#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i6k s THR 3 N 0.00 1.82 -0.01 -0.18 2.01 -1.26 -0.98 115.64 117.03 1i6k s THR 3 Ca 0.00 -0.97 0.08 0.00 0.31 0.00 0.00 61.69 61.11 1i6k s THR 3 Cb 0.00 -1.52 -0.02 0.00 0.01 0.00 0.00 72.50 70.96 1i6k s THR 3 CO 0.00 0.51 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.56 1i6k s ILE 4 N -0.37 2.16 -0.01 1.82 1.01 0.87 -0.91 121.20 125.75 1i6k s ILE 4 Ca 0.04 -1.11 0.02 0.00 0.00 0.00 0.00 60.65 59.60 1i6k s ILE 4 Cb -0.10 -1.76 -0.00 0.00 0.01 0.00 0.00 42.46 40.60 1i6k s ILE 4 CO 0.01 0.55 -0.08 0.12 0.00 0.00 0.00 174.94 175.54 1i6k s PHE 5 N -0.65 0.78 -0.07 3.97 5.36 -1.06 -0.77 117.98 125.54 1i6k s PHE 5 Ca 0.10 -0.17 -0.26 0.00 -0.96 0.00 0.00 56.93 55.65 1i6k s PHE 5 Cb -0.10 -0.54 0.06 0.00 -0.34 0.00 0.00 43.02 42.10 1i6k s PHE 5 CO -0.00 -0.05 0.58 0.45 -1.46 0.00 0.00 175.22 174.74 1i6k s SER 6 N -0.01 -0.55 0.17 6.13 0.15 -0.67 -4.11 113.70 114.82 1i6k s SER 6 Ca 0.00 0.65 0.07 0.00 0.70 0.00 0.00 55.95 57.37 1i6k s SER 6 Cb -0.05 0.59 -0.04 0.00 -1.71 0.00 0.00 66.02 64.81 1i6k s SER 6 CO -0.00 -0.51 -0.14 -0.83 1.20 0.00 0.00 173.24 172.96 1i6k s GLY 7 N -1.00 1.26 -0.02 9.45 0.00 -1.26 -1.37 107.32 114.38 1i6k s GLY 7 Ca -0.10 -1.52 -0.01 0.00 0.00 0.00 0.00 44.72 43.09 1i6k s GLY 7 CO 0.07 -1.61 0.05 -0.42 0.00 0.00 0.00 173.10 171.20 1i6k s ILE 8 N -2.78 -0.02 0.26 0.90 1.01 -0.81 -4.97 121.20 114.80 1i6k s ILE 8 Ca 0.17 0.08 -0.30 0.00 0.00 0.00 0.00 60.65 60.61 1i6k s ILE 8 Cb -0.01 -0.09 -0.09 0.00 0.01 0.00 0.00 42.46 42.27 1i6k s ILE 8 CO 0.04 0.03 1.11 -1.10 0.00 0.00 0.00 174.94 175.03 1i6k s GLN 9 N 0.46 4.62 -0.07 2.79 -0.21 -1.26 -1.85 119.66 124.14 1i6k s GLN 9 Ca -0.04 1.80 -0.30 0.00 0.02 0.00 0.00 55.36 56.85 1i6k s GLN 9 Cb -0.05 -3.20 -0.03 0.00 1.00 0.00 0.00 33.01 30.72 1i6k s GLN 9 CO -0.02 0.17 1.19 -1.25 -2.12 0.00 0.00 175.29 173.27 1i6k s PRO 10 N -1.21 4.35 0.26 2.91 0.04 -1.26 -4.92 135.00 135.16 1i6k s PRO 10 Ca 0.46 1.65 -0.10 0.00 0.04 0.00 0.00 61.00 63.04 1i6k s PRO 10 Cb -0.32 -3.57 -0.00 0.00 0.04 0.00 0.00 34.50 30.65 1i6k s PRO 10 CO 0.40 -0.46 0.46 -1.54 0.04 0.00 0.00 177.00 175.90 1i6k s SER 11 N 1.49 0.09 0.53 6.66 1.04 -1.26 -4.86 113.70 117.39 1i6k s SER 11 Ca 0.55 -1.06 0.28 0.00 0.48 0.00 0.00 55.95 56.20 1i6k s SER 11 Cb -0.24 0.59 1.52 0.00 0.10 0.00 0.00 66.02 67.99 1i6k s SER 11 CO 0.21 -1.16 2.10 1.23 0.98 0.00 0.00 173.24 176.60 1i6k h GLY 12 N 2.25 0.00 -7.26 7.32 0.00 -1.94 -3.40 103.07 100.04 1i6k h GLY 12 Ca -0.27 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.48 1i6k h GLY 12 CO 0.37 0.00 -0.79 0.14 0.00 0.00 0.00 176.54 176.27 1i6k s VAL 13 N -4.25 1.25 -0.26 4.60 1.01 -1.26 -5.08 120.40 116.41 1i6k s VAL 13 Ca -0.03 -0.87 -0.07 0.00 0.00 0.00 0.00 61.98 61.01 1i6k s VAL 13 Cb 0.13 -1.48 -0.02 0.00 0.00 0.00 0.00 36.38 35.02 1i6k s VAL 13 CO 0.58 0.02 0.06 -0.63 0.00 0.00 0.00 175.10 175.13 1i6k s ILE 14 N 1.55 4.13 0.46 2.22 -1.09 -1.26 -4.75 121.20 122.46 1i6k s ILE 14 Ca -0.02 -0.35 0.04 0.00 -2.23 0.00 0.00 60.65 58.09 1i6k s ILE 14 Cb -0.17 -2.99 0.01 0.00 -1.58 0.00 0.00 42.46 37.74 1i6k s ILE 14 CO -0.07 0.27 0.65 0.42 -1.23 0.00 0.00 174.94 174.98 1i6k s THR 15 N 1.57 3.14 -0.28 2.92 -4.23 -1.26 -1.19 115.64 116.31 1i6k s THR 15 Ca 0.05 -0.81 0.27 0.00 -1.18 0.00 0.00 61.69 60.03 1i6k s THR 15 Cb -0.16 -3.12 0.31 0.00 1.34 0.00 0.00 72.50 70.87 1i6k s THR 15 CO 0.03 -0.06 1.81 0.16 -0.54 0.00 0.00 174.62 176.02 1i6k h ILE 16 N 0.42 0.00 -0.41 2.99 3.07 -1.15 -1.67 117.51 120.76 1i6k h ILE 16 Ca -0.42 -0.37 -0.07 0.00 1.55 0.00 0.00 64.86 65.55 1i6k h ILE 16 Cb 1.28 1.22 -0.01 0.00 -0.27 0.00 0.00 36.82 39.03 1i6k h ILE 16 CO 0.50 0.00 -0.01 1.23 -1.05 0.00 0.00 178.15 178.83 1i6k h GLY 17 N 2.34 0.79 1.00 0.16 0.00 -1.93 -0.41 103.07 105.03 1i6k h GLY 17 Ca 0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 46.72 1i6k h GLY 17 CO 0.00 0.54 0.33 3.43 0.00 0.00 0.00 176.54 180.84 1i6k h ASN 18 N 0.56 0.87 0.29 0.19 -0.26 -1.73 0.62 115.58 116.12 1i6k h ASN 18 Ca 0.12 -0.12 -0.01 0.00 -0.56 0.00 0.00 56.30 55.72 1i6k h ASN 18 Cb 0.49 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 37.53 1i6k h ASN 18 CO 0.02 0.75 -0.14 0.22 -1.06 0.00 0.00 177.43 177.23 1i6k h TYR 19 N 0.93 -0.36 -0.29 1.19 3.20 -1.16 -1.43 116.97 119.05 1i6k h TYR 19 Ca 0.23 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.99 1i6k h TYR 19 Cb 0.10 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 1i6k h TYR 19 CO 0.00 -0.14 -0.23 0.82 -1.64 0.00 0.00 178.16 176.98 1i6k h ILE 20 N -0.51 1.30 0.00 1.81 2.04 -1.00 0.27 117.51 121.42 1i6k h ILE 20 Ca -0.04 -1.37 -0.12 0.00 1.00 0.00 0.00 64.86 64.33 1i6k h ILE 20 Cb 0.38 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 1i6k h ILE 20 CO 0.06 0.44 -0.58 1.23 0.00 0.00 0.00 178.15 179.30 1i6k h GLY 21 N 0.40 0.00 0.00 5.37 0.00 -0.92 -3.43 103.07 104.50 1i6k h GLY 21 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1i6k h GLY 21 CO 0.06 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.60 1i6k n ALA 22 N -2.31 3.00 -0.35 3.60 0.00 -0.59 -3.50 120.51 120.35 1i6k n ALA 22 Ca 0.00 0.00 0.24 0.00 0.00 0.00 0.00 53.44 53.68 1i6k n ALA 22 Cb 0.68 0.00 0.49 0.00 0.00 0.00 0.00 19.45 20.62 1i6k n ALA 22 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1i6k h LEU 23 N 0.00 0.49 -1.01 0.00 3.38 -1.24 0.40 115.31 117.33 1i6k h LEU 23 Ca 0.00 0.13 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 1i6k h LEU 23 Cb 0.00 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1i6k h LEU 23 CO 0.00 -0.00 -0.04 -0.09 0.09 0.00 0.00 178.44 178.40 1i6k h ARG 24 N 0.38 0.67 -0.38 1.13 2.43 -1.20 -2.05 114.38 115.36 1i6k h ARG 24 Ca 0.68 -0.18 -0.08 0.00 -0.81 0.00 0.00 59.98 59.59 1i6k h ARG 24 Cb 1.63 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 31.09 1i6k h ARG 24 CO -0.44 0.72 -0.07 1.96 -1.51 0.00 0.00 179.97 180.63 1i6k h GLN 25 N 0.63 0.72 -0.11 0.20 4.20 -0.49 -2.16 115.11 118.10 1i6k h GLN 25 Ca 0.12 -0.26 0.03 0.00 0.06 0.00 0.00 58.65 58.60 1i6k h GLN 25 Cb 0.45 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 1i6k h GLN 25 CO 0.02 0.85 -0.07 0.74 -0.67 0.00 0.00 178.83 179.70 1i6k h PHE 26 N 0.53 -0.17 -0.57 2.96 0.04 -0.66 -0.18 116.94 118.89 1i6k h PHE 26 Ca 0.10 0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.83 1i6k h PHE 26 Cb 0.57 0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.79 1i6k h PHE 26 CO 0.05 -0.11 0.16 0.28 -0.60 0.00 0.00 178.31 178.08 1i6k h VAL 27 N -0.07 1.23 -0.59 -0.55 2.07 -1.40 -0.45 116.25 116.48 1i6k h VAL 27 Ca 0.07 -0.81 -0.07 0.00 0.82 0.00 0.00 66.70 66.72 1i6k h VAL 27 Cb 0.18 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1i6k h VAL 27 CO -0.16 0.30 0.10 -0.08 0.02 0.00 0.00 177.57 177.76 1i6k h GLU 28 N 0.84 0.96 0.00 1.57 4.81 -0.77 -3.29 114.58 118.71 1i6k h GLU 28 Ca 0.19 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1i6k h GLU 28 Cb 0.28 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1i6k h GLU 28 CO -0.00 0.91 -1.16 1.28 -0.73 0.00 0.00 179.01 179.30 1i6k n LEU 29 N -4.33 0.68 -0.32 1.64 4.77 -0.13 -4.56 117.00 114.75 1i6k n LEU 29 Ca 0.03 0.24 0.33 0.00 -0.03 0.00 0.00 56.01 56.58 1i6k n LEU 29 Cb 0.27 -0.06 0.70 0.00 -2.33 0.00 0.00 43.42 42.00 1i6k n LEU 29 CO 0.42 -0.13 1.30 0.06 -1.33 0.00 0.00 177.39 177.70 1i6k h GLN 30 N 0.00 0.08 0.00 3.23 3.07 -1.15 -2.08 115.11 118.26 1i6k h GLN 30 Ca 0.00 -0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.66 1i6k h GLN 30 Cb 0.97 -0.02 -0.01 0.00 0.08 0.00 0.00 27.48 28.50 1i6k h GLN 30 CO 0.00 0.05 -0.63 0.45 0.09 0.00 0.00 178.83 178.79 1i6k h HIS 31 N 0.08 0.00 0.00 0.06 3.86 -1.83 -3.36 115.15 113.97 