.77 0.00 0.00 -1.26 -4.57 105.19 101.92 1s6v n GLY 129 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1s6v n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s6v s ARG 130 N 0.00 4.24 -0.11 1.61 0.52 -1.26 -0.58 118.95 123.37 1s6v s ARG 130 Ca 0.00 2.24 0.04 0.00 -0.52 0.00 0.00 55.73 57.49 1s6v s ARG 130 Cb 0.00 -2.98 0.00 0.00 0.52 0.00 0.00 34.95 32.49 1s6v s ARG 130 CO 0.00 -0.30 -0.23 0.08 0.02 0.00 0.00 175.30 174.87 1s6v s VAL 131 N -1.17 2.02 0.26 3.52 1.01 -1.16 -4.61 120.40 120.27 1s6v s VAL 131 Ca 0.51 -0.99 -0.30 0.00 0.00 0.00 0.00 61.98 61.20 1s6v s VAL 131 Cb -0.40 -1.75 -0.13 0.00 0.00 0.00 0.00 36.38 34.09 1s6v s VAL 131 CO 0.53 0.55 1.37 0.47 0.00 0.00 0.00 175.10 178.02 1s6v n ASP 132 N 3.64 2.70 -4.51 3.32 10.43 -1.26 -4.06 116.55 126.82 1s6v n ASP 132 Ca -0.19 1.16 -0.26 0.00 2.57 0.00 0.00 54.79 58.07 1s6v n ASP 132 Cb 0.53 -1.43 -0.10 0.00 1.84 0.00 0.00 41.12 41.95 1s6v n ASP 132 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1s6v s THR 133 N -0.29 2.78 0.94 -3.53 -4.23 -0.91 -4.98 115.64 105.42 1s6v s THR 133 Ca 0.65 -1.98 -0.13 0.00 -1.18 0.00 0.00 61.69 59.05 1s6v s THR 133 Cb -0.64 -2.40 0.02 0.00 1.34 0.00 0.00 72.50 70.82 1s6v s THR 133 CO 0.52 -0.21 0.34 -2.65 -0.54 0.00 0.00 174.62 172.08 1s6v n PRO 134 N -0.14 -0.22 0.04 3.99 -0.02 -1.26 -4.85 135.00 132.53 1s6v n PRO 134 Ca -0.10 -0.03 0.05 0.00 -2.02 0.00 0.00 63.50 61.41 1s6v n PRO 134 Cb 0.57 -1.80 0.47 0.00 -0.02 0.00 0.00 33.50 32.73 1s6v n PRO 134 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1s6v h GLU 135 N -1.43 0.42 0.00 -0.52 4.81 -1.99 -0.96 114.58 114.91 1s6v h GLU 135 Ca -0.44 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1s6v h GLU 135 Cb 1.29 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.57 1s6v h GLU 135 CO 0.34 0.28 0.00 -0.40 -0.73 0.00 0.00 179.01 178.50 1s6v n ASP 136 N -4.49 0.00 -0.44 1.04 3.85 -1.26 -2.05 116.55 113.21 1s6v n ASP 136 Ca 0.02 0.48 0.13 0.00 -0.71 0.00 0.00 54.79 54.72 1s6v n ASP 136 Cb 0.09 -0.49 0.54 0.00 -1.35 0.00 0.00 41.12 39.90 1s6v n ASP 136 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1s6v n THR 137 N -1.49 0.04 -2.11 2.12 -2.24 -0.36 -4.89 114.28 105.35 1s6v n THR 137 Ca 0.04 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 61.16 1s6v n THR 137 Cb 0.18 0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.75 1s6v n THR 137 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1s6v s THR 138 N -1.96 3.10 0.42 4.28 2.01 -0.87 -4.72 115.64 117.89 1s6v s THR 138 Ca 0.38 0.80 -0.24 0.00 0.31 0.00 0.00 61.69 62.94 1s6v s THR 138 Cb 0.20 -3.52 -0.08 0.00 0.01 0.00 0.00 72.50 69.11 1s6v s THR 138 CO 0.32 0.07 1.10 -2.84 -0.69 0.00 0.00 174.62 172.58 1s6v s PRO 139 N 0.93 4.03 0.77 4.92 0.02 -1.26 -5.02 135.00 139.38 1s6v s PRO 139 Ca 0.65 1.64 -0.12 0.00 0.02 0.00 0.00 61.00 63.19 1s6v s PRO 139 Cb -0.39 -2.53 0.06 0.00 0.02 0.00 0.00 34.50 31.66 1s6v s PRO 139 CO 0.32 -0.29 1.12 -0.51 -0.33 0.00 0.00 177.00 177.31 1s6v s ASP 140 N -1.44 4.33 0.74 2.53 1.01 -1.26 -4.62 116.67 117.97 1s6v s ASP 140 Ca 0.59 1.98 -0.12 0.00 0.71 0.00 0.00 52.55 55.71 1s6v s ASP 140 Cb -0.25 -2.54 0.04 0.00 1.01 0.00 0.00 42.92 41.18 1s6v s ASP 140 CO 0.31 -2.15 1.10 0.20 0.21 0.00 0.00 175.17 174.84 1s6v s ASN 141 N -2.96 4.62 0.00 0.27 0.02 -1.26 -4.28 114.94 111.35 1s6v s ASN 141 Ca 0.65 1.90 0.00 0.00 -1.02 0.00 0.00 52.86 54.39 1s6v s ASN 141 Cb -0.20 -2.53 0.00 0.00 0.02 0.00 0.00 41.25 38.54 1s6v s ASN 141 CO 0.52 -1.96 0.00 0.61 0.02 0.00 0.00 177.10 176.29 1s6v n GLY 142 N -0.92 0.86 0.03 0.66 0.00 -1.26 -5.00 105.19 99.55 1s6v n GLY 142 Ca 0.10 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.23 1s6v n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s6v n ARG 143 N -1.18 0.23 -3.22 1.61 1.74 -1.26 -4.92 116.66 109.65 1s6v n ARG 143 Ca 0.00 -0.01 -0.34 0.00 -0.77 0.00 0.00 57.85 56.73 1s6v n ARG 143 Cb 0.00 -1.57 -0.06 0.00 -1.02 0.00 0.00 32.46 29.81 1s6v n ARG 143 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1s6v s LEU 144 N -3.74 4.22 0.40 0.55 1.43 -1.26 -4.78 118.68 115.50 1s6v s LEU 144 Ca 0.05 1.21 -0.27 0.00 -1.03 0.00 0.00 54.13 54.09 1s6v s LEU 144 Cb 0.15 -3.70 -0.10 0.00 0.03 0.00 0.00 46.19 42.57 1s6v s LEU 144 CO 0.80 -0.05 1.41 -2.16 0.23 0.00 0.00 176.35 176.58 1s6v s PRO 145 N -2.46 3.97 0.20 1.29 0.04 -1.26 -5.02 135.00 131.76 1s6v s PRO 145 Ca 0.46 2.40 -0.29 0.00 0.04 0.00 0.00 61.00 63.62 1s6v s PRO 145 Cb -0.13 -2.84 -0.08 0.00 0.04 0.00 0.00 34.50 31.49 1s6v s PRO 145 CO 0.19 -0.58 0.91 -0.51 0.04 0.00 0.00 177.00 177.05 1s6v s ASP 146 N -0.41 7.56 0.10 6.66 1.01 -1.26 -4.96 116.67 125.38 1s6v s ASP 146 Ca 0.56 1.85 0.27 0.00 0.71 0.00 0.00 52.55 55.94 1s6v s ASP 146 Cb -0.43 -2.58 0.90 0.00 1.01 0.00 0.00 42.92 41.81 1s6v s ASP 146 CO 0.57 0.12 1.76 0.00 0.21 0.00 0.00 175.17 177.83 1s6v n ALA 147 N 1.81 2.48 -1.23 5.23 0.00 -1.26 -4.09 120.51 123.44 1s6v n ALA 147 Ca -0.02 -0.10 -0.27 0.00 0.00 0.00 0.00 53.44 53.05 1s6v n ALA 147 Cb 0.48 -1.41 0.04 0.00 0.00 0.00 0.00 19.45 18.56 1s6v n ALA 147 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1s6v n ASP 148 N -1.89 7.07 -3.28 0.00 5.68 -1.26 -2.32 116.55 120.54 1s6v n ASP 148 Ca 0.06 -3.44 -0.17 0.00 -0.50 0.00 0.00 54.79 50.73 1s6v n ASP 148 Cb 0.39 -1.05 -0.04 0.00 -1.14 0.00 0.00 41.12 39.28 1s6v n ASP 148 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1s6v n LYS 149 N -0.18 1.02 -2.77 0.11 4.76 -1.26 -4.97 118.16 114.88 1s6v n LYS 149 Ca 0.47 -2.14 -0.12 0.00 -2.87 0.00 0.00 58.31 53.66 1s6v n LYS 149 Cb 0.58 0.83 -0.01 0.00 -1.84 0.00 0.00 35.03 34.58 1s6v n LYS 149 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1s6v n ASP 150 N -1.43 2.17 -0.31 4.39 