1i6k h HIS 31 Ca 0.57 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.78 1i6k h HIS 31 Cb 2.10 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.57 1i6k h HIS 31 CO -0.00 0.34 -0.64 0.39 0.86 0.00 0.00 177.93 178.87 1i6k n GLU 32 N -3.06 0.11 -4.20 2.45 4.71 -0.79 -4.97 120.64 114.88 1i6k n GLU 32 Ca -0.00 0.02 -0.12 0.00 -0.01 0.00 0.00 57.16 57.05 1i6k n GLU 32 Cb 0.69 -1.55 -0.10 0.00 -1.01 0.00 0.00 31.44 29.46 1i6k n GLU 32 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1i6k s TYR 33 N -3.07 1.04 -0.13 -0.32 1.51 -1.16 -4.66 117.35 110.57 1i6k s TYR 33 Ca 0.09 -1.03 -0.28 0.00 -1.01 0.00 0.00 57.07 54.84 1i6k s TYR 33 Cb 0.16 -0.60 -0.01 0.00 -0.11 0.00 0.00 41.96 41.40 1i6k s TYR 33 CO 0.73 -0.25 0.97 -0.80 -1.11 0.00 0.00 175.55 175.09 1i6k s ASN 34 N -3.11 7.17 -0.05 2.29 0.01 -0.15 -4.85 114.94 116.25 1i6k s ASN 34 Ca 0.20 1.44 0.06 0.00 -0.71 0.00 0.00 52.86 53.85 1i6k s ASN 34 Cb 0.06 -2.53 -0.01 0.00 0.41 0.00 0.00 41.25 39.18 1i6k s ASN 34 CO 0.01 -0.45 -0.23 0.00 -1.51 0.00 0.00 177.10 174.92 1i6k s TYR 36 N -0.17 2.00 -0.13 0.00 1.51 0.05 -0.51 117.35 120.10 1i6k s TYR 36 Ca -0.02 -1.27 0.03 0.00 -1.01 0.00 0.00 57.07 54.79 1i6k s TYR 36 Cb -0.13 -1.46 0.01 0.00 -0.11 0.00 0.00 41.96 40.27 1i6k s TYR 36 CO 0.03 -0.66 -0.22 -0.06 -1.11 0.00 0.00 175.55 173.53 1i6k s PHE 37 N 1.53 2.59 0.05 2.71 2.99 0.44 -1.67 117.98 126.63 1i6k s PHE 37 Ca 0.00 -1.26 0.09 0.00 0.00 0.00 0.00 56.93 55.77 1i6k s PHE 37 Cb -0.15 -1.76 -0.03 0.00 0.00 0.00 0.00 43.02 41.07 1i6k s PHE 37 CO -0.08 -0.57 -0.26 0.00 -0.00 0.00 0.00 175.22 174.31 1i6k s ILE 39 N -0.82 5.16 -1.29 0.00 1.01 -0.12 -1.91 121.20 123.22 1i6k s ILE 39 Ca 0.12 -1.37 -0.12 0.00 0.00 0.00 0.00 60.65 59.28 1i6k s ILE 39 Cb -0.10 -4.33 -0.06 0.00 0.01 0.00 0.00 42.46 37.99 1i6k s ILE 39 CO 0.02 -0.86 2.40 1.33 0.00 0.00 0.00 174.94 177.84 1i6k n VAL 40 N 5.28 3.27 -0.04 2.92 0.24 -0.77 -1.14 118.33 128.09 1i6k n VAL 40 Ca -0.13 -2.31 -0.02 0.00 -2.04 0.00 0.00 64.34 59.85 1i6k n VAL 40 Cb 0.41 -2.47 0.25 0.00 -1.47 0.00 0.00 33.84 30.56 1i6k n VAL 40 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 1i6k h ASP 41 N 6.04 0.59 0.13 -1.34 2.03 -1.94 0.25 116.42 122.18 1i6k h ASP 41 Ca 0.63 -0.12 -0.07 0.00 -0.73 0.00 0.00 57.03 56.74 1i6k h ASP 41 Cb 0.42 -0.15 -0.01 0.00 -0.83 0.00 0.00 39.33 38.76 1i6k h ASP 41 CO 1.77 0.65 -0.26 1.56 -1.03 0.00 0.00 179.24 181.94 1i6k h GLN 42 N 0.59 0.22 -0.18 4.15 4.20 -1.94 -1.73 115.11 120.41 1i6k h GLN 42 Ca 0.12 -0.07 -0.17 0.00 0.06 0.00 0.00 58.65 58.59 1i6k h GLN 42 Cb 0.37 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 1i6k h GLN 42 CO 0.01 0.47 -0.60 0.45 -0.67 0.00 0.00 178.83 178.49 1i6k h HIS 43 N 0.20 0.77 -0.99 2.96 3.86 -1.82 -3.16 115.15 116.98 1i6k h HIS 43 Ca 0.03 -0.29 0.11 0.00 -1.16 0.00 0.00 60.37 59.06 1i6k h HIS 43 Cb 0.57 -0.14 -0.08 0.00 1.06 0.00 0.00 27.41 28.82 1i6k h HIS 43 CO 0.01 1.05 0.62 0.00 0.86 0.00 0.00 177.93 180.47 1i6k h ALA 44 N 0.88 1.46 0.00 2.45 0.00 -0.08 -1.33 119.26 122.64 1i6k h ALA 44 Ca -0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1i6k h ALA 44 Cb 1.17 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1i6k h ALA 44 CO 0.12 0.24 0.00 0.44 0.00 0.00 0.00 179.25 180.05 1i6k n ILE 45 N -4.62 0.00 0.31 0.00 -5.35 -0.93 -2.99 119.36 105.78 1i6k n ILE 45 Ca 0.18 0.00 0.14 0.00 -0.27 0.00 0.00 62.75 62.80 1i6k n ILE 45 Cb 0.32 -0.41 0.65 0.00 -1.74 0.00 0.00 39.64 38.46 1i6k n ILE 45 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1i6k h THR 46 N 0.00 0.00 -3.38 7.28 1.35 -1.35 -3.40 112.91 113.41 1i6k h THR 46 Ca 0.00 -0.22 -0.53 0.00 -0.55 0.00 0.00 66.41 65.11 1i6k h THR 46 Cb 0.00 0.99 -0.18 0.00 -1.73 0.00 0.00 68.15 67.23 1i6k h THR 46 CO 0.00 0.00 -0.79 0.68 -0.25 0.00 0.00 175.52 175.16 1i6k s VAL 47 N -3.55 1.82 0.31 6.82 -7.23 -1.16 -4.18 120.40 113.23 1i6k s VAL 47 Ca 0.01 -1.87 -0.29 0.00 -1.81 0.00 0.00 61.98 58.02 1i6k s VAL 47 Cb 0.09 -1.81 -0.13 0.00 0.56 0.00 0.00 36.38 35.09 1i6k s VAL 47 CO 0.39 -0.28 1.35 1.87 -0.31 0.00 0.00 175.10 178.12 1i6k n TRP 48 N 0.40 2.29 -4.53 2.82 -0.00 -1.26 -5.00 117.44 112.15 1i6k n TRP 48 Ca -0.14 0.49 -0.22 0.00 -0.00 0.00 0.00 57.50 57.63 1i6k n TRP 48 Cb 0.57 -2.44 -0.16 0.00 -0.00 0.00 0.00 31.31 29.27 1i6k n TRP 48 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 1i6k s GLN 49 N -1.31 1.27 0.11 5.87 -1.52 -1.26 -5.03 119.66 117.79 1i6k s GLN 49 Ca 0.60 -0.40 -0.31 0.00 -1.95 0.00 0.00 55.36 53.30 1i6k s GLN 49 Cb -0.59 -1.14 -0.08 0.00 -0.22 0.00 0.00 33.01 30.98 1i6k s GLN 49 CO 0.57 0.14 1.48 0.34 -0.25 0.00 0.00 175.29 177.57 1i6k s ASP 50 N 0.22 6.72 0.25 5.90 2.15 -1.26 -4.88 116.67 125.76 1i6k s ASP 50 Ca -0.05 2.42 -0.06 0.00 0.43 0.00 0.00 52.55 55.29 1i6k s ASP 50 Cb -0.10 -2.58 0.27 0.00 -0.30 0.00 0.00 42.92 40.20 1i6k s ASP 50 CO 0.01 -0.75 1.92 -0.65 -0.17 0.00 0.00 175.17 175.54 1i6k h PRO 51 N 7.13 1.28 -0.36 4.34 0.11 -1.99 -0.25 132.00 142.26 1i6k h PRO 51 Ca -0.42 -0.08 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 1i6k h PRO 51 Cb 1.20 -0.29 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 1i6k h PRO 51 CO 0.89 0.85 -0.00 1.25 -0.21 0.00 0.00 178.00 180.78 1i6k h HIS 52 N 1.32 0.70 -0.71 0.65 -0.00 -2.00 -2.06 115.15 113.05 1i6k h HIS 52 Ca 0.37 -0.12 -0.06 0.00 -0.00 0.00 0.00 60.37 60.56 1i6k h HIS 52 Cb -0.12 -0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 27.08 1i6k h HIS 52 CO -0.00 0.74 0.21 0.93 -0.00 0.00 0.00 177.93 179.80 1i6k h GLU 53 N 0.45 1.10 -0.09 5.26 4.39 -1.88 -2.28 114.58 121.53 1i6k h GLU 53 Ca 0.10 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 1i6k h GLU 53 Cb 0.46 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1i6k h GLU 53 CO 0.02 0.95 0.05 1.25 -1.16 0.00 0.00 179.01 180.11 1i6k h LEU 54 N 1.05 0.11 -0.77 1.33 5.85 -0.81 0.19 115.31 122.26 1i6k h LEU 54 Ca 0.23 -0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.93 1i6k h LEU 54 Cb 0.32 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 1i6k h LEU 54 CO -0.00 0.17 0.44 0.03 -0.34 0.00 0.00 178.44 178.74 1i6k h ARG 55 N 0.04 0.75 -0.34 1.25 2.47 -1.22 -0.23 114.38 117.10 1i6k h ARG 55 Ca 0.03 -0.05 -0.07 0.00 -1.26 0.00 0.00 59.98 58.64 1i6k h ARG 55 Cb 0.09 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.23 1i6k h ARG 55 CO -0.00 0.50 -0.05 1.96 0.56 0.00 0.00 179.97 182.94 1i6k h GLN 56 N 0.77 0.63 -0.32 0.04 1.08 -1.04 -2.87 115.11 113.41 1i6k h GLN 56 Ca 0.36 -0.22 -0.03 0.00 -1.45 0.00 0.00 58.65 57.31 1i6k h GLN 56 Cb 0.27 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.64 1i6k h GLN 56 CO -0.22 0.78 0.09 -0.91 -0.95 0.00 0.00 178.83 177.62 1i6k h ASN 57 N 0.42 0.41 -0.49 1.46 2.35 -0.25 0.36 115.58 119.84 1i6k h ASN 57 Ca 0.09 -0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.70 1i6k h ASN 57 Cb 0.53 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 1i6k h ASN 57 CO 0.03 0.41 -0.06 0.40 -1.65 0.00 0.00 177.43 176.56 1i6k h ILE 58 N 0.45 1.27 -0.49 2.81 2.04 -0.90 -0.63 117.51 122.06 1i6k h ILE 58 Ca 0.11 -1.18 -0.12 0.00 1.00 0.00 0.00 64.86 64.68 1i6k h ILE 58 Cb 0.16 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 1i6k h ILE 58 CO -0.01 0.41 -0.14 0.03 0.00 0.00 0.00 178.15 178.44 1i6k h ARG 59 N 0.77 0.96 -0.49 2.37 3.08 -1.09 -2.32 114.38 117.67 1i6k h ARG 59 Ca 0.13 -0.38 0.02 0.00 0.07 0.00 0.00 59.98 59.82 1i6k h ARG 59 Cb 0.60 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1i6k h ARG 59 CO 0.04 1.05 0.30 0.00 -1.07 0.00 0.00 179.97 180.29 1i6k h ARG 60 N 0.82 0.58 -0.63 0.04 3.08 -0.11 -0.01 114.38 118.14 1i6k h ARG 60 Ca 0.12 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.05 1i6k h ARG 