3.85 -1.26 -3.14 116.55 120.81 1s6v n ASP 150 Ca -0.08 -1.81 -0.04 0.00 -0.71 0.00 0.00 54.79 52.15 1s6v n ASP 150 Cb 0.38 0.07 0.08 0.00 -1.35 0.00 0.00 41.12 40.29 1s6v n ASP 150 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1s6v h ALA 151 N 0.94 1.05 -0.70 2.12 0.00 -1.90 -0.79 119.26 119.98 1s6v h ALA 151 Ca -0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1s6v h ALA 151 Cb 0.50 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1s6v h ALA 151 CO 0.25 0.47 0.44 -0.44 0.00 0.00 0.00 179.25 179.97 1s6v h ASP 152 N 1.13 0.81 -0.34 0.00 3.32 -1.97 0.59 116.42 119.96 1s6v h ASP 152 Ca 0.30 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.20 1s6v h ASP 152 Cb -0.12 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.22 1s6v h ASP 152 CO -0.06 0.61 -0.27 0.22 -1.72 0.00 0.00 179.24 178.01 1s6v h TYR 153 N 0.95 0.93 -0.26 4.55 5.03 -1.70 -1.92 116.97 124.55 1s6v h TYR 153 Ca 0.25 -0.26 -0.01 0.00 2.58 0.00 0.00 58.73 61.29 1s6v h TYR 153 Cb -0.08 -0.20 -0.01 0.00 1.55 0.00 0.00 36.73 37.99 1s6v h TYR 153 CO 0.00 1.03 0.13 0.28 -1.32 0.00 0.00 178.16 178.28 1s6v h VAL 154 N 0.56 1.13 -0.51 1.81 2.07 -0.53 0.01 116.25 120.78 1s6v h VAL 154 Ca 0.06 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1s6v h VAL 154 Cb 0.84 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1s6v h VAL 154 CO 0.07 0.13 0.23 -0.09 0.02 0.00 0.00 177.57 177.93 1s6v h ARG 155 N 0.30 0.75 -0.03 1.57 2.43 -0.90 -1.13 114.38 117.37 1s6v h ARG 155 Ca 0.09 -0.12 -0.18 0.00 -0.81 0.00 0.00 59.98 58.96 1s6v h ARG 155 Cb 0.09 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1s6v h ARG 155 CO -0.01 0.64 -0.77 1.79 -1.51 0.00 0.00 179.97 180.10 1s6v h THR 156 N 0.68 1.45 0.57 0.20 1.35 -1.26 -2.69 112.91 113.20 1s6v h THR 156 Ca 0.17 -2.37 -0.03 0.00 -0.55 0.00 0.00 66.41 63.64 1s6v h THR 156 Cb 0.15 2.28 0.01 0.00 -1.73 0.00 0.00 68.15 68.85 1s6v h THR 156 CO -0.02 0.69 -0.27 0.15 -0.25 0.00 0.00 175.52 175.82 1s6v h PHE 157 N 0.14 -0.71 0.00 4.73 3.04 -0.81 -2.95 116.94 120.39 1s6v h PHE 157 Ca -0.03 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.90 1s6v h PHE 157 Cb 1.36 0.23 0.00 0.00 2.56 0.00 0.00 35.95 40.10 1s6v h PHE 157 CO 0.03 -0.40 0.00 0.74 -2.02 0.00 0.00 178.31 176.66 1s6v h PHE 158 N -0.87 0.00 0.00 0.41 0.04 -1.22 0.16 116.94 115.47 1s6v h PHE 158 Ca -0.08 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.63 1s6v h PHE 158 Cb 0.62 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.76 1s6v h PHE 158 CO -0.02 0.00 -0.32 1.96 -0.60 0.00 0.00 178.31 179.34 1s6v h GLN 159 N 0.00 0.00 0.00 1.51 4.20 -1.29 -1.24 115.11 118.29 1s6v h GLN 159 Ca 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1s6v h GLN 159 Cb 0.06 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1s6v h GLN 159 CO 0.00 0.32 -0.04 -0.09 -0.67 0.00 0.00 178.83 178.35 1s6v h ARG 160 N 0.00 0.00 -0.70 1.46 2.43 -1.01 -0.78 114.38 115.78 1s6v h ARG 160 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1s6v h ARG 160 Cb 0.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1s6v h ARG 160 CO 0.04 0.04 0.00 1.28 -1.51 0.00 0.00 179.97 179.82 1s6v n LEU 161 N -3.18 3.77 -2.12 3.80 4.77 -0.56 -2.18 117.00 121.30 1s6v n LEU 161 Ca -0.00 -1.88 -0.18 0.00 -0.03 0.00 0.00 56.01 53.92 1s6v n LEU 161 Cb 0.27 -0.47 -0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1s6v n LEU 161 CO 0.27 0.94 -0.20 -3.20 -1.33 0.00 0.00 177.39 173.87 1s6v n ASN 162 N 1.57 -5.27 -4.74 -1.43 5.15 -0.30 -4.97 115.26 105.27 1s6v n ASN 162 Ca 0.24 -0.05 -0.35 0.00 -0.60 0.00 0.00 54.58 53.81 1s6v n ASN 162 Cb 0.60 -4.31 -0.08 0.00 -0.53 0.00 0.00 39.78 35.45 1s6v n ASN 162 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 1s6v s MET 163 N -4.98 3.11 0.43 1.20 -1.94 -0.65 -5.02 119.30 111.46 1s6v s MET 163 Ca 0.03 -0.33 0.07 0.00 -1.71 0.00 0.00 55.69 53.75 1s6v s MET 163 Cb -0.01 -2.90 0.07 0.00 2.01 0.00 0.00 34.83 33.99 1s6v s MET 163 CO 0.04 0.72 0.59 0.27 -0.01 0.00 0.00 175.02 176.64 1s6v n ASN 164 N 2.07 1.55 -0.09 3.03 0.23 -1.26 -4.13 115.26 116.65 1s6v n ASN 164 Ca -0.19 -2.13 -0.06 0.00 -0.53 0.00 0.00 54.58 51.67 1s6v n ASN 164 Cb 0.54 -0.31 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 1s6v n ASN 164 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1s6v h ASP 165 N 0.07 -0.36 -0.80 0.53 5.19 -1.99 -0.57 116.42 118.48 1s6v h ASP 165 Ca -0.20 0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 1s6v h ASP 165 Cb 0.92 0.23 -0.04 0.00 0.18 0.00 0.00 39.33 40.62 1s6v h ASP 165 CO 0.28 -0.13 0.51 -0.09 -3.12 0.00 0.00 179.24 176.69 1s6v h ARG 166 N -0.02 1.08 -0.55 3.56 2.43 -1.96 -1.29 114.38 117.62 1s6v h ARG 166 Ca 0.17 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1s6v h ARG 166 Cb 0.28 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 1s6v h ARG 166 CO -0.36 0.74 0.17 0.93 -1.51 0.00 0.00 179.97 179.94 1s6v h GLU 167 N 1.10 0.85 0.29 0.20 5.08 -1.72 -0.93 114.58 119.45 1s6v h GLU 167 Ca 0.29 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1s6v h GLU 167 Cb -0.08 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.05 1s6v h GLU 167 CO -0.06 0.77 -0.14 0.28 -1.00 0.00 0.00 179.01 178.87 1s6v h VAL 168 N 0.76 0.73 -0.85 3.13 2.07 -0.94 0.13 116.25 121.30 1s6v h VAL 168 Ca 0.18 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 1s6v h VAL 168 Cb 0.28 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1s6v h VAL 168 CO -0.01 0.03 0.44 0.58 0.02 0.00 0.00 177.57 178.63 1s6v h VAL 169 N -0.45 1.25 -0.07 2.57 2.07 -1.15 -1.57 116.25 118.91 1s6v h VAL 169 Ca -0.04 -0.66 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 1s6v h VAL 169 Cb 0.34 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1s6v h VAL 169 CO 0.06 0.29 0.02 