60 Cb 0.71 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 1i6k h ARG 60 CO 0.05 0.38 0.06 1.25 -1.07 0.00 0.00 179.97 180.65 1i6k h LEU 61 N 0.60 1.01 -0.16 3.04 5.85 -1.01 -0.46 115.31 124.18 1i6k h LEU 61 Ca 0.20 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1i6k h LEU 61 Cb 0.00 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 1i6k h LEU 61 CO -0.08 1.03 0.11 0.00 -0.34 0.00 0.00 178.44 179.15 1i6k h ALA 62 N 1.08 0.20 -0.69 1.25 0.00 -0.87 -0.40 119.26 119.83 1i6k h ALA 62 Ca 0.19 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1i6k h ALA 62 Cb 0.47 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 1i6k h ALA 62 CO 0.02 -0.31 0.40 0.00 0.00 0.00 0.00 179.25 179.36 1i6k h ALA 63 N 1.05 0.92 -0.66 0.00 0.00 -0.64 -2.16 119.26 117.77 1i6k h ALA 63 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1i6k h ALA 63 Cb -0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1i6k h ALA 63 CO -0.01 0.11 0.08 -0.07 0.00 0.00 0.00 179.25 179.36 1i6k h LEU 64 N 0.75 1.07 -0.47 0.00 3.38 -0.70 0.37 115.31 119.71 1i6k h LEU 64 Ca 0.30 -0.27 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1i6k h LEU 64 Cb 0.14 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1i6k h LEU 64 CO -0.16 1.07 0.29 1.88 0.09 0.00 0.00 178.44 181.61 1i6k h TYR 65 N 1.03 0.54 -0.07 1.13 0.05 -0.73 -0.19 116.97 118.74 1i6k h TYR 65 Ca 0.20 0.02 -0.18 0.00 0.05 0.00 0.00 58.73 58.81 1i6k h TYR 65 Cb 0.47 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 38.03 1i6k h TYR 65 CO 0.03 0.32 -0.73 -0.07 -1.05 0.00 0.00 178.16 176.67 1i6k h LEU 66 N 0.58 0.46 -1.06 3.88 3.38 -1.17 -1.84 115.31 119.54 1i6k h LEU 66 Ca 0.19 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1i6k h LEU 66 Cb -0.01 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1i6k h LEU 66 CO -0.07 1.04 0.24 0.00 0.09 0.00 0.00 178.44 179.74 1i6k h ALA 67 N 0.95 1.26 0.00 1.53 0.00 0.20 -0.85 119.26 122.35 1i6k h ALA 67 Ca -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1i6k h ALA 67 Cb 1.30 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1i6k h ALA 67 CO 0.12 0.54 0.00 1.33 0.00 0.00 0.00 179.25 181.25 1i6k n VAL 68 N -4.31 0.70 0.00 0.00 0.24 -0.12 -4.66 118.33 110.18 1i6k n VAL 68 Ca 0.05 0.10 0.00 0.00 -2.04 0.00 0.00 64.34 62.46 1i6k n VAL 68 Cb 0.17 -0.90 0.00 0.00 -1.47 0.00 0.00 33.84 31.64 1i6k n VAL 68 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1i6k n GLY 69 N 0.48 1.34 3.69 7.63 0.00 -0.32 -4.97 105.19 113.04 1i6k n GLY 69 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1i6k n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i6k s ILE 70 N -2.00 2.88 -0.29 -0.61 1.09 -0.70 -4.94 121.20 116.63 1i6k s ILE 70 Ca 0.00 0.35 -0.10 0.00 -1.10 0.00 0.00 60.65 59.80 1i6k s ILE 70 Cb 0.00 -3.22 -0.03 0.00 -1.06 0.00 0.00 42.46 38.15 1i6k s ILE 70 CO 0.00 -0.00 0.15 -0.62 -0.10 0.00 0.00 174.94 174.37 1i6k s ASP 71 N 2.50 5.61 0.26 3.58 -1.08 -1.26 -4.55 116.67 121.72 1i6k s ASP 71 Ca 0.76 -0.29 0.18 0.00 -0.52 0.00 0.00 52.55 52.68 1i6k s ASP 71 Cb -0.42 -2.02 0.95 0.00 -1.46 0.00 0.00 42.92 39.97 1i6k s ASP 71 CO 0.34 -0.12 1.56 -0.81 0.52 0.00 0.00 175.17 176.65 1i6k n PRO 72 N 5.00 0.12 0.05 4.34 -0.04 -1.26 -0.77 135.00 142.44 1i6k n PRO 72 Ca -0.14 0.59 0.12 0.00 -0.04 0.00 0.00 63.50 64.02 1i6k n PRO 72 Cb 0.51 -1.87 0.19 0.00 -0.04 0.00 0.00 33.50 32.28 1i6k n PRO 72 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1i6k n THR 73 N -2.12 0.30 -0.03 0.52 -2.24 -1.26 -4.00 114.28 105.45 1i6k n THR 73 Ca -0.01 -0.23 0.02 0.00 -2.27 0.00 0.00 64.05 61.56 1i6k n THR 73 Cb 0.05 -0.08 -0.11 0.00 -2.10 0.00 0.00 70.33 68.10 1i6k n THR 73 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i6k n GLN 74 N -2.02 0.93 -3.99 -0.78 1.13 0.05 -5.06 117.38 107.65 1i6k n GLN 74 Ca 0.04 -0.09 -0.08 0.00 -1.94 0.00 0.00 57.00 54.93 1i6k n GLN 74 Cb 0.42 -1.33 -0.09 0.00 0.11 0.00 0.00 30.24 29.35 1i6k n GLN 74 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1i6k s ALA 75 N -2.74 0.19 -0.32 -1.58 0.00 -0.13 -4.31 121.76 112.87 1i6k s ALA 75 Ca -0.06 -0.92 -0.10 0.00 0.00 0.00 0.00 51.96 50.89 1i6k s ALA 75 Cb 0.07 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.53 1i6k s ALA 75 CO 0.56 -0.41 0.15 0.99 0.00 0.00 0.00 175.76 177.06 1i6k s THR 76 N -3.69 4.53 -0.20 0.00 2.01 0.34 -4.34 115.64 114.28 1i6k s THR 76 Ca 0.04 -0.53 -0.06 0.00 0.31 0.00 0.00 61.69 61.46 1i6k s THR 76 Cb 0.05 -3.35 -0.03 0.00 0.01 0.00 0.00 72.50 69.18 1i6k s THR 76 CO -0.10 0.01 0.02 -0.22 -0.69 0.00 0.00 174.62 173.64 1i6k s LEU 77 N 1.59 3.36 0.25 4.42 2.96 -1.26 -0.42 118.68 129.59 1i6k s LEU 77 Ca 0.04 -0.16 -0.15 0.00 -0.22 0.00 0.00 54.13 53.63 1i6k s LEU 77 Cb -0.17 -1.86 0.00 0.00 0.50 0.00 0.00 46.19 44.66 1i6k s LEU 77 CO 0.06 0.07 0.54 0.72 -1.32 0.00 0.00 176.35 176.42 1i6k s PHE 78 N 0.99 0.19 -0.25 5.38 -0.12 -0.59 -3.92 117.98 119.66 1i6k s PHE 78 Ca 0.02 -0.58 -0.10 0.00 -0.05 0.00 0.00 56.93 56.21 1i6k s PHE 78 Cb -0.14 0.34 -0.05 0.00 -0.63 0.00 0.00 43.02 42.53 1i6k s PHE 78 CO 0.02 -1.06 0.16 0.42 -0.05 0.00 0.00 175.22 174.72 1i6k s ILE 79 N -3.99 5.32 0.20 -4.49 1.01 -1.26 -0.94 121.20 117.05 1i6k s ILE 79 Ca 0.19 0.17 -0.18 0.00 0.00 0.00 0.00 60.65 60.82 1i6k s ILE 79 Cb -0.02 -3.49 0.17 0.00 0.01 0.00 0.00 42.46 39.13 1i6k s ILE 79 CO 0.08 0.33 1.59 -0.61 0.00 0.00 0.00 174.94 176.33 1i6k h GLN 80 N 7.69 -0.11 -0.01 2.79 4.15 -1.50 -0.90 115.11 127.23 1i6k h GLN 80 Ca -0.37 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.06 1i6k h GLN 80 Cb 1.17 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.89 1i6k h GLN 80 CO 0.63 -0.07 0.05 0.66 -1.93 0.00 0.00 178.83 178.17 1i6k h SER 81 N -0.11 0.00 -0.01 -0.69 4.64 -1.95 -1.78 113.55 113.65 1i6k h SER 81 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1i6k h SER 81 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1i6k h SER 81 CO -0.71 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 174.63 1i6k n GLU 82 N -3.19 1.34 -3.90 4.77 1.02 -0.34 -4.40 120.64 115.94 1i6k n GLU 82 Ca -0.03 -0.49 -0.30 0.00 -0.02 0.00 0.00 57.16 56.32 1i6k n GLU 82 Cb 0.12 -1.48 -0.14 0.00 -0.02 0.00 0.00 31.44 29.92 1i6k n GLU 82 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1i6k s VAL 83 N -1.99 2.13 0.54 2.62 1.01 -0.67 -4.93 120.40 119.12 1i6k s VAL 83 Ca 0.42 -2.80 0.31 0.00 0.00 0.00 0.00 61.98 59.91 1i6k s VAL 83 Cb 0.21 -2.51 0.47 0.00 0.00 0.00 0.00 36.38 34.55 1i6k s VAL 83 CO 0.34 -0.77 1.89 -0.65 0.00 0.00 0.00 175.10 175.92 1i6k h PRO 84 N 6.91 0.00 -0.86 2.72 0.11 -1.81 -1.72 132.00 137.35 1i6k h PRO 84 Ca -0.06 0.00 0.23 0.00 0.11 0.00 0.00 66.00 66.28 1i6k h PRO 84 Cb 0.94 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.00 1i6k h PRO 84 CO 0.59 0.00 0.60 0.00 -0.21 0.00 0.00 178.00 178.98 1i6k h ALA 85 N 1.54 2.62 -0.55 -0.75 0.00 -1.92 -0.81 119.26 119.40 1i6k h ALA 85 Ca 0.40 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.25 1i6k h ALA 85 Cb 1.63 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.44 1i6k h ALA 85 CO -0.00 -0.88 0.20 0.45 0.00 0.00 0.00 179.25 179.02 1i6k h HIS 86 N 0.12 0.85 -0.47 0.00 3.86 -1.61 0.15 115.15 118.04 1i6k h HIS 86 Ca 0.42 -0.07 -0.12 0.00 -1.16 0.00 0.00 60.37 59.44 1i6k h HIS 86 Cb 1.48 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 29.68 1i6k h HIS 86 CO -0.00 0.71 -0.18 0.00 0.86 0.00 0.00 177.93 179.32 1i6k h ALA 87 N 1.05 0.79 0.32 2.45 0.00 -1.37 -0.27 119.26 122.24 1i6k h ALA 87 Ca 0.18 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1i6k h ALA 87 Cb 0.23 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1i6k h ALA 87 CO -0.01 0.66 -0.15 1.96 0.00 0.00 0.00 179.25 181.70 1i6k h GLN 88 N 0.81 -0.41 -0.83 0.00 4.20 -1.05 -1.98 115.11 115.85 1i6k h GLN 88 Ca 0.12 0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.89 1i6k h GLN 88 Cb 0.73 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.55 1i6k h GLN 88 CO 0.06 -0.18 0.55 0.00 -0.67 0.00 0.00 178.83 178.59 1i6k h ALA 89 N 0.05 1.49 -0.79 3.87 0.00 -0.72 -2.58 119.26 120.58 1i6k h ALA 89 Ca -0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1i6k h ALA 89 Cb 0.42 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1i6k h ALA 89 CO 0.07 0.43 0.48 0.00 0.00 0.00 0.00 179.25 180.23 1i6k h ALA 90 N 1.51 1.01 0.00 0.00 0.00 -0.80 -1.35 119.26 119.64 1i6k h ALA 90 Ca 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1i6k h ALA 90 Cb 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1i6k h ALA 90 CO -0.10 0.47 0.00 1.87 0.00 0.00 0.00 179.25 181.49 1i6k n TRP 91 N -4.48 0.00 0.00 0.00 -0.00 -0.76 -0.63 117.44 111.56 1i6k n TRP 91 Ca 0.08 -0.01 0.00 0.00 -0.00 0.00 0.00 57.50 57.56 1i6k n TRP 91 Cb 0.05 -0.04 0.00 0.00 -0.00 0.00 0.00 31.31 31.32 1i6k n TRP 91 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1i6k n LEU 93 N 0.64 0.00 0.11 5.87 4.77 -0.51 -1.79 117.00 126.10 1i6k n LEU 93 Ca 0.00 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.00 1i6k n LEU 93 Cb 0.02 0.00 0.36 0.00 -2.33 0.00 0.00 43.42 41.47 1i6k n LEU 93 CO 0.00 0.00 0.86 1.56 -1.33 0.00 0.00 177.39 178.48 1i6k h GLN 94 N 0.00 0.25 0.00 3.23 4.20 -1.13 -1.94 115.11 119.71 1i6k h GLN 94 Ca 0.00 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1i6k h GLN 94 Cb 0.00 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.75 1i6k h GLN 94 CO 0.00 0.42 0.00 0.00 -0.67 0.00 0.00 178.83 178.58 1i6k n ILE 96 N -2.70 0.00 -3.23 0.00 -5.35 -0.88 -4.98 119.36 102.22 1i6k n ILE 96 Ca 0.02 -0.21 -0.35 0.00 -0.27 0.00 0.00 62.75 61.95 1i6k n ILE 96 Cb 0.32 0.98 -0.06 0.00 -1.74 0.00 0.00 39.64 39.15 1i6k n ILE 96 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1i6k s VAL 97 N -2.20 4.73 0.22 7.28 0.11 -0.78 -5.06 120.40 124.69 1i6k s VAL 97 Ca 0.05 0.98 -0.12 0.00 -2.93 0.00 0.00 61.98 59.96 1i6k s VAL 97 Cb 0.09 -3.75 -0.07 0.00 -1.53 0.00 0.00 36.38 31.12 1i6k s VAL 97 CO 0.52 0.12 0.58 -0.31 -3.33 0.00 0.00 175.10 172.68 1i6k s TYR 98 N -1.61 3.48 0.26 1.54 1.51 -1.26 -4.95 117.35 116.31 1i6k s TYR 98 Ca 0.43 0.99 -0.03 0.00 -1.01 0.00 0.00 57.07 57.45 1i6k s TYR 98 Cb -0.14 -2.34 0.36 0.00 -0.11 0.00 0.00 41.96 39.73 1i6k s TYR 98 CO 0.20 0.29 1.89 0.82 -1.11 0.00 0.00 175.55 177.64 1i6k h ILE 99 N 2.25 1.13 -0.62 2.71 2.04 -1.97 -1.58 117.51 121.46 1i6k h ILE 99 Ca -0.48 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 64.95 1i6k h ILE 99 Cb 1.18 -0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 1i6k h ILE 99 CO 0.67 0.22 0.32 1.23 0.00 0.00 0.00 178.15 180.60 1i6k h GLY 100 N 1.23 0.93 1.09 5.37 0.00 -1.98 0.36 103.07 110.06 1i6k h GLY 100 Ca 0.41 -0.42 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1i6k h GLY 100 CO -0.15 0.40 0.28 0.83 0.00 0.00 0.00 176.54 177.90 1i6k h GLU 101 N 0.87 1.15 -0.24 4.80 5.08 -1.69 -2.40 114.58 122.14 1i6k h GLU 101 Ca 0.22 -0.22 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 1i6k h GLU 101 Cb 0.05 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.12 1i6k h GLU 101 CO -0.03 0.94 -0.52 -0.07 -1.00 0.00 0.00 179.01 178.33 1i6k h LEU 102 N 1.11 0.88 -1.97 1.33 3.38 -1.16 -3.25 115.31 115.63 1i6k h LEU 102 Ca 0.25 -0.55 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 1i6k h LEU 102 Cb 0.24 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1i6k h LEU 102 CO -0.02 1.26 -0.11 -0.33 0.09 0.00 0.00 178.44 179.34 1i6k h GLU 103 N 0.52 0.00 -5.19 1.13 5.08 -0.65 -3.46 114.58 112.01 1i6k h GLU 103 Ca 0.00 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.69 1i6k h GLU 103 Cb 1.13 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.22 1i6k h GLU 103 CO 0.11 0.11 0.78 -0.98 -1.00 0.00 0.00 179.01 178.03 1i6k s ARG 104 N -4.40 3.46 0.00 2.33 1.70 -0.93 -4.67 118.95 116.43 1i6k s ARG 104 Ca -0.04 -1.47 0.00 0.00 -0.47 0.00 0.00 55.73 53.75 1i6k s ARG 104 Cb 0.14 -4.75 0.00 0.00 -0.57 0.00 0.00 34.95 29.77 1i6k s ARG 104 CO 0.60 -1.80 0.00 0.25 -1.08 0.00 0.00 175.30 173.27 1i6k n THR 106 N 5.69 0.00 -0.19 4.99 -2.24 -1.26 -4.95 114.28 116.32 1i6k n THR 106 Ca 0.16 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.90 1i6k n THR 106 Cb 0.48 -0.65 0.05 0.00 -2.10 0.00 0.00 70.33 68.12 1i6k n THR 106 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1i6k h GLN 107 N 0.00 0.62 -0.25 -0.78 1.08 -1.97 0.70 115.11 114.50 1i6k h GLN 107 Ca 0.00 -0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 1i6k h GLN 107 Cb 0.95 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 28.23 1i6k h GLN 107 CO 0.00 0.41 0.05 0.35 -0.95 0.00 0.00 178.83 178.69 1i6k h PHE 108 N 0.64 0.44 -0.93 2.96 3.57 -1.89 -1.33 116.94 120.39 1i6k h PHE 108 Ca 0.23 -0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.68 1i6k h PHE 108 Cb 0.07 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 38.64 1i6k h PHE 108 CO -0.07 0.52 0.61 0.87 -2.23 0.00 0.00 178.31 178.01 1i6k h LYS 109 N 0.23 1.24 -0.12 1.11 1.57 -1.70 -1.05 116.57 117.84 1i6k h LYS 109 Ca 0.08 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 1i6k h LYS 109 Cb 0.31 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1i6k h LYS 109 CO 0.00 0.83 -0.21 0.93 -0.57 0.00 0.00 179.45 180.43 1i6k h GLU 110 N 1.27 0.35 0.00 3.15 5.08 -0.75 -1.34 114.58 122.35 1i6k h GLU 110 Ca 0.34 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1i6k h GLU 110 Cb -0.13 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.14 1i6k h GLU 110 CO -0.07 0.81 -0.16 0.87 -1.00 0.00 0.00 179.01 179.45 1i6k h LYS 111 N -0.06 0.00 -0.02 2.33 1.57 -1.16 -2.87 116.57 116.36 1i6k h LYS 111 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1i6k h LYS 111 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1i6k h LYS 111 CO 0.05 0.16 -0.14 -1.13 -0.57 0.00 0.00 179.45 177.82 1i6k n SER 112 N -3.35 2.49 -4.66 0.86 3.41 -0.41 -4.99 113.62 106.97 1i6k n SER 112 Ca -0.00 -1.74 -0.48 0.00 -0.26 0.00 0.00 58.87 56.39 1i6k n SER 112 Cb 0.38 0.16 -0.05 0.00 -0.26 0.00 0.00 64.21 64.44 1i6k n SER 112 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i6k n ALA 113 N 0.79 0.89 -3.34 7.33 0.00 -0.51 -2.89 120.51 122.77 1i6k n ALA 113 Ca 0.11 0.42 -0.18 0.00 0.00 0.00 0.00 53.44 53.79 1i6k n ALA 113 Cb 0.50 -2.34 0.06 0.00 0.00 0.00 0.00 19.45 17.67 1i6k n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i6k n GLY 114 N 3.50 -0.20 3.29 0.00 0.00 -1.26 -4.98 105.19 105.54 1i6k n GLY 114 Ca 0.19 0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.95 1i6k n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i6k s LYS 115 N -6.01 1.89 0.15 1.61 1.02 -1.14 -5.04 119.74 112.22 1i6k s LYS 115 Ca 0.45 -0.92 -0.19 0.00 0.02 0.00 0.00 55.97 55.34 1i6k s LYS 115 Cb -0.20 -1.88 0.03 0.00 -0.52 0.00 0.00 37.83 35.26 1i6k s LYS 115 CO 0.56 0.51 1.68 1.49 -0.92 0.00 0.00 175.35 178.67 1i6k h GLU 116 N 5.35 -0.01 -0.18 1.68 4.57 -1.93 -3.43 114.58 120.63 1i6k h GLU 116 Ca -0.43 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 57.84 1i6k h GLU 116 Cb 1.13 0.00 -0.16 0.00 -0.16 0.00 0.00 28.75 29.56 1i6k h GLU 116 CO 0.46 -0.01 -0.11 0.00 -1.18 0.00 0.00 179.01 178.18 1i6k s ALA 117 N -6.21 -4.53 -0.14 2.92 0.00 -1.26 -5.13 121.76 107.41 1i6k s ALA 117 Ca -0.14 1.00 -0.14 0.00 0.00 0.00 0.00 51.96 52.69 1i6k s ALA 117 Cb 0.12 -3.01 -0.05 0.00 0.00 0.00 0.00 23.12 20.19 1i6k s ALA 117 CO 0.70 -2.52 0.31 0.08 0.00 0.00 0.00 175.76 174.32 1i6k s VAL 118 N 1.52 5.28 0.24 0.00 1.01 -1.26 -5.08 120.40 122.11 1i6k s VAL 118 Ca 0.18 0.58 -0.30 0.00 0.00 0.00 0.00 61.98 62.45 1i6k s VAL 118 Cb 0.08 -3.64 -0.09 0.00 0.00 0.00 0.00 36.38 32.73 1i6k s VAL 118 CO -0.13 0.42 1.12 -0.44 0.00 0.00 0.00 175.10 176.06 1i6k s SER 119 N 0.25 7.23 0.54 3.32 0.01 -1.26 -4.94 113.70 118.85 1i6k s SER 119 Ca 0.18 2.23 0.22 0.00 1.31 0.00 0.00 55.95 59.89 1i6k s SER 119 Cb -0.13 -2.62 1.49 0.00 0.21 0.00 0.00 66.02 64.97 1i6k s SER 119 CO 0.05 -0.21 2.18 0.00 0.41 0.00 0.00 173.24 175.67 1i6k h ALA 120 N 4.37 1.73 -0.20 1.44 0.00 -1.98 -2.56 119.26 122.06 1i6k h ALA 120 Ca -0.46 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1i6k h ALA 120 Cb 1.21 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1i6k h ALA 120 CO 0.70 0.03 0.08 0.78 0.00 0.00 0.00 179.25 180.84 1i6k h GLY 121 N 0.10 0.29 1.00 0.00 0.00 -1.92 -1.04 103.07 101.50 1i6k h GLY 121 Ca -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1i6k h GLY 121 CO 0.00 0.12 0.35 1.41 0.00 0.00 0.00 176.54 178.42 1i6k h LEU 122 N 0.28 0.77 -0.30 3.11 3.38 -1.62 -0.35 115.31 120.58 1i6k h LEU 122 Ca 0.07 -0.08 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 1i6k h LEU 122 Cb 0.05 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1i6k h LEU 122 CO -0.01 0.63 -0.55 0.25 0.09 0.00 0.00 178.44 178.85 1i6k h LEU 123 N 0.85 0.97 -1.99 1.67 5.85 -1.41 -3.05 115.31 118.20 1i6k h LEU 123 Ca 0.22 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1i6k h LEU 123 Cb 0.02 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.77 1i6k h LEU 123 CO -0.04 1.32 0.00 0.35 -0.34 0.00 0.00 178.44 179.73 1i6k n THR 124 N -4.00 1.09 -0.31 1.05 -2.24 -0.49 -4.33 114.28 105.04 1i6k n THR 124 Ca -0.04 -0.65 0.03 0.00 -2.27 0.00 0.00 64.05 61.12 1i6k n THR 124 Cb 0.63 -0.15 0.17 0.00 -2.10 0.00 0.00 70.33 68.88 1i6k n THR 124 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1i6k h TYR 125 N 2.13 0.96 -0.28 4.78 3.20 -0.95 -3.23 116.97 123.58 1i6k h TYR 125 Ca 0.00 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 1i6k h TYR 125 Cb 0.99 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 1i6k h TYR 125 CO 0.45 0.44 0.04 -1.35 -1.64 0.00 0.00 178.16 176.10 1i6k h PRO 126 N 0.91 0.46 -0.82 1.82 0.11 -1.85 -2.93 132.00 129.69 1i6k h PRO 126 Ca 0.40 -0.12 0.08 0.00 0.11 0.00 0.00 66.00 66.47 1i6k h PRO 126 Cb 0.29 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 31.29 1i6k h PRO 126 CO -0.22 0.57 0.53 -1.35 -0.21 0.00 0.00 178.00 177.33 1i6k h PRO 127 N 0.27 0.79 -1.23 1.05 0.11 -1.90 0.15 132.00 131.25 1i6k h PRO 127 Ca 0.08 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1i6k h PRO 127 Cb 0.34 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.27 1i6k h PRO 127 CO 0.01 0.52 0.00 -0.11 -0.21 0.00 0.00 178.00 178.21 1i6k n LEU 128 N -4.50 0.51 0.00 2.35 7.94 -1.11 -1.17 117.00 121.02 1i6k n LEU 128 Ca 0.13 -0.26 0.00 0.00 -1.11 0.00 0.00 56.01 54.78 1i6k n LEU 128 Cb 0.28 -0.11 0.00 0.00 0.53 0.00 0.00 43.42 44.12 1i6k n LEU 128 CO 0.32 0.09 0.00 0.00 -1.11 0.00 0.00 177.39 176.70 1i6k n ALA 130 N 0.71 0.00 -0.15 1.96 0.00 0.52 -1.01 120.51 122.54 1i6k n ALA 130 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1i6k n ALA 130 Cb 0.09 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.55 1i6k n ALA 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i6k h ALA 131 N 0.00 0.58 -0.61 0.00 0.00 -1.39 0.25 119.26 118.10 1i6k h ALA 131 Ca 0.00 -0.10 0.13 0.00 0.00 0.00 0.00 54.91 54.94 1i6k h ALA 131 Cb 0.00 -0.18 -0.11 0.00 0.00 0.00 0.00 17.79 17.50 1i6k h ALA 131 CO 0.00 0.13 -0.04 -0.44 0.00 0.00 0.00 179.25 178.89 1i6k h ASP 132 N 0.59 -0.36 0.07 0.00 3.45 -1.33 -1.03 116.42 117.82 1i6k h ASP 132 Ca 0.16 0.16 -0.00 0.00 0.43 0.00 0.00 57.03 57.78 1i6k h ASP 132 Cb 0.08 0.30 0.00 0.00 -0.56 0.00 0.00 39.33 39.15 1i6k h ASP 132 CO -0.02 -0.14 -0.03 0.40 -1.57 0.00 0.00 179.24 177.87 1i6k h ILE 133 N 0.08 0.92 -0.17 0.35 2.04 -1.79 -3.36 117.51 115.58 1i6k h ILE 133 Ca 0.31 -1.47 -0.03 0.00 1.00 0.00 0.00 64.86 64.67 1i6k h ILE 133 Cb 0.50 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 1i6k h ILE 133 CO -0.55 0.28 -0.02 -0.07 0.00 0.00 0.00 178.15 177.79 1i6k h LEU 134 N -0.94 0.23 -1.37 1.44 3.38 -0.85 -2.92 115.31 114.28 1i6k h LEU 134 Ca -0.01 -0.03 0.24 0.00 0.09 0.00 0.00 57.88 58.17 1i6k h LEU 134 Cb 0.54 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 41.14 1i6k h LEU 134 CO 0.02 0.29 0.65 -0.07 0.09 0.00 0.00 178.44 179.42 1i6k h LEU 135 N 0.25 0.47 -2.84 1.67 3.38 -1.33 -2.48 115.31 114.43 1i6k h LEU 135 Ca 0.06 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1i6k h LEU 135 Cb 0.21 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1i6k h LEU 135 CO 0.01 0.13 0.00 -1.22 0.09 0.00 0.00 178.44 177.44 1i6k n TYR 136 N -4.61 1.26 -3.65 1.13 4.02 -1.10 -4.55 117.16 109.66 1i6k n TYR 136 Ca 0.24 -0.54 -0.24 0.00 -0.01 0.00 0.00 57.90 57.35 1i6k n TYR 136 Cb 0.80 -0.15 0.07 0.00 -0.02 0.00 0.00 39.34 40.04 1i6k n TYR 136 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1i6k n ASN 137 N 1.26 -5.06 -4.74 7.72 5.15 -0.93 -4.89 115.26 113.77 1i6k n ASN 137 Ca 0.24 -0.62 -0.42 0.00 -0.60 0.00 0.00 54.58 53.18 1i6k n ASN 137 Cb 0.76 -4.73 -0.02 0.00 -0.53 0.00 0.00 39.78 35.25 1i6k n ASN 137 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1i6k s THR 138 N -3.34 2.58 -0.19 -0.44 2.01 -1.23 -4.71 115.64 110.32 1i6k s THR 138 Ca 0.48 0.46 -0.12 0.00 0.31 0.00 0.00 61.69 62.82 1i6k s THR 138 Cb -0.22 -3.29 -0.21 0.00 0.01 0.00 0.00 72.50 68.79 1i6k s THR 138 CO 0.76 0.06 0.16 0.47 -0.69 0.00 0.00 174.62 175.38 1i6k n ASP 139 N 2.88 1.99 -4.13 3.53 8.00 -0.09 -3.73 116.55 125.01 1i6k n ASP 139 Ca 0.09 0.26 -0.25 0.00 0.71 0.00 0.00 54.79 55.61 1i6k n ASP 139 Cb 0.39 -0.85 -0.16 0.00 -0.02 0.00 0.00 41.12 40.49 1i6k n ASP 139 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1i6k s ILE 140 N -2.48 1.36 -0.38 0.53 -1.09 -0.40 -1.29 121.20 117.47 1i6k s ILE 140 Ca -0.28 -0.69 0.02 0.00 -2.23 0.00 0.00 60.65 57.47 1i6k s ILE 140 Cb 0.08 -1.16 0.11 0.00 -1.58 0.00 0.00 42.46 39.90 1i6k s ILE 140 CO 0.65 0.39 0.14 -0.69 -1.23 0.00 0.00 174.94 174.20 1i6k s VAL 141 N -0.04 1.63 -0.21 2.92 1.01 -0.02 -2.57 120.40 123.12 1i6k s VAL 141 Ca -0.01 -2.19 -0.29 0.00 0.00 0.00 0.00 61.98 59.48 1i6k s VAL 141 Cb -0.10 -2.18 -0.00 0.00 0.00 0.00 0.00 36.38 34.09 1i6k s VAL 141 CO 0.01 -0.72 1.20 -2.16 0.00 0.00 0.00 175.10 173.43 1i6k s PRO 142 N 0.87 4.19 0.28 2.72 0.04 -1.26 -1.30 135.00 140.55 1i6k s PRO 142 Ca 0.13 1.51 -0.09 0.00 0.04 0.00 0.00 61.00 62.59 1i6k s PRO 142 Cb -0.21 -3.75 -0.00 0.00 0.04 0.00 0.00 34.50 30.59 1i6k s PRO 142 CO -0.11 -0.75 0.46 0.14 0.04 0.00 0.00 177.00 176.79 1i6k s VAL 143 N 3.54 0.00 0.68 -0.36 -7.23 -0.86 -4.83 120.40 111.34 1i6k s VAL 143 Ca 0.52 -1.50 -0.07 0.00 -1.81 0.00 0.00 61.98 59.12 1i6k s VAL 143 Cb -0.19 -2.40 0.04 0.00 0.56 0.00 0.00 36.38 34.39 1i6k s VAL 143 CO 0.13 0.00 1.00 -0.83 -0.31 0.00 0.00 175.10 175.09 1i6k s GLY 144 N -3.10 1.65 0.50 2.32 0.00 -1.23 -4.20 107.32 103.27 1i6k s GLY 144 Ca 0.26 -0.78 0.26 0.00 0.00 0.00 0.00 44.72 44.46 1i6k s GLY 144 CO 0.13 -0.41 1.91 -2.09 0.00 0.00 0.00 173.10 172.63 1i6k h GLU 145 N -0.51 0.11 0.00 2.90 4.57 -1.53 -2.69 114.58 117.44 1i6k h GLU 145 Ca -0.45 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 1i6k h GLU 145 Cb 1.29 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1i6k h GLU 145 CO 0.61 0.08 0.00 0.38 -1.18 0.00 0.00 179.01 178.90 1i6k h ASP 146 N 0.12 0.00 -0.02 1.04 3.04 -1.94 -2.34 116.42 116.32 1i6k h ASP 146 Ca 0.40 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.19 1i6k h ASP 146 Cb 1.39 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.68 1i6k h ASP 