0.00 0.02 0.00 0.00 177.57 177.96 1s6v h ALA 170 N 1.29 0.09 -0.54 1.67 0.00 -0.99 -3.02 119.26 117.76 1s6v h ALA 170 Ca 0.30 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1s6v h ALA 170 Cb 0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1s6v h ALA 170 CO -0.04 -0.29 0.26 -0.07 0.00 0.00 0.00 179.25 179.10 1s6v h LEU 171 N -0.10 0.68 -1.64 0.00 3.38 -0.37 -1.36 115.31 115.88 1s6v h LEU 171 Ca 0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1s6v h LEU 171 Cb 0.24 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1s6v h LEU 171 CO 0.00 0.58 0.00 -0.03 0.09 0.00 0.00 178.44 179.08 1s6v h MET 172 N 0.76 0.00 0.00 1.13 4.05 -1.18 -2.03 114.93 117.66 1s6v h MET 172 Ca 0.19 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.61 1s6v h MET 172 Cb 0.08 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.88 1s6v h MET 172 CO -0.03 0.00 0.00 0.41 0.23 0.00 0.00 176.91 177.52 1s6v n GLY 173 N -0.50 -0.86 0.14 1.39 0.00 -0.51 -0.73 105.19 104.12 1s6v n GLY 173 Ca -0.00 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1s6v n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s6v n ALA 174 N -1.72 1.50 0.70 4.61 0.00 -0.76 -1.96 120.51 122.88 1s6v n ALA 174 Ca -0.01 0.12 0.06 0.00 0.00 0.00 0.00 53.44 53.61 1s6v n ALA 174 Cb 0.06 -1.37 0.34 0.00 0.00 0.00 0.00 19.45 18.47 1s6v n ALA 174 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1s6v n HIS 175 N -2.26 0.00 0.30 0.00 8.25 0.09 -1.03 115.22 120.56 1s6v n HIS 175 Ca 0.01 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 57.66 1s6v n HIS 175 Cb 0.18 -0.01 0.82 0.00 1.12 0.00 0.00 29.99 32.09 1s6v n HIS 175 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1s6v h ALA 176 N 2.70 1.00 -2.67 -1.41 0.00 -1.64 -3.40 119.26 113.84 1s6v h ALA 176 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 1s6v h ALA 176 Cb 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 1s6v h ALA 176 CO 0.00 0.00 -0.24 -0.51 0.00 0.00 0.00 179.25 178.50 1s6v s LEU 177 N -6.11 4.46 0.00 0.00 1.02 -0.19 -4.30 118.68 113.56 1s6v s LEU 177 Ca -0.00 0.90 0.00 0.00 0.02 0.00 0.00 54.13 55.05 1s6v s LEU 177 Cb 0.10 -2.53 0.00 0.00 0.02 0.00 0.00 46.19 43.78 1s6v s LEU 177 CO 0.50 0.33 0.00 0.61 0.02 0.00 0.00 176.35 177.82 1s6v n GLY 178 N 1.82 1.70 3.75 -3.19 0.00 0.05 -4.92 105.19 104.39 1s6v n GLY 178 Ca -0.15 -0.60 -0.02 0.00 0.00 0.00 0.00 46.02 45.26 1s6v n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s6v s LYS 179 N 0.00 1.00 0.07 1.61 -2.85 -1.26 -4.36 119.74 113.95 1s6v s LYS 179 Ca 0.00 -0.57 -0.12 0.00 -1.00 0.00 0.00 55.97 54.28 1s6v s LYS 179 Cb 0.00 0.33 -0.06 0.00 -2.06 0.00 0.00 37.83 36.04 1s6v s LYS 179 CO 0.00 -0.46 0.43 0.95 0.10 0.00 0.00 175.35 176.37 1s6v s THR 180 N -2.87 5.03 -0.13 3.79 -4.23 -0.46 -4.96 115.64 111.82 1s6v s THR 180 Ca 0.15 0.63 0.02 0.00 -1.18 0.00 0.00 61.69 61.31 1s6v s THR 180 Cb -0.00 -3.68 0.01 0.00 1.34 0.00 0.00 72.50 70.17 1s6v s THR 180 CO 0.01 0.37 -0.18 -1.00 -0.54 0.00 0.00 174.62 173.28 1s6v s HIS 181 N -1.31 2.33 0.29 3.99 0.09 -1.06 -1.63 115.29 117.99 1s6v s HIS 181 Ca 0.31 -1.17 0.04 0.00 -0.00 0.00 0.00 55.06 54.24 1s6v s HIS 181 Cb -0.15 -1.63 0.65 0.00 -0.00 0.00 0.00 32.58 31.45 1s6v s HIS 181 CO 0.17 -0.57 1.81 1.25 -0.00 0.00 0.00 174.74 177.40 1s6v h LEU 182 N 7.47 0.86 -1.65 0.89 5.85 -1.51 0.46 115.31 127.68 1s6v h LEU 182 Ca -0.33 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.44 1s6v h LEU 182 Cb 1.18 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 1s6v h LEU 182 CO 0.53 0.39 -0.09 0.07 -0.34 0.00 0.00 178.44 179.00 1s6v h LYS 183 N 0.89 0.00 0.00 1.25 2.10 -1.96 -1.28 116.57 117.57 1s6v h LYS 183 Ca 0.53 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 59.05 1s6v h LYS 183 Cb 0.68 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.99 1s6v h LYS 183 CO -0.31 0.09 -0.93 -0.91 -2.00 0.00 0.00 179.45 175.39 1s6v h ASN 184 N 0.00 0.00 -0.00 7.07 2.35 -1.26 -3.45 115.58 120.29 1s6v h ASN 184 Ca -0.00 -0.28 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 1s6v h ASN 184 Cb 0.48 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.85 1s6v h ASN 184 CO 0.01 1.16 -0.26 -1.54 -1.65 0.00 0.00 177.43 175.16 1s6v n SER 185 N -4.52 0.32 0.00 5.81 3.41 -0.74 -4.72 113.62 113.19 1s6v n SER 185 Ca -0.21 -0.66 0.00 0.00 -0.26 0.00 0.00 58.87 57.74 1s6v n SER 185 Cb 0.49 0.96 0.00 0.00 -0.26 0.00 0.00 64.21 65.40 1s6v n SER 185 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s6v n GLY 186 N 1.10 0.68 3.17 5.00 0.00 -0.48 -5.04 105.19 109.62 1s6v n GLY 186 Ca 0.01 -0.15 -0.16 0.00 0.00 0.00 0.00 46.02 45.73 1s6v n GLY 186 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s6v s TYR 187 N -2.00 1.09 -0.05 1.61 1.51 -1.26 -4.59 117.35 113.66 1s6v s TYR 187 Ca 0.00 -0.58 -0.03 0.00 -1.01 0.00 0.00 57.07 55.46 1s6v s TYR 187 Cb 0.00 -0.60 0.02 0.00 -0.11 0.00 0.00 41.96 41.27 1s6v s TYR 187 CO 0.00 0.02 0.11 -2.00 -1.11 0.00 0.00 175.55 172.57 1s6v s GLU 188 N -2.36 0.09 0.00 -0.62 2.56 -1.26 -1.17 118.70 115.93 1s6v s GLU 188 Ca 0.02 0.23 0.00 0.00 0.00 0.00 0.00 54.97 55.22 1s6v s GLU 188 Cb -0.06 -0.07 0.00 0.00 2.00 0.00 0.00 34.13 36.00 1s6v s GLU 188 CO 0.01 -0.09 0.00 0.41 -0.56 0.00 0.00 175.26 175.03 1s6v n GLY 189 N 3.60 3.21 3.88 -1.50 0.00 -0.65 -4.86 105.19 108.88 1s6v n GLY 189 Ca -0.19 -1.91 -0.30 0.00 0.00 0.00 0.00 46.02 43.62 1s6v n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1s6v s PRO 190 N -3.30 3.69 0.14 1.61 0.04 -1.26 -1.35 135.00 134.57 1s6v s PRO 190 Ca 0.00 0.56 0.24 0.00 0.04 0.00 0.00 61.00 61.84 1s6v s PRO 190 Cb 0.00 -2.25 0.40 0.00 0.04 0.00 0.00 34.50 32.69 1s6v s PRO 190 CO 0.00 -0.28 1.39 -1.49 0.04 0.00 0.00 177.00 176.66 1s6v h TRP 191 N 0.46 0.00 -1.20 0.56 6.55 -1.76 -0.04 115.95 120.52 1s6v h TRP 191 Ca -0.46 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.38 1s6v h TRP 191 Cb 1.19 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.49 1s6v h TRP 191 CO 0.62 0.00 0.00 0.41 -1.05 0.00 0.00 178.44 178.42 1s6v n GLY 192 N 1.32 2.43 0.08 1.49 0.00 -1.26 -4.63 105.19 104.63 1s6v n GLY 192 Ca 0.04 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 1s6v n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s6v n ALA 193 N -3.00 1.58 -1.97 4.61 0.00 -1.26 -4.63 120.51 115.84 1s6v n ALA 193 Ca 0.00 -1.13 -0.41 0.00 0.00 0.00 0.00 53.44 51.91 1s6v n ALA 193 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 19.45 19.33 1s6v n ALA 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s6v n ALA 194 N -2.64 6.47 0.20 0.00 0.00 -1.26 -4.80 120.51 118.49 1s6v n ALA 194 Ca -0.28 -4.05 0.18 0.00 0.00 0.00 0.00 53.44 49.29 1s6v n ALA 194 Cb 1.05 -2.96 0.80 0.00 0.00 0.00 0.00 19.45 18.35 1s6v n ALA 194 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1s6v h ASN 195 N 5.04 0.00 0.00 0.00 -0.26 -1.82 -2.51 115.58 116.03 1s6v h ASN 195 Ca 0.64 0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 56.34 1s6v h ASN 195 Cb 0.41 0.00 -0.09 0.00 -1.06 0.00 0.00 38.32 37.58 1s6v h ASN 195 CO 1.59 0.00 -0.52 -0.46 -1.06 0.00 0.00 177.43 176.98 1s6v n ASN 196 N -3.47 1.50 -4.21 5.81 0.23 -1.26 -0.77 115.26 113.08 1s6v n ASN 196 Ca 0.03 -3.09 -0.30 0.00 -0.53 0.00 0.00 54.58 50.69 1s6v n ASN 196 Cb 0.46 -0.42 -0.17 0.00 -2.08 0.00 0.00 39.78 37.58 1s6v n ASN 196 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1s6v s PHE 198 N 0.18 2.84 0.20 0.00 5.36 0.79 -4.76 117.98 122.59 1s6v s PHE 198 Ca -0.12 -0.15 0.04 0.00 -0.96 0.00 0.00 56.93 55.73 1s6v s PHE 198 Cb -0.16 -3.98 -0.01 0.00 -0.34 0.00 0.00 43.02 38.53 1s6v s PHE 198 CO 0.06 -1.31 0.14 0.25 -1.46 0.00 0.00 175.22 172.90 1s6v n THR 199 N 6.06 0.00 -0.15 0.12 -2.24 -1.26 -4.41 114.28 112.40 1s6v n THR 199 Ca -0.00 -1.38 0.02 0.00 -2.27 0.00 0.00 64.05 60.41 1s6v n THR 199 Cb 0.47 0.63 0.22 0.00 -2.10 0.00 0.00 70.33 69.56 1s6v n THR 199 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1s6v n ASN 200 N -2.10 3.76 -0.22 3.42 6.94 -1.26 -4.55 115.26 121.25 1s6v n ASN 200 Ca 0.02 -2.60 0.15 0.00 -0.02 0.00 0.00 54.58 52.12 1s6v n ASN 200 Cb 0.35 -0.62 0.45 0.00 -2.36 0.00 0.00 39.78 37.60 1s6v n ASN 200 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1s6v h GLU 201 N 2.13 0.51 -0.28 -3.83 4.81 -1.95 -2.42 114.58 113.56 1s6v h GLU 201 Ca 0.05 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.30 1s6v h GLU 201 Cb 1.48 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.69 1s6v h GLU 201 CO 0.34 0.34 -0.03 0.35 -0.73 0.00 0.00 179.01 179.28 1s6v h PHE 202 N 0.53 -0.07 -0.53 0.92 3.57 -1.85 -0.39 116.94 119.11 1s6v h PHE 202 Ca 0.42 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.85 1s6v h PHE 202 Cb 0.85 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 1s6v h PHE 202 CO -0.00 -0.08 -0.06 1.88 -2.23 0.00 0.00 178.31 177.82 1s6v h TYR 203 N 0.04 1.03 -0.28 0.41 -1.99 -1.79 -1.52 116.97 112.87 1s6v h TYR 203 Ca 0.13 -0.18 -0.02 0.00 2.00 0.00 0.00 58.73 60.66 1s6v h TYR 203 Cb 0.19 -0.27 -0.01 0.00 2.00 0.00 0.00 36.73 38.64 1s6v h TYR 203 CO -0.24 0.95 0.09 -0.07 -0.00 0.00 0.00 178.16 178.89 1s6v h LEU 204 N 0.85 0.41 -0.32 3.88 3.38 -1.35 -2.06 115.31 120.10 1s6v h LEU 204 Ca 0.15 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1s6v h LEU 204 Cb 0.58 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1s6v h LEU 204 CO 0.04 0.50 0.06 0.78 0.09 0.00 0.00 178.44 179.91 1s6v h ASN 205 N 0.30 0.50 -0.84 -0.43 2.35 -0.95 0.28 115.58 116.78 1s6v h ASN 205 Ca 0.09 -0.25 0.09 0.00 -0.55 0.00 0.00 56.30 55.69 1s6v h ASN 205 Cb 0.24 -0.13 -0.07 0.00 0.05 0.00 0.00 38.32 38.40 1s6v h ASN 205 CO -0.00 0.62 0.49 0.25 -1.65 0.00 0.00 177.43 177.14 1s6v h LEU 206 N 0.36 0.72 0.16 1.61 5.85 -1.23 0.84 115.31 123.62 1s6v h LEU 206 Ca 0.10 0.04 -0.31 0.00 0.84 0.00 0.00 57.88 58.55 1s6v h LEU 206 Cb 0.32 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 41.26 1s6v h LEU 206 CO 0.00 0.42 -1.47 -0.07 -0.34 0.00 0.00 178.44 176.98 1s6v h LEU 207 N 0.84 0.53 0.00 2.25 4.07 -1.11 -3.40 115.31 118.49 1s6v h LEU 207 Ca 0.40 -0.65 -0.24 0.00 0.08 0.00 0.00 57.88 57.47 1s6v h LEU 207 Cb 0.34 -0.17 -0.04 0.00 1.08 0.00 0.00 40.66 41.86 1s6v h LEU 207 CO -0.24 1.53 -1.93 0.59 -1.08 0.00 0.00 178.44 177.31 1s6v n ASN 208 N -3.55 0.39 -4.84 -0.43 5.03 0.95 -4.95 115.26 107.86 1s6v n ASN 208 Ca -0.15 0.18 -0.31 0.00 0.87 0.00 0.00 54.58 55.16 1s6v n ASN 208 Cb 1.06 0.74 0.02 0.00 -1.02 0.00 0.00 39.78 40.57 1s6v n ASN 208 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1s6v s GLU 209 N -2.80 3.36 -0.24 3.52 0.41 0.28 -5.03 118.70 118.20 1s6v s GLU 209 Ca -0.07 0.92 -0.11 0.00 -0.41 0.00 0.00 54.97 55.30 1s6v s GLU 209 Cb 0.08 -2.05 -0.05 0.00 -1.78 0.00 0.00 34.13 30.34 1s6v s GLU 209 CO 0.84 -0.76 0.19 -0.51 -0.49 0.00 0.00 175.26 174.52 1s6v s ASP 210 N -3.69 6.14 -0.08 -0.19 -0.00 -1.26 -4.92 116.67 112.66 1s6v s ASP 210 Ca 0.58 0.14 -0.01 0.00 -0.00 0.00 0.00 52.55 53.26 1s6v s ASP 210 Cb -0.13 -2.12 -0.03 0.00 -0.00 0.00 0.00 42.92 40.64 1s6v s ASP 210 CO 0.49 0.04 -0.04 0.26 -0.00 0.00 0.00 175.17 175.92 1s6v s TRP 211 N 1.16 3.04 -0.08 4.23 0.52 -1.26 -4.29 118.94 122.26 1s6v s TRP 211 Ca 0.09 0.07 0.04 0.00 0.02 0.00 0.00 56.10 56.31 1s6v s TRP 211 Cb -0.14 -1.76 -0.01 0.00 -1.15 0.00 0.00 33.47 30.41 1s6v s TRP 211 CO 0.05 0.36 -0.22 0.21 0.02 0.00 0.00 176.95 177.37 1s6v s LYS 212 N -0.74 2.87 -0.23 4.98 2.20 0.15 -4.88 119.74 124.09 1s6v s LYS 212 Ca 0.11 -0.85 -0.29 0.00 -0.36 0.00 0.00 55.97 54.59 1s6v s LYS 212 Cb -0.11 -2.30 0.01 0.00 -1.51 0.00 0.00 37.83 33.91 1s6v s LYS 212 CO 0.02 0.30 1.07 -1.17 -0.36 0.00 0.00 175.35 175.21 1s6v s LEU 213 N 0.07 4.09 0.16 5.43 0.20 -1.26 -0.98 118.68 126.38 1s6v s LEU 213 Ca -0.09 1.38 -0.12 0.00 0.69 0.00 0.00 54.13 55.99 1s6v s LEU 213 Cb -0.15 -3.54 0.01 0.00 -0.43 0.00 0.00 46.19 42.07 1s6v s LEU 213 CO 0.06 -0.71 0.36 -1.83 -0.29 0.00 0.00 176.35 173.94 1s6v s GLU 214 N 3.29 1.19 0.25 1.98 -1.05 -0.41 -4.97 118.70 118.99 1s6v s GLU 214 Ca 0.46 -1.02 -0.24 0.00 -0.15 0.00 0.00 54.97 54.01 1s6v s GLU 214 Cb -0.16 0.43 -0.09 0.00 -0.44 0.00 0.00 34.13 33.87 1s6v s GLU 214 CO 0.08 -0.46 0.84 0.15 0.95 0.00 0.00 175.26 176.82 1s6v s LYS 215 N -3.91 4.50 0.50 -4.83 1.02 -1.26 -0.84 119.74 114.91 1s6v s LYS 215 Ca 0.12 1.16 0.07 0.00 0.02 0.00 0.00 55.97 57.34 1s6v s LYS 215 Cb 0.02 -2.97 0.07 0.00 -0.52 0.00 0.00 37.83 34.43 1s6v s LYS 215 CO -0.03 0.40 0.55 0.27 -0.92 0.00 0.00 175.35 175.62 1s6v n ASN 216 N 0.92 2.16 0.02 2.83 0.23 0.27 -4.93 115.26 116.76 1s6v n ASN 216 Ca -0.01 -2.48 0.04 0.00 -0.53 0.00 0.00 54.58 51.59 1s6v n ASN 216 Cb 0.50 -0.22 0.20 0.00 -2.08 0.00 0.00 39.78 38.17 1s6v n ASN 216 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1s6v n ASP 217 N -2.16 0.10 -1.27 0.53 8.00 -1.26 -1.26 116.55 119.22 1s6v n ASP 217 Ca 0.07 0.54 0.12 0.00 0.71 0.00 0.00 54.79 56.23 1s6v n ASP 217 Cb 0.53 -0.55 0.28 0.00 -0.02 0.00 0.00 41.12 41.36 1s6v n ASP 217 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1s6v n ALA 218 N -1.55 2.40 -1.13 2.24 0.00 -1.26 -4.93 120.51 116.28 1s6v n ALA 218 Ca 0.01 -1.17 -0.04 0.00 0.00 0.00 0.00 53.44 52.24 1s6v n ALA 218 Cb 0.08 -0.92 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 1s6v n ALA 218 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1s6v n ASN 219 N 1.58 -4.02 -4.91 0.00 5.15 -0.39 -5.02 115.26 107.65 1s6v n ASN 219 Ca 0.22 0.11 -0.31 0.00 -0.60 0.00 0.00 54.58 54.01 1s6v n ASN 219 Cb 0.61 -1.91 -0.04 0.00 -0.53 0.00 0.00 39.78 37.91 1s6v n ASN 219 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1s6v s ASN 220 N -2.52 6.42 -0.03 1.20 0.01 -1.26 -4.83 114.94 113.94 1s6v s ASN 220 Ca 0.00 0.42 -0.13 0.00 -0.71 0.00 0.00 52.86 52.45 1s6v s ASN 220 Cb 0.00 -2.02 -0.05 0.00 0.41 0.00 0.00 41.25 39.59 1s6v s ASN 220 CO 0.00 0.08 0.34 -1.61 -1.51 0.00 0.00 177.10 174.41 1s6v s GLU 221 N -2.71 3.79 0.12 -0.60 2.02 -1.26 -0.57 118.70 119.49 1s6v s GLU 221 Ca 0.38 0.27 -0.04 0.00 0.02 0.00 0.00 54.97 55.61 1s6v s GLU 221 Cb -0.12 -3.21 -0.03 0.00 0.10 0.00 0.00 34.13 30.87 1s6v s GLU 221 CO 0.27 0.71 0.11 1.14 0.02 0.00 0.00 175.26 177.50 1s6v s GLN 222 N -1.09 0.91 -0.13 1.61 -2.07 -0.02 -4.67 119.66 114.20 1s6v s GLN 222 Ca 0.22 -1.28 -0.17 0.00 -1.82 0.00 0.00 55.36 52.31 1s6v s GLN 222 Cb -0.15 0.28 -0.04 0.00 -1.09 0.00 0.00 33.01 32.00 1s6v s GLN 222 CO 0.11 -0.27 0.41 -1.58 -1.32 0.00 0.00 175.29 172.65 1s6v s TRP 223 N -3.98 3.50 0.07 9.60 0.52 -0.64 -1.28 118.94 126.74 1s6v s TRP 223 Ca 0.17 0.80 0.09 0.00 0.02 0.00 0.00 56.10 57.17 1s6v s TRP 223 Cb 0.06 -2.47 -0.03 0.00 -1.15 0.00 0.00 33.47 29.88 1s6v s TRP 223 CO -0.02 0.21 -0.24 -0.51 0.02 0.00 0.00 176.95 176.40 1s6v s ASP 224 N 0.52 2.89 0.30 2.95 1.01 -0.16 -0.68 116.67 123.49 1s6v s ASP 224 Ca 0.23 -0.62 0.08 0.00 0.71 0.00 0.00 52.55 52.95 1s6v s ASP 224 Cb -0.14 -0.22 -0.04 0.00 1.01 0.00 0.00 42.92 43.52 1s6v s ASP 224 CO 0.08 0.18 0.11 -0.94 0.21 0.00 0.00 175.17 174.81 1s6v s SER 225 N -1.53 4.83 0.54 0.27 1.04 -0.67 -0.67 113.70 117.52 1s6v s SER 225 Ca 0.10 -0.61 0.29 0.00 0.48 0.00 0.00 55.95 56.22 1s6v s SER 225 Cb -0.10 -0.91 1.56 0.00 0.10 0.00 0.00 66.02 66.67 1s6v s SER 225 CO 0.03 -0.15 2.11 0.07 0.98 0.00 0.00 173.24 176.29 1s6v h LYS 226 N 1.64 0.00 0.00 4.02 2.10 -1.90 -2.28 116.57 120.15 1s6v h LYS 226 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1s6v h LYS 226 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 1s6v h LYS 226 CO 0.61 0.09 0.00 0.45 -2.00 0.00 0.00 179.45 178.60 1s6v n SER 227 N -3.58 0.00 0.00 7.07 2.88 -1.26 -4.89 113.62 113.84 1s6v n SER 227 Ca -0.02 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 1s6v n SER 227 Cb 0.21 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 1s6v n SER 227 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1s6v n GLY 228 N 0.82 0.86 3.97 0.46 0.00 -0.86 -5.08 105.19 105.36 1s6v n GLY 228 Ca 0.08 -0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 1s6v n GLY 228 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s6v s TYR 229 N -2.00 3.29 0.13 1.61 4.12 -1.26 -4.45 117.35 118.80 1s6v s TYR 229 Ca 0.00 0.02 -0.01 0.00 0.02 0.00 0.00 57.07 57.10 1s6v s TYR 229 Cb 0.00 -1.92 -0.04 0.00 -1.52 0.00 0.00 41.96 38.48 1s6v s TYR 229 CO 0.00 0.07 0.07 0.00 0.02 0.00 0.00 175.55 175.71 1s6v s MET 230 N -4.22 0.94 -0.01 -0.62 0.23 -0.03 -1.67 119.30 113.92 1s6v s MET 230 Ca 0.42 -1.43 -0.01 0.00 -1.03 0.00 0.00 55.69 53.64 1s6v s MET 230 Cb -0.09 0.25 0.01 0.00 -1.53 0.00 0.00 34.83 33.46 1s6v s MET 230 CO 0.33 -0.27 0.02 -1.64 -2.03 0.00 0.00 175.02 171.43 1s6v s MET 231 N -4.05 0.01 0.69 3.16 -1.94 0.14 -4.15 119.30 113.16 1s6v s MET 231 Ca 0.24 0.07 -0.11 0.00 -1.71 0.00 0.00 55.69 54.18 1s6v s MET 231 Cb 0.07 -0.05 0.01 0.00 2.01 0.00 0.00 34.83 36.87 1s6v s MET 231 CO 0.02 -0.04 1.06 -0.51 -0.01 0.00 0.00 175.02 175.54 1s6v s LEU 232 N 0.27 3.05 0.34 -0.03 1.43 -1.26 -1.61 118.68 120.87 1s6v s LEU 232 Ca -0.02 1.47 0.05 0.00 -1.03 0.00 0.00 54.13 54.61 1s6v s LEU 232 Cb -0.03 -4.34 0.71 0.00 0.03 0.00 0.00 46.19 42.55 1s6v s LEU 232 CO -0.01 -1.37 1.92 -0.65 0.23 0.00 0.00 176.35 176.46 1s6v h PRO 233 N -0.67 0.79 -0.29 1.29 0.11 -1.82 0.38 132.00 131.78 1s6v h PRO 