146 CO -0.05 0.00 -0.04 0.00 -2.04 0.00 0.00 179.24 177.11 1i6k n GLN 147 N -3.00 2.01 -0.04 4.15 1.13 -1.01 -4.52 117.38 116.10 1i6k n GLN 147 Ca -0.02 -1.53 -0.09 0.00 -1.94 0.00 0.00 57.00 53.42 1i6k n GLN 147 Cb 0.15 -1.47 -0.03 0.00 0.11 0.00 0.00 30.24 29.00 1i6k n GLN 147 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1i6k h LYS 148 N 3.74 0.17 -0.75 -1.09 3.64 -1.58 -1.91 116.57 118.78 1i6k h LYS 148 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1i6k h LYS 148 Cb 0.82 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.56 1i6k h LYS 148 CO 0.00 0.11 0.48 0.37 -2.27 0.00 0.00 179.45 178.14 1i6k h GLN 149 N 0.17 1.01 -0.91 1.90 4.15 -1.80 0.29 115.11 119.93 1i6k h GLN 149 Ca 0.08 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1i6k h GLN 149 Cb 0.04 -0.22 -0.04 0.00 0.21 0.00 0.00 27.48 27.47 1i6k h GLN 149 CO -0.07 0.69 0.58 0.45 -1.93 0.00 0.00 178.83 178.55 1i6k h HIS 150 N 1.03 1.15 -0.10 3.99 3.86 -1.80 -0.65 115.15 122.62 1i6k h HIS 150 Ca 0.27 0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.39 1i6k h HIS 150 Cb -0.08 -0.39 -0.01 0.00 1.06 0.00 0.00 27.41 27.99 1i6k h HIS 150 CO -0.01 0.74 -0.46 0.82 0.86 0.00 0.00 177.93 179.88 1i6k h ILE 151 N 1.23 1.33 -0.51 2.45 2.04 -0.70 -0.44 117.51 122.92 1i6k h ILE 151 Ca 0.33 -1.64 -0.01 0.00 1.00 0.00 0.00 64.86 64.55 1i6k h ILE 151 Cb -0.12 1.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 1i6k h ILE 151 CO -0.07 0.49 0.30 -0.33 0.00 0.00 0.00 178.15 178.54 1i6k h GLU 152 N 0.20 0.69 -0.50 2.37 4.39 -0.05 0.18 114.58 121.87 1i6k h GLU 152 Ca 0.01 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.58 1i6k h GLU 152 Cb 0.89 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.38 1i6k h GLU 152 CO 0.07 0.52 0.05 1.25 -1.16 0.00 0.00 179.01 179.74 1i6k h LEU 153 N 0.68 0.75 -0.71 1.33 5.85 -0.90 -0.90 115.31 121.41 1i6k h LEU 153 Ca 0.18 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1i6k h LEU 153 Cb 0.01 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1i6k h LEU 153 CO -0.03 0.79 0.35 0.74 -0.34 0.00 0.00 178.44 179.94 1i6k h THR 154 N 0.75 1.23 -0.27 1.05 2.02 -0.50 0.11 112.91 117.30 1i6k h THR 154 Ca 0.16 -0.64 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1i6k h THR 154 Cb 0.38 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1i6k h THR 154 CO 0.01 0.27 0.12 0.03 0.37 0.00 0.00 175.52 176.32 1i6k h ARG 155 N 0.99 0.40 -0.54 6.66 3.08 -0.39 0.02 114.38 124.60 1i6k h ARG 155 Ca 0.24 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.28 1i6k h ARG 155 Cb 0.10 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.04 1i6k h ARG 155 CO -0.03 0.41 0.27 -0.44 -1.07 0.00 0.00 179.97 179.10 1i6k h ASP 156 N 0.30 0.38 -0.44 7.04 3.32 -0.64 -0.80 116.42 125.58 1i6k h ASP 156 Ca 0.09 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.13 1i6k h ASP 156 Cb 0.15 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1i6k h ASP 156 CO -0.01 0.26 0.10 -0.07 -1.72 0.00 0.00 179.24 177.79 1i6k h LEU 157 N 0.51 0.68 -0.51 1.55 3.38 -0.47 0.07 115.31 120.52 1i6k h LEU 157 Ca 0.24 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1i6k h LEU 157 Cb 0.16 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1i6k h LEU 157 CO -0.17 0.74 0.33 0.00 0.09 0.00 0.00 178.44 179.43 1i6k h ALA 158 N 0.96 0.65 -0.45 1.53 0.00 -0.68 0.12 119.26 121.40 1i6k h ALA 158 Ca 0.14 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1i6k h ALA 158 Cb 0.34 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1i6k h ALA 158 CO 0.00 0.08 0.06 0.93 0.00 0.00 0.00 179.25 180.32 1i6k h GLU 159 N 0.68 0.76 -0.03 0.00 5.08 -0.98 -0.49 114.58 119.60 1i6k h GLU 159 Ca 0.19 -0.21 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1i6k h GLU 159 Cb -0.06 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1i6k h GLU 159 CO -0.05 0.79 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.64 1i6k h ARG 160 N 0.61 -0.01 -0.22 2.33 2.43 -0.64 0.36 114.38 119.24 1i6k h ARG 160 Ca 0.13 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 1i6k h ARG 160 Cb 0.41 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 1i6k h ARG 160 CO 0.01 -0.01 0.10 0.35 -1.51 0.00 0.00 179.97 178.91 1i6k h PHE 161 N -0.01 0.18 -0.86 2.20 3.57 -0.65 -0.44 116.94 120.93 1i6k h PHE 161 Ca 0.02 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.55 1i6k h PHE 161 Cb 0.04 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.68 1i6k h PHE 161 CO -0.10 0.10 0.56 -0.91 -2.23 0.00 0.00 178.31 175.72 1i6k h ASN 162 N 0.21 0.95 -0.24 0.41 2.35 -0.86 0.29 115.58 118.69 1i6k h ASN 162 Ca 0.09 -0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.78 1i6k h ASN 162 Cb 0.04 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 1i6k h ASN 162 CO -0.08 0.67 -0.03 0.50 -1.65 0.00 0.00 177.43 176.85 1i6k h LYS 163 N 1.12 0.45 -0.18 0.81 3.64 -0.60 -0.68 116.57 121.12 1i6k h LYS 163 Ca 0.33 -0.16 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 1i6k h LYS 163 Cb -0.07 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1i6k h LYS 163 CO -0.09 0.65 -0.31 0.00 -2.27 0.00 0.00 179.45 177.43 1i6k h ARG 164 N 0.20 0.52 -0.01 1.90 3.08 -0.82 -3.39 114.38 115.86 1i6k h ARG 164 Ca 0.07 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.79 1i6k h ARG 164 Cb 0.47 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1i6k h ARG 164 CO 0.02 0.93 -0.02 0.66 -1.07 0.00 0.00 179.97 180.49 1i6k n TYR 165 N -4.35 0.00 0.00 3.04 4.02 1.00 -5.10 117.16 115.77 1i6k n TYR 165 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.83 1i6k n TYR 165 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.80 1i6k n TYR 165 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1i6k n GLY 166 N 0.47 2.73 3.65 2.72 0.00 -0.27 -4.87 105.19 109.62 1i6k n GLY 166 Ca 0.04 -1.68 -0.43 0.00 0.00 0.00 0.00 46.02 43.95 1i6k n GLY 166 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1i6k n GLU 167 N 0.83 2.59 0.00 1.61 2.13 -1.20 -4.25 120.64 122.34 1i6k n GLU 167 Ca 0.00 0.91 0.00 0.00 0.66 0.00 0.00 57.16 58.73 1i6k n GLU 167 Cb 0.00 -3.01 0.00 0.00 0.27 0.00 0.00 31.44 28.70 1i6k n GLU 167 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1i6k n LEU 168 N 8.34 0.84 -4.87 4.31 7.94 -1.26 -5.06 117.00 127.24 1i6k n LEU 168 Ca 0.23 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.79 1i6k n LEU 168 Cb 0.40 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.30 1i6k n LEU 168 CO 0.68 0.06 0.15 -0.36 -1.11 0.00 0.00 177.39 176.81 1i6k s PHE 169 N -1.54 3.52 0.21 1.96 2.99 -1.26 -5.04 117.98 118.82 1i6k s PHE 169 Ca 0.00 0.84 -0.25 0.00 0.00 0.00 0.00 56.93 57.52 1i6k s PHE 169 Cb 0.00 -2.21 -0.08 0.00 0.00 0.00 0.00 43.02 40.72 1i6k s PHE 169 CO 0.00 0.41 0.81 0.99 -0.00 0.00 0.00 175.22 177.44 1i6k s THR 170 N -1.58 4.34 -0.54 0.64 2.01 -1.26 -4.99 115.64 114.26 1i6k s THR 170 Ca 0.40 1.69 -0.25 0.00 0.31 0.00 0.00 61.69 63.83 1i6k s THR 170 Cb -0.13 -4.08 0.04 0.00 0.01 0.00 0.00 72.50 68.33 1i6k s THR 170 CO 0.20 0.39 1.00 -0.63 -0.69 0.00 0.00 174.62 174.90 1i6k s ILE 171 N -1.31 4.31 0.79 1.82 -1.09 -1.26 -4.78 121.20 119.68 1i6k s ILE 171 Ca 0.40 0.54 -0.11 0.00 -2.23 0.00 0.00 60.65 59.26 1i6k s ILE 171 Cb -0.21 -4.57 0.06 0.00 -1.58 0.00 0.00 42.46 36.17 1i6k s ILE 171 CO 0.25 -1.11 1.09 -2.16 -1.23 0.00 0.00 174.94 171.78 1i6k s PRO 172 N 4.16 2.15 -0.02 2.79 0.04 -1.24 -4.89 135.00 137.99 1i6k s PRO 172 Ca 0.35 1.05 0.01 0.00 0.04 0.00 0.00 61.00 62.44 1i6k s PRO 172 Cb -0.11 -1.89 0.02 0.00 0.04 0.00 0.00 34.50 32.55 1i6k s PRO 172 CO 0.22 -1.68 -0.02 -2.00 0.04 0.00 0.00 177.00 173.56 1i6k s GLU 173 N -4.94 0.37 0.64 4.56 2.12 -0.41 -4.85 118.70 116.19 1i6k s GLU 173 Ca 0.61 -0.03 -0.17 0.00 0.36 0.00 0.00 54.97 55.74 1i6k s GLU 173 Cb -0.17 -0.46 -0.01 0.00 0.26 0.00 0.00 34.13 33.76 1i6k s GLU 173 CO 0.56 -0.05 1.18 0.00 -0.54 0.00 0.00 175.26 176.42 1i6k s ALA 174 N 0.58 2.42 -0.23 6.30 0.00 -1.26 -0.84 121.76 128.74 1i6k s ALA 174 Ca -0.06 0.87 -0.01 0.00 0.00 0.00 0.00 51.96 52.76 1i6k s ALA 174 Cb -0.09 -3.42 0.06 0.00 0.00 0.00 0.00 23.12 19.67 1i6k s ALA 174 CO -0.01 -1.35 -0.00 0.50 0.00 0.00 0.00 175.76 174.90 1i6k s ARG 175 N -3.64 1.15 -0.12 0.00 3.52 -0.42 -4.75 118.95 114.69 1i6k s ARG 175 Ca 0.74 -0.79 0.02 0.00 -0.13 0.00 0.00 55.73 55.58 1i6k s ARG 175 Cb -0.27 -2.36 0.00 0.00 -1.56 0.00 0.00 34.95 30.76 1i6k s ARG 175 CO 0.38 -0.66 -0.21 0.42 -0.81 0.00 0.00 175.30 174.42 1i6k s ILE 176 N 1.59 2.28 0.40 4.11 1.01 -1.26 -2.02 121.20 127.31 1i6k s ILE 176 Ca -0.02 -0.92 -0.25 0.00 0.00 0.00 0.00 60.65 59.46 1i6k s ILE 176 Cb -0.18 -1.91 -0.11 0.00 0.01 0.00 0.00 42.46 40.27 1i6k s ILE 176 CO -0.09 0.54 0.97 -2.65 0.00 0.00 0.00 174.94 173.72 1i6k n PRO 177 N 3.77 1.28 -0.07 2.79 -0.02 -1.26 -4.91 135.00 136.59 1i6k n PRO 177 Ca -0.19 0.46 -0.13 0.00 -2.02 0.00 0.00 63.50 61.62 1i6k n PRO 177 Cb 0.52 -1.96 -0.06 0.00 -0.02 0.00 0.00 33.50 31.98 1i6k n PRO 177 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1i6k h LYS 178 N 1.55 0.41 -5.57 -0.52 1.79 -1.99 -3.33 116.57 108.90 1i6k h LYS 178 Ca -0.43 -0.19 -0.66 0.00 -2.18 0.00 0.00 60.65 57.18 1i6k h LYS 178 Cb 1.34 -0.00 -0.24 0.00 -1.58 0.00 0.00 32.23 31.75 1i6k h LYS 178 CO 0.57 0.73 -0.73 0.08 -1.08 0.00 0.00 179.45 179.03 1i6k s VAL 179 N -4.48 3.39 0.00 0.50 1.01 -1.26 -4.55 120.40 115.02 1i6k s VAL 179 Ca -0.14 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1i6k s VAL 179 Cb 0.06 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 34.02 1i6k s VAL 179 CO 0.76 0.54 0.00 0.61 0.00 0.00 0.00 175.10 177.01 1i6k n GLY 180 N 3.16 0.67 0.21 4.51 0.00 -1.26 -4.94 105.19 107.54 1i6k n GLY 180 Ca -0.18 -0.37 0.08 0.00 0.00 0.00 0.00 46.02 45.55 1i6k n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i6k h ALA 181 N 0.00 1.08 -1.95 4.61 0.00 -1.80 -3.27 119.26 117.94 1i6k h ALA 181 Ca 0.00 -0.27 -0.42 0.00 0.00 0.00 0.00 54.91 54.22 1i6k h ALA 181 Cb 0.00 -0.05 -0.31 0.00 0.00 0.00 0.00 17.79 17.43 1i6k h ALA 181 CO 0.00 0.37 -0.77 0.50 0.00 0.00 0.00 179.25 179.34 1i6k s ARG 182 N -3.77 0.83 1.06 0.00 3.52 -1.26 -1.22 118.95 118.11 1i6k s ARG 182 Ca -0.01 -1.44 -0.16 0.00 -0.13 0.00 0.00 55.73 54.00 1i6k s ARG 182 Cb 0.11 -0.89 0.22 0.00 -1.56 0.00 0.00 34.95 32.83 1i6k s ARG 182 CO 0.66 -1.30 1.13 0.42 -0.81 0.00 0.00 175.30 175.40 1i6k s ILE 183 N 0.74 1.84 0.04 4.11 -1.09 -1.26 -5.01 121.20 120.56 1i6k s ILE 183 Ca 0.26 0.00 -0.10 0.00 -2.23 0.00 0.00 60.65 58.58 1i6k s ILE 183 Cb -0.05 -2.60 -0.05 0.00 -1.58 0.00 0.00 42.46 38.18 1i6k s ILE 183 CO -0.10 0.00 0.36 -0.55 -1.23 0.00 0.00 174.94 173.43 1i6k s SER 185 N -3.90 6.62 0.44 3.58 0.15 0.81 -4.67 113.70 116.73 1i6k s SER 185 Ca 0.68 0.75 0.23 0.00 0.70 0.00 0.00 55.95 58.32 1i6k s SER 185 Cb -0.13 -2.16 0.40 0.00 -1.71 0.00 0.00 66.02 62.42 1i6k s SER 185 CO 0.56 0.22 1.63 -0.07 1.20 0.00 0.00 173.24 176.78 1i6k h LEU 186 N 3.97 0.00 0.14 3.45 3.38 -1.49 -3.12 115.31 121.64 1i6k h LEU 186 Ca -0.50 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.12 1i6k h LEU 186 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1i6k h LEU 186 CO 0.65 0.04 -1.83 0.58 0.09 0.00 0.00 178.44 177.97 1i6k h VAL 187 N 0.00 0.83 -2.78 1.22 2.07 -1.78 -0.10 116.25 115.70 1i6k h VAL 187 Ca -0.00 -2.49 -0.54 0.00 0.82 0.00 0.00 66.70 64.49 1i6k h VAL 187 Cb 0.99 2.64 -0.40 0.00 -1.52 0.00 0.00 31.29 33.00 1i6k h VAL 187 CO 0.01 0.85 -0.79 -0.62 0.02 0.00 0.00 177.57 177.04 1i6k s ASP 188 N -7.08 3.48 0.00 0.57 -1.08 -1.24 -4.69 116.67 106.62 1i6k s ASP 188 Ca -0.17 -1.48 0.10 0.00 -0.52 0.00 0.00 52.55 50.48 1i6k s ASP 188 Cb 0.06 -0.40 0.58 0.00 -1.46 0.00 0.00 42.92 41.70 1i6k s ASP 188 CO 0.82 -0.41 1.02 -0.81 0.52 0.00 0.00 175.17 176.30 1i6k n PRO 189 N 5.00 0.48 0.00 4.34 -0.04 -1.18 -1.65 135.00 141.95 1i6k n PRO 189 Ca -0.03 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.55 1i6k n PRO 189 Cb 0.41 -1.31 0.15 0.00 -0.04 0.00 0.00 33.50 32.71 1i6k n PRO 189 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1i6k n THR 190 N -0.81 0.00 -4.22 0.52 -2.24 -1.26 -4.74 114.28 101.52 1i6k n THR 190 Ca 0.07 -0.09 -0.30 0.00 -2.27 0.00 0.00 64.05 61.46 1i6k n THR 190 Cb 0.03 0.66 -0.09 0.00 -2.10 0.00 0.00 70.33 68.83 1i6k n THR 190 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1i6k s LYS 191 N -2.76 2.36 0.00 -0.78 1.02 -0.66 -5.04 119.74 113.88 1i6k s LYS 191 Ca 0.16 -0.90 0.00 0.00 0.02 0.00 0.00 55.97 55.24 1i6k s LYS 191 Cb 0.18 -2.43 0.00 0.00 -0.52 0.00 0.00 37.83 35.06 1i6k s LYS 191 CO 0.66 0.54 0.00 1.17 -0.92 0.00 0.00 175.35 176.80 1i6k n LYS 192 N 0.79 0.00 0.00 1.68 4.81 -1.26 -0.13 118.16 124.04 1i6k n LYS 192 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.31 1i6k n LYS 192 Cb 0.52 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.57 1i6k n LYS 192 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1i6k n SER 194 N 0.00 0.00 0.28 3.14 2.88 -1.26 -4.06 113.62 114.60 1i6k n SER 194 Ca 0.00 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.73 1i6k n SER 194 Cb 0.00 0.00 0.98 0.00 -0.75 0.00 0.00 64.21 64.44 1i6k n SER 194 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 1i6k h LYS 195 N 0.00 0.00 -0.43 -1.46 2.10 -2.01 -1.86 116.57 112.90 1i6k h LYS 195 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1i6k h LYS 195 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1i6k h LYS 195 CO 0.00 0.00 0.00 -1.13 -2.00 0.00 0.00 179.45 176.32 1i6k n SER 196 N -2.84 3.62 -4.71 7.07 3.41 -1.26 -4.66 113.62 114.25 1i6k n SER 196 Ca -0.02 -2.31 -0.42 0.00 -0.26 0.00 0.00 58.87 55.86 1i6k n SER 196 Cb 0.09 -0.40 -0.03 0.00 -0.26 0.00 0.00 64.21 63.61 1i6k n SER 196 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1i6k s ASP 197 N -1.18 6.50 0.58 4.04 -1.08 -0.70 -4.83 116.67 119.99 1i6k s ASP 197 Ca 0.36 2.70 0.34 0.00 -0.52 0.00 0.00 52.55 55.43 1i6k s ASP 197 Cb 0.22 -2.59 1.78 0.00 -1.46 0.00 0.00 42.92 40.87 1i6k s ASP 197 CO 0.18 -0.90 2.17 -0.65 0.52 0.00 0.00 175.17 176.48 1i6k h PRO 198 N 7.21 0.00 -4.70 4.34 0.11 -1.94 -3.39 132.00 133.63 1i6k h PRO 198 Ca -0.43 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 64.97 1i6k h PRO 198 Cb 1.20 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.12 1i6k h PRO 198 CO 0.94 0.05 -0.12 1.21 -0.21 0.00 0.00 178.00 179.86 1i6k s ASN 199 N -5.77 6.19 0.45 -2.05 3.84 -1.26 -4.93 114.94 111.41 1i6k s ASN 199 Ca -0.03 -1.06 0.30 0.00 0.21 0.00 0.00 52.86 52.28 1i6k s ASN 199 Cb 0.12 -2.24 1.61 0.00 -0.55 0.00 0.00 41.25 40.19 1i6k s ASN 199 CO 0.52 -0.77 1.91 1.55 -2.79 0.00 0.00 177.10 177.52 1i6k h PRO 200 N 8.88 0.00 0.00 0.43 0.13 -1.93 0.52 132.00 140.03 1i6k h PRO 200 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1i6k h PRO 200 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1i6k h PRO 200 CO 0.92 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.32 1i6k n LYS 201 N -2.55 0.01 0.13 0.86 4.76 -1.26 -3.22 118.16 116.90 1i6k n LYS 201 Ca -0.02 0.07 -0.00 0.00 -2.87 0.00 0.00 58.31 55.48 1i6k n LYS 201 Cb 0.06 -1.52 0.14 0.00 -1.84 0.00 0.00 35.03 31.87 1i6k n LYS 201 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1i6k h ALA 202 N 2.86 0.83 -2.21 7.82 0.00 -1.27 -3.39 119.26 123.90 1i6k h ALA 202 Ca 0.00 -0.57 -0.42 0.00 0.00 0.00 0.00 54.91 53.92 1i6k h ALA 202 Cb 0.45 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.00 1i6k h ALA 202 CO 0.00 0.78 -0.72 1.52 0.00 0.00 