233 Ca -0.44 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 1s6v h PRO 233 Cb 1.22 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1s6v h PRO 233 CO 0.59 0.52 -0.12 1.79 -0.21 0.00 0.00 178.00 180.57 1s6v h THR 234 N 0.81 1.23 -0.18 -1.15 1.35 -1.41 -0.97 112.91 112.59 1s6v h THR 234 Ca 0.38 -1.01 -0.05 0.00 -0.55 0.00 0.00 66.41 65.18 1s6v h THR 234 Cb 0.39 1.14 -0.00 0.00 -1.73 0.00 0.00 68.15 67.95 1s6v h THR 234 CO -0.15 0.33 -0.07 0.44 -0.25 0.00 0.00 175.52 175.82 1s6v h ASP 235 N 0.46 0.36 0.43 5.36 3.32 -1.39 -3.04 116.42 121.93 1s6v h ASP 235 Ca 0.09 -0.39 -0.03 0.00 0.02 0.00 0.00 57.03 56.71 1s6v h ASP 235 Cb 0.49 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.93 1s6v h ASP 235 CO 0.03 0.67 -0.16 0.22 -1.72 0.00 0.00 179.24 178.28 1s6v h TYR 236 N 0.05 0.00 0.00 4.55 5.03 -0.73 -1.78 116.97 124.09 1s6v h TYR 236 Ca 0.04 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.35 1s6v h TYR 236 Cb 0.53 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.81 1s6v h TYR 236 CO 0.06 0.16 0.00 0.66 -1.32 0.00 0.00 178.16 177.72 1s6v h SER 237 N 0.00 0.00 0.88 -2.11 4.64 -1.06 -1.33 113.55 114.57 1s6v h SER 237 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1s6v h SER 237 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1s6v h SER 237 CO 0.02 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.91 1s6v h LEU 238 N 0.00 0.00 -0.87 5.97 3.38 -1.42 -1.72 115.31 120.65 1s6v h LEU 238 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1s6v h LEU 238 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1s6v h LEU 238 CO 0.00 0.00 -0.15 2.30 0.09 0.00 0.00 178.44 180.68 1s6v n ILE 239 N -2.60 0.00 0.01 1.22 -5.35 -0.51 -1.52 119.36 110.60 1s6v n ILE 239 Ca 0.02 -0.42 -0.10 0.00 -0.27 0.00 0.00 62.75 61.98 1s6v n ILE 239 Cb 0.27 1.13 -0.13 0.00 -1.74 0.00 0.00 39.64 39.16 1s6v n ILE 239 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 1s6v h GLN 240 N 1.22 0.04 -5.73 6.28 4.20 -1.33 -3.45 115.11 116.34 1s6v h GLN 240 Ca 0.00 -0.07 -0.59 0.00 0.06 0.00 0.00 58.65 58.05 1s6v h GLN 240 Cb 0.34 0.03 -0.09 0.00 0.30 0.00 0.00 27.48 28.05 1s6v h GLN 240 CO 0.00 0.73 0.15 0.34 -0.67 0.00 0.00 178.83 179.38 1s6v s ASP 241 N -6.40 6.74 0.23 1.46 -1.08 -0.69 -4.98 116.67 111.95 1s6v s ASP 241 Ca -0.04 0.91 -0.07 0.00 -0.52 0.00 0.00 52.55 52.82 1s6v s ASP 241 Cb 0.08 -2.37 0.31 0.00 -1.46 0.00 0.00 42.92 39.49 1s6v s ASP 241 CO 0.82 -0.28 1.81 1.55 0.52 0.00 0.00 175.17 179.60 1s6v h PRO 242 N 7.40 0.72 -0.60 4.34 0.13 -1.91 0.16 132.00 142.25 1s6v h PRO 242 Ca -0.32 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 64.73 1s6v h PRO 242 Cb 1.14 -0.16 -0.03 0.00 0.13 0.00 0.00 31.00 32.09 1s6v h PRO 242 CO 0.78 0.48 0.22 0.87 -0.23 0.00 0.00 178.00 180.12 1s6v h LYS 243 N 0.74 0.91 -0.37 0.86 1.57 -1.94 -2.33 116.57 116.01 1s6v h LYS 243 Ca 0.34 -0.18 -0.15 0.00 -1.87 0.00 0.00 60.65 58.80 1s6v h LYS 243 Cb 0.26 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1s6v h LYS 243 CO -0.21 0.79 -0.35 1.88 -0.57 0.00 0.00 179.45 180.99 1s6v h TYR 244 N 0.84 1.07 -0.81 -1.35 0.99 -1.67 -3.16 116.97 112.87 1s6v h TYR 244 Ca 0.20 -0.32 0.09 0.00 2.00 0.00 0.00 58.73 60.70 1s6v h TYR 244 Cb 0.23 -0.23 -0.07 0.00 1.00 0.00 0.00 36.73 37.67 1s6v h TYR 244 CO 0.01 1.13 0.46 1.25 -0.00 0.00 0.00 178.16 181.01 1s6v h LEU 245 N 0.70 0.67 -0.88 3.88 5.85 0.39 -0.58 115.31 125.35 1s6v h LEU 245 Ca 0.06 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.89 1s6v h LEU 245 Cb 0.94 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.82 1s6v h LEU 245 CO 0.09 0.39 0.55 -1.28 -0.34 0.00 0.00 178.44 177.85 1s6v h SER 246 N 0.79 0.86 -0.02 1.25 0.87 -1.39 -0.40 113.55 115.51 1s6v h SER 246 Ca 0.38 0.02 -0.23 0.00 -1.23 0.00 0.00 61.79 60.73 1s6v h SER 246 Cb 0.32 -0.16 0.01 0.00 -0.44 0.00 0.00 62.40 62.13 1s6v h SER 246 CO -0.23 0.55 -0.85 0.40 -0.53 0.00 0.00 176.83 176.16 1s6v h ILE 247 N 0.99 1.30 -0.83 2.23 2.04 -1.33 -2.68 117.51 119.23 1s6v h ILE 247 Ca 0.38 -2.10 0.06 0.00 1.00 0.00 0.00 64.86 64.21 1s6v h ILE 247 Cb 0.18 2.13 -0.06 0.00 -0.74 0.00 0.00 36.82 38.33 1s6v h ILE 247 CO -0.18 0.65 0.50 0.58 0.00 0.00 0.00 178.15 179.71 1s6v h VAL 248 N 0.45 1.02 -0.63 1.67 2.07 -0.56 -1.04 116.25 119.22 1s6v h VAL 248 Ca -0.07 -0.31 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 1s6v h VAL 248 Cb 1.48 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 1s6v h VAL 248 CO 0.17 0.17 0.20 0.11 0.02 0.00 0.00 177.57 178.23 1s6v h LYS 249 N 0.91 0.96 -0.45 1.57 1.57 -1.01 0.06 116.57 120.19 1s6v h LYS 249 Ca 0.36 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1s6v h LYS 249 Cb 0.19 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1s6v h LYS 249 CO -0.18 0.83 0.26 1.49 -0.57 0.00 0.00 179.45 181.28 1s6v h GLU 250 N 0.93 0.61 -0.04 3.15 4.81 -0.88 -1.75 114.58 121.41 1s6v h GLU 250 Ca 0.21 -0.06 -0.19 0.00 -0.13 0.00 0.00 59.36 59.19 1s6v h GLU 250 Cb 0.27 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1s6v h GLU 250 CO -0.01 0.47 -0.78 1.88 -0.73 0.00 0.00 179.01 179.85 1s6v h TYR 251 N 0.59 0.44 -0.06 0.92 0.99 -0.94 -0.97 116.97 117.94 1s6v h TYR 251 Ca 0.16 -0.21 -0.06 0.00 2.00 0.00 0.00 58.73 60.62 1s6v h TYR 251 Cb 0.02 -0.06 -0.01 0.00 1.00 0.00 0.00 36.73 37.68 1s6v h TYR 251 CO -0.03 0.97 -0.23 0.00 -0.00 0.00 0.00 178.16 178.88 1s6v h ALA 252 N 0.96 1.51 0.00 3.88 0.00 -0.84 -2.84 119.26 121.94 1s6v h ALA 252 Ca -0.04 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1s6v h ALA 252 Cb 1.36 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1s6v h ALA 252 CO 0.13 0.36 -0.76 -0.97 0.00 0.00 0.00 179.25 178.01 1s6v h ASN 253 N 0.10 0.00 -2.15 0.00 -1.24 -1.09 -3.44 115.58 107.75 1s6v h ASN 253 Ca 0.02 -0.24 -0.46 0.00 0.71 0.00 0.00 56.30 56.33 1s6v h ASN 253 Cb 0.46 0.00 -0.34 0.00 0.73 0.00 0.00 38.32 39.17 1s6v h ASN 253 CO 0.03 0.12 -0.77 -0.62 -1.29 0.00 0.00 177.43 174.90 1s6v s ASP 254 N -4.25 1.60 0.37 1.15 -1.08 -0.39 -5.01 116.67 109.07 1s6v s ASP 254 Ca 0.05 -2.02 0.05 0.00 -0.52 0.00 0.00 52.55 50.11 1s6v s ASP 254 Cb 0.13 0.19 0.73 0.00 -1.46 0.00 0.00 42.92 42.51 1s6v s ASP 254 CO 0.75 -0.25 1.99 -0.61 0.52 0.00 0.00 175.17 177.57 1s6v h GLN 255 N 6.70 0.73 -0.85 4.34 4.15 -1.85 -1.97 115.11 126.36 1s6v h GLN 255 Ca 0.09 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.43 1s6v h GLN 255 Cb 1.01 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.50 1s6v h GLN 255 CO 0.23 0.48 0.41 -0.44 -1.93 0.00 0.00 178.83 177.58 1s6v h ASP 256 N 0.75 1.12 -0.13 -0.69 3.32 -1.95 0.21 116.42 119.06 1s6v h ASP 256 Ca 0.26 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1s6v h ASP 256 Cb 0.11 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1s6v h ASP 256 CO -0.08 0.94 0.04 0.50 -1.72 0.00 0.00 179.24 178.93 1s6v h LYS 257 N 1.22 0.20 -0.57 3.56 1.63 -1.77 -0.48 116.57 120.36 1s6v h LYS 257 Ca 0.29 -0.04 0.07 0.00 -0.85 0.00 0.00 60.65 60.12 1s6v h LYS 257 Cb 0.12 -0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 31.66 1s6v h LYS 257 CO -0.04 0.32 0.25 0.35 -3.45 0.00 0.00 179.45 176.89 1s6v h PHE 258 N 0.04 0.46 -0.31 1.91 3.57 -1.01 -1.24 116.94 120.35 1s6v h PHE 258 Ca 0.04 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.59 1s6v h PHE 258 Cb 0.20 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 1s6v h PHE 258 CO -0.01 0.17 0.15 0.74 -2.23 0.00 0.00 178.31 177.14 1s6v h PHE 259 N 0.47 0.28 -0.67 0.41 -1.00 -0.16 0.16 116.94 116.43 1s6v h PHE 259 Ca 0.27 0.01 -0.02 0.00 2.81 0.00 0.00 57.97 61.04 1s6v h PHE 259 Cb 0.26 -0.08 -0.03 0.00 3.61 0.00 0.00 35.95 39.71 1s6v h PHE 259 CO -0.13 0.15 0.33 0.87 -1.61 0.00 0.00 178.31 177.92 1s6v h LYS 260 N 0.32 0.97 -0.28 1.51 1.57 -0.61 -1.29 116.57 118.76 1s6v h LYS 260 Ca 0.13 -0.14 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 1s6v h LYS 260 Cb 0.05 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.18 1s6v h LYS 260 CO -0.09 0.76 -0.49 -0.44 -0.57 0.00 0.00 179.45 178.62 1s6v h ASP 261 N 0.93 0.84 -0.41 0.86 3.32 -0.94 -2.81 116.42 118.21 1s6v h ASP 261 Ca 0.23 -0.42 -0.06 0.00 0.02 0.00 0.00 57.03 56.81 1s6v h ASP 261 Cb 0.11 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1s6v h ASP 261 CO -0.03 1.18 0.04 0.15 -1.72 0.00 0.00 179.24 178.86 1s6v h PHE 262 N 0.60 0.75 -0.21 4.55 3.57 -0.54 -1.51 116.94 124.16 1s6v h PHE 262 Ca 0.03 -0.11 0.04 0.00 3.53 0.00 0.00 57.97 61.45 1s6v h PHE 262 Cb 1.06 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 1s6v h PHE 262 CO 0.06 0.74 -0.01 1.03 -2.23 0.00 0.00 178.31 177.90 1s6v h SER 263 N 0.54 -0.11 -0.47 0.41 0.87 -1.16 0.40 113.55 114.03 1s6v h SER 263 Ca 0.12 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.70 1s6v h SER 263 Cb 0.41 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.45 1s6v h SER 263 CO 0.01 -0.03 0.15 0.11 -0.53 0.00 0.00 176.83 176.55 1s6v h LYS 264 N 0.05 0.73 -0.28 2.24 1.57 -1.42 -1.06 116.57 118.40 1s6v h LYS 264 Ca 0.10 -0.15 -0.12 0.00 -1.87 0.00 0.00 60.65 58.60 1s6v h LYS 264 Cb 0.13 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1s6v h LYS 264 CO -0.18 0.69 -0.33 0.00 -0.57 0.00 0.00 179.45 179.07 1s6v h ALA 265 N 1.01 0.90 -0.17 3.86 0.00 -0.88 -1.41 119.26 122.57 1s6v h ALA 265 Ca 0.15 -0.40 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1s6v h ALA 265 Cb 0.26 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1s6v h ALA 265 CO -0.01 0.63 -0.17 0.35 0.00 0.00 0.00 179.25 180.05 1s6v h PHE 266 N 0.52 0.49 -0.98 0.00 -0.00 -0.09 0.12 116.94 117.00 1s6v h PHE 266 Ca 0.06 -0.15 0.02 0.00 -0.00 0.00 0.00 57.97 57.90 1s6v h PHE 266 Cb 0.82 -0.10 -0.05 0.00 -0.00 0.00 0.00 35.95 36.61 1s6v h PHE 266 CO 0.03 0.78 0.65 1.49 -0.00 0.00 0.00 178.31 181.26 1s6v h GLU 267 N 0.05 1.26 -0.24 1.11 4.81 -1.13 -0.79 114.58 119.65 1s6v h GLU 267 Ca 0.03 -0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1s6v h GLU 267 Cb 0.70 -0.28 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 1s6v h GLU 267 CO 0.04 0.83 0.11 -0.22 -0.73 0.00 0.00 179.01 179.04 1s6v h LYS 268 N 1.30 0.23 -0.50 1.92 3.64 -0.94 -0.66 116.57 121.55 1s6v h LYS 268 Ca 0.37 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.80 1s6v h LYS 268 Cb -0.10 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.61 1s6v h LYS 268 CO -0.09 0.15 0.19 1.25 -2.27 0.00 0.00 179.45 178.67 1s6v h LEU 269 N 0.23 0.20 -0.67 5.20 5.85 -0.15 -0.07 115.31 125.90 1s6v h LEU 269 Ca 0.10 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1s6v h LEU 269 Cb 0.04 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1s6v h LEU 269 CO -0.08 0.14 0.00 -0.07 -0.34 0.00 0.00 178.44 178.09 1s6v h LEU 270 N 0.37 0.00 -0.70 2.25 3.38 -0.61 -3.14 115.31 116.86 1s6v h LEU 270 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1s6v h LEU 270 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1s6v h LEU 270 CO -0.24 0.00 -0.30 -0.62 0.09 0.00 0.00 178.44 177.37 1s6v n GLU 271 N -2.31 2.06 -1.65 1.13 1.02 -0.31 -4.72 120.64 115.86 1s6v n GLU 271 Ca 0.02 -0.60 -0.45 0.00 -0.02 0.00 0.00 57.16 56.11 1s6v n GLU 271 Cb 0.26 -1.15 -0.03 0.00 -0.02 0.00 0.00 31.44 30.50 1s6v n GLU 271 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1s6v n ASN 272 N -0.34 2.47 0.00 1.62 3.02 -0.13 -1.55 115.26 120.34 1s6v n ASN 272 Ca 0.05 1.15 0.00 0.00 -0.03 0.00 0.00 54.58 55.75 1s6v n ASN 272 Cb 0.25 -1.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.03 1s6v n ASN 272 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1s6v n GLY 273 N 1.98 1.35 3.73 7.41 0.00 -1.26 -4.40 105.19 114.00 1s6v n GLY 273 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1s6v n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s6v s ILE 274 N -2.98 5.35 -0.34 -0.61 1.01 -0.60 -4.22 121.20 118.81 1s6v s ILE 274 Ca 0.00 0.17 -0.13 0.00 0.00 0.00 0.00 60.65 60.68 1s6v s ILE 274 Cb 0.00 -3.43 -0.02 0.00 0.01 0.00 0.00 42.46 39.03 1s6v s ILE 274 CO 0.00 0.46 0.25 -0.89 0.00 0.00 0.00 174.94 174.76 1s6v s THR 275 N 0.22 5.27 -0.22 2.92 2.01 0.75 -4.97 115.64 121.61 1s6v s THR 275 Ca 0.08 -0.18 -0.14 0.00 0.31 0.00 0.00 61.69 61.76 1s6v s THR 275 Cb -0.11 -3.72 -0.04 0.00 0.01 0.00 0.00 72.50 68.63 1s6v s THR 275 CO -0.01 -0.02 0.33 -0.36 -0.69 0.00 0.00 174.62 173.87 1s6v s PHE 276 N 1.76 3.34 0.59 4.92 0.40 -1.26 -1.03 117.98 126.69 1s6v s PHE 276 Ca 0.07 0.48 -0.19 0.00 -0.60 0.00 0.00 56.93 56.68 1s6v s PHE 276 Cb -0.17 -2.47 -0.04 0.00 0.51 0.00 0.00 43.02 40.85 1s6v s PHE 276 CO 0.11 -0.02 1.10 -2.30 0.70 0.00 0.00 175.22 174.80 1s6v n PRO 277 N 4.56 1.10 0.30 0.24 -0.02 -1.26 -4.83 135.00 135.09 1s6v n PRO 277 Ca -0.10 0.42 0.17 0.00 -2.02 0.00 0.00 63.50 61.97 1s6v n PRO 277 Cb 0.51 -2.30 0.95 0.00 -0.02 0.00 0.00 33.50 32.64 1s6v n PRO 277 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1s6v h LYS 278 N 0.71 0.00 -0.01 -0.52 1.57 -2.02 -0.74 116.57 115.56 1s6v h LYS 278 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1s6v h LYS 278 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1s6v h LYS 278 CO 0.53 0.03 -0.18 -0.40 -0.57 0.00 0.00 179.45 178.86 1s6v n ASP 279 N -3.52 1.65 -4.63 0.86 5.75 -1.26 -4.96 116.55 110.44 1s6v n ASP 279 Ca -0.02 -1.36 -0.37 0.00 -0.01 0.00 0.00 54.79 53.03 1s6v n ASP 279 Cb 0.13 0.13 0.07 0.00 -1.03 0.00 0.00 41.12 40.43 1s6v n ASP 279 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1s6v n ALA 280 N 0.02 0.07 -1.16 2.12 0.00 -0.29 -4.93 120.51 116.35 1s6v n ALA 280 Ca 0.14 -0.10 -0.32 0.00 0.00 0.00 0.00 53.44 53.16 1s6v n ALA 280 Cb 0.41 -2.14 0.11 0.00 0.00 0.00 0.00 19.45 17.83 1s6v n ALA 280 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1s6v s PRO 281 N -3.14 1.95 0.69 0.00 0.04 -1.26 -4.98 135.00 128.30 1s6v s PRO 281 Ca 0.76 1.47 -0.13 0.00 0.04 0.00 0.00 61.00 63.14 1s6v s PRO 281 Cb -0.37 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 32.34 1s6v s PRO 281 CO 0.48 -1.92 1.08 -1.54 0.04 0.00 0.00 177.00 175.13 1s6v s SER 282 N -2.71 5.18 0.50 6.66 1.04 -1.26 -4.95 113.70 118.16 1s6v s SER 282 Ca 0.67 1.78 -0.22 0.00 0.48 0.00 0.00 55.95 58.67 1s6v s SER 282 Cb -0.22 -2.52 -0.08 0.00 0.10 0.00 0.00 66.02 63.30 1s6v s SER 282 CO 0.51 -1.58 0.99 -0.81 0.98 0.00 0.00 173.24 173.34 1s6v n PRO 283 N -2.87 1.19 -3.34 4.02 -0.04 -1.26 -4.97 135.00 127.72 1s6v n PRO 283 Ca 0.09 0.44 -0.34 0.00 -0.04 0.00 0.00 63.50 63.64 1s6v n PRO 283 Cb 0.53 -2.11 -0.06 0.00 -0.04 0.00 0.00 33.50 31.83 1s6v n PRO 283 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1s6v s PHE 284 N -1.39 3.56 -0.29 0.54 2.99 0.39 -4.79 117.98 119.00 1s6v s PHE 284 Ca 0.68 1.05 0.03 0.00 0.00 0.00 0.00 56.93 58.69 1s6v s PHE 284 Cb -0.49 -2.37 0.08 0.00 0.00 0.00 0.00 43.02 40.23 1s6v s PHE 284 CO 0.53 0.37 -0.03 0.42 -0.00 0.00 0.00 175.22 176.52 1s6v s ILE 285 N -1.57 1.98 0.38 0.64 1.01 -1.26 -0.72 121.20 121.66 1s6v s ILE 285 Ca 0.41 -1.78 -0.24 0.00 0.00 0.00 0.00 60.65 59.03 1s6v s ILE 285 Cb -0.14 -2.28 -0.09 0.00 0.01 0.00 0.00 42.46 39.96 1s6v s ILE 285 CO 0.20 -0.29 1.03 -0.36 0.00 0.00 0.00 174.94 175.51 1s6v s PHE 286 N 1.13 3.36 0.23 3.97 0.40 -1.26 -5.02 117.98 120.79 1s6v s PHE 286 Ca 0.00 1.67 -0.30 0.00 -0.60 0.00 0.00 56.93 57.70 1s6v s PHE 286 Cb -0.19 -3.08 -0.09 0.00 0.51 0.00 0.00 43.02 40.17 1s6v s PHE 286 CO -0.08 -0.45 0.95 0.15 0.70 0.00 0.00 175.22 176.50 1s6v s LYS 287 N -2.40 4.83 0.84 0.44 1.02 -1.26 -4.99 119.74 118.22 1s6v s LYS 287 Ca 0.56 1.51 -0.12 0.00 0.02 0.00 0.00 55.97 57.95 1s6v s LYS 287 Cb -0.21 -3.28 0.09 0.00 -0.52 0.00 0.00 37.83 33.91 1s6v s LYS 287 CO 0.27 0.48 1.10 0.95 -0.92 0.00 0.00 175.35 177.23 1s6v s THR 288 N -1.10 2.80 0.16 2.17 -4.23 -1.26 -4.91 115.64 109.28 1s6v s THR 288 Ca 0.42 0.26 -0.15 0.00 -1.18 0.00 0.00 61.69 61.04 1s6v s THR 288 Cb -0.26 -2.96 0.04 0.00 1.34 0.00 0.00 72.50 70.65 1s6v s THR 288 CO 0.33 -0.34 1.77 -0.07 -0.54 0.00 0.00 174.62 175.77 1s6v h LEU 289 N -1.24 0.60 -0.51 4.79 3.38 -1.96 -2.30 115.31 118.07 1s6v h LEU 289 Ca -0.48 -0.08 0.09 0.00 0.09 0.00 0.00 57.88 57.50 1s6v h LEU 289 Cb 1.28 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.80 1s6v h LEU 289 CO 0.59 0.51 0.07 -0.08 0.09 0.00 0.00 178.44 179.62 1s6v h GLU 290 N 0.65 0.19 0.00 1.13 4.81 -1.93 0.39 114.58 119.82 1s6v h GLU 290 Ca 0.17 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1s6v h GLU 290 Cb 0.03 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1s6v h GLU 290 CO -0.03 0.12 0.00 0.39 -0.73 0.00 0.00 179.01 178.77 1s6v n GLU 291 N -5.16 0.14 -0.30 1.92 1.02 -0.91 -1.14 120.64 116.22 1s6v n GLU 291 Ca 0.06 0.51 0.11 0.00 -0.02 0.00 0.00 57.16 57.82 1s6v n GLU 291 Cb 0.26 -1.85 0.28 0.00 -0.02 0.00 0.00 31.44 30.11 1s6v n GLU 291 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1s6v n GLN 292 N -2.14 2.53 -2.52 3.49 6.02 0.08 -4.94 117.38 119.91 1s6v n GLN 292 Ca 0.01 -2.36 -0.01 0.00 -0.01 0.00 0.00 57.00 54.63 1s6v n GLN 292 Cb 0.12 -1.52 0.00 0.00 1.02 0.00 0.00 30.24 29.87 1s6v n GLN 292 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1s6v n GLY 293 N 1.55 0.82 0.00 1.08 0.00 -0.29 -5.07 105.19 103.28 1s6v n GLY 293 Ca 0.22 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1s6v n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36