0.00 179.25 180.83 1i6k s TYR 203 N -3.37 1.61 -0.20 0.00 -0.85 -1.20 -1.53 117.35 111.81 1i6k s TYR 203 Ca -0.00 -0.64 -0.03 0.00 -0.52 0.00 0.00 57.07 55.88 1i6k s TYR 203 Cb 0.11 -0.78 -0.01 0.00 0.38 0.00 0.00 41.96 41.66 1i6k s TYR 203 CO 0.75 0.27 -0.07 0.42 -1.52 0.00 0.00 175.55 175.40 1i6k s ILE 204 N -3.08 3.19 0.56 -3.49 1.01 -1.26 -4.96 121.20 113.17 1i6k s ILE 204 Ca 0.22 -0.56 -0.15 0.00 0.00 0.00 0.00 60.65 60.16 1i6k s ILE 204 Cb 0.01 -2.43 -0.06 0.00 0.01 0.00 0.00 42.46 39.99 1i6k s ILE 204 CO 0.06 0.45 1.01 0.42 0.00 0.00 0.00 174.94 176.87 1i6k s THR 205 N 1.30 4.51 -0.70 2.92 -4.23 -1.26 -0.58 115.64 117.60 1i6k s THR 205 Ca 0.04 1.07 0.17 0.00 -1.18 0.00 0.00 61.69 61.79 1i6k s THR 205 Cb -0.14 -3.72 0.16 0.00 1.34 0.00 0.00 72.50 70.14 1i6k s THR 205 CO -0.03 -0.81 1.51 0.18 -0.54 0.00 0.00 174.62 174.93 1i6k n LEU 206 N -2.00 0.32 -0.89 4.79 4.77 -0.33 -2.16 117.00 121.50 1i6k n LEU 206 Ca 0.07 0.60 0.08 0.00 -0.03 0.00 0.00 56.01 56.72 1i6k n LEU 206 Cb 0.54 -0.58 0.21 0.00 -2.33 0.00 0.00 43.42 41.26 1i6k n LEU 206 CO 0.50 -0.50 0.67 0.18 -1.33 0.00 0.00 177.39 176.91 1i6k n LEU 207 N -1.88 3.24 -4.74 2.23 4.77 -1.26 -4.68 117.00 114.67 1i6k n LEU 207 Ca 0.02 -1.91 -0.41 0.00 -0.03 0.00 0.00 56.01 53.68 1i6k n LEU 207 Cb 0.15 -0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 40.91 1i6k n LEU 207 CO 0.13 0.79 1.04 -1.81 -1.33 0.00 0.00 177.39 176.21 1i6k s ASP 208 N -1.03 6.77 0.87 -1.43 1.11 -0.92 -5.02 116.67 117.03 1i6k s ASP 208 Ca 0.32 2.56 -0.13 0.00 0.18 0.00 0.00 52.55 55.48 1i6k s ASP 208 Cb 0.17 -2.62 0.12 0.00 1.07 0.00 0.00 42.92 41.65 1i6k s ASP 208 CO 0.22 -0.61 1.17 1.51 1.18 0.00 0.00 175.17 178.65 1i6k s ASP 209 N 0.24 3.93 0.19 0.27 1.47 -1.26 -4.77 116.67 116.73 1i6k s ASP 209 Ca 0.57 0.82 -0.12 0.00 1.18 0.00 0.00 52.55 54.99 1i6k s ASP 209 Cb -0.39 -1.30 0.16 0.00 -0.34 0.00 0.00 42.92 41.04 1i6k s ASP 209 CO 0.42 -2.27 1.79 0.00 0.68 0.00 0.00 175.17 175.79 1i6k h ALA 210 N -1.31 0.70 -0.88 2.11 0.00 -1.97 -0.90 119.26 117.01 1i6k h ALA 210 Ca -0.48 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1i6k h ALA 210 Cb 1.32 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 1i6k h ALA 210 CO 0.62 -0.05 0.46 -0.22 0.00 0.00 0.00 179.25 180.06 1i6k h LYS 211 N 0.55 1.24 -0.44 0.00 3.64 -1.99 -0.98 116.57 118.58 1i6k h LYS 211 Ca 0.24 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 1i6k h LYS 211 Cb 0.13 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 1i6k h LYS 211 CO -0.16 0.92 0.07 1.15 -2.27 0.00 0.00 179.45 179.16 1i6k h THR 212 N 1.24 1.24 -0.67 1.00 2.02 -1.81 -0.98 112.91 114.95 1i6k h THR 212 Ca 0.31 -0.88 -0.03 0.00 0.77 0.00 0.00 66.41 66.57 1i6k h THR 212 Cb 0.05 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 1i6k h THR 212 CO -0.05 0.31 0.29 0.40 0.37 0.00 0.00 175.52 176.84 1i6k h ILE 213 N 0.58 1.24 -0.26 3.11 2.04 -0.91 -0.47 117.51 122.84 1i6k h ILE 213 Ca 0.13 -0.71 -0.00 0.00 1.00 0.00 0.00 64.86 65.28 1i6k h ILE 213 Cb 0.37 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1i6k h ILE 213 CO 0.01 0.29 0.16 -0.33 0.00 0.00 0.00 178.15 178.27 1i6k h GLU 214 N 0.94 0.35 -0.58 2.37 5.08 -0.85 -0.58 114.58 121.31 1i6k h GLU 214 Ca 0.23 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.62 1i6k h GLU 214 Cb 0.18 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 1i6k h GLU 214 CO -0.02 0.27 0.28 0.87 -1.00 0.00 0.00 179.01 179.42 1i6k h LYS 215 N 0.33 0.52 -0.38 2.33 1.57 -0.82 0.05 116.57 120.16 1i6k h LYS 215 Ca 0.09 -0.03 -0.15 0.00 -1.87 0.00 0.00 60.65 58.70 1i6k h LYS 215 Cb 0.01 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1i6k h LYS 215 CO -0.02 0.34 -0.34 0.87 -0.57 0.00 0.00 179.45 179.73 1i6k h LYS 216 N 0.53 0.88 -0.19 3.15 1.57 -0.74 -1.71 116.57 120.05 1i6k h LYS 216 Ca 0.27 -0.43 -0.09 0.00 -1.87 0.00 0.00 60.65 58.53 1i6k h LYS 216 Cb 0.21 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 1i6k h LYS 216 CO -0.20 1.08 -0.22 0.82 -0.57 0.00 0.00 179.45 180.36 1i6k h ILE 217 N 0.73 1.33 -0.73 1.86 1.08 -0.93 -2.37 117.51 118.48 1i6k h ILE 217 Ca 0.07 -1.40 0.02 0.00 -0.39 0.00 0.00 64.86 63.16 1i6k h ILE 217 Cb 0.91 1.79 -0.04 0.00 -3.07 0.00 0.00 36.82 36.42 1i6k h ILE 217 CO 0.08 0.42 0.47 0.11 -0.69 0.00 0.00 178.15 178.55 1i6k h LYS 218 N 0.16 0.92 0.00 2.37 6.56 -0.95 -2.04 116.57 123.59 1i6k h LYS 218 Ca 0.03 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 1i6k h LYS 218 Cb 0.77 -0.21 0.00 0.00 -0.57 0.00 0.00 32.23 32.22 1i6k h LYS 218 CO 0.05 0.61 0.00 0.43 -2.06 0.00 0.00 179.45 178.48 1i6k n SER 219 N -4.61 0.25 -4.67 0.86 7.64 -0.65 -4.87 113.62 107.57 1i6k n SER 219 Ca 0.07 0.54 -0.51 0.00 1.01 0.00 0.00 58.87 59.99 1i6k n SER 219 Cb 0.05 -0.60 -0.05 0.00 -1.01 0.00 0.00 64.21 62.59 1i6k n SER 219 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1i6k n ALA 220 N -1.60 0.43 -1.72 -0.43 0.00 -0.77 -4.86 120.51 111.57 1i6k n ALA 220 Ca 0.05 0.38 -0.42 0.00 0.00 0.00 0.00 53.44 53.44 1i6k n ALA 220 Cb 0.28 -2.34 -0.03 0.00 0.00 0.00 0.00 19.45 17.37 1i6k n ALA 220 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1i6k n VAL 221 N 4.29 0.08 0.00 0.00 0.31 -0.05 -4.97 118.33 117.98 1i6k n VAL 221 Ca 0.22 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.53 1i6k n VAL 221 Cb 0.24 -1.96 0.00 0.00 -0.91 0.00 0.00 33.84 31.21 1i6k n VAL 221 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1i6k n THR 222 N 3.81 0.00 -3.39 2.52 -2.24 -1.26 -4.42 114.28 109.29 1i6k n THR 222 Ca 0.16 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.90 1i6k n THR 222 Cb 0.35 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 1i6k n THR 222 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1i6k n ASP 223 N 0.00 -0.57 -2.53 3.42 5.68 -1.26 -4.66 116.55 116.63 1i6k n ASP 223 Ca 0.00 -1.49 -0.30 0.00 -0.50 0.00 0.00 54.79 52.50 1i6k n ASP 223 Cb 0.00 0.98 0.01 0.00 -1.14 0.00 0.00 41.12 40.97 1i6k n ASP 223 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1i6k n SER 224 N -1.43 5.45 -0.05 -1.12 3.41 -1.26 -4.58 113.62 114.03 1i6k n SER 224 Ca -0.02 -3.75 -0.05 0.00 -0.26 0.00 0.00 58.87 54.79 1i6k n SER 224 Cb 0.17 -0.60 -0.08 0.00 -0.26 0.00 0.00 64.21 63.44 1i6k n SER 224 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1i6k n GLU 225 N -0.53 2.21 -1.38 4.33 1.02 -1.26 -4.98 120.64 120.06 1i6k n GLU 225 Ca 0.44 -0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.45 1i6k n GLU 225 Cb 0.60 -1.26 -0.06 0.00 -0.02 0.00 0.00 31.44 30.70 1i6k n GLU 225 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1i6k n GLY 226 N 2.39 1.29 3.36 0.62 0.00 -1.26 -4.95 105.19 106.64 1i6k n GLY 226 Ca -0.17 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 1i6k n GLY 226 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i6k s THR 227 N -2.23 3.23 -1.01 2.61 2.01 -1.26 -4.63 115.64 114.35 1i6k s THR 227 Ca 0.00 -0.58 -0.14 0.00 0.31 0.00 0.00 61.69 61.28 1i6k s THR 227 Cb 0.00 -2.40 0.20 0.00 0.01 0.00 0.00 72.50 70.31 1i6k s THR 227 CO 0.00 0.49 1.09 -0.63 -0.69 0.00 0.00 174.62 174.88 1i6k s ILE 228 N 0.73 5.38 0.00 1.82 1.01 -1.26 -4.95 121.20 123.93 1i6k s ILE 228 Ca -0.04 -2.55 0.01 0.00 0.00 0.00 0.00 60.65 58.07 1i6k s ILE 228 Cb -0.15 -4.68 -0.01 0.00 0.01 0.00 0.00 42.46 37.63 1i6k s ILE 228 CO 0.02 -1.32 -0.04 -0.60 0.00 0.00 0.00 174.94 173.00 1i6k s ARG 229 N 0.70 0.33 -0.08 2.79 3.52 -1.26 -4.61 118.95 120.34 1i6k s ARG 229 Ca 0.30 -0.24 -0.30 0.00 -0.13 0.00 0.00 55.73 55.37 1i6k s ARG 229 Cb -0.07 -0.26 -0.02 0.00 -1.56 0.00 0.00 34.95 33.04 1i6k s ARG 229 CO -0.07 0.07 0.99 -0.47 -0.81 0.00 0.00 175.30 175.01 1i6k s TYR 230 N -0.34 3.55 -0.45 5.12 5.04 -1.26 -4.60 117.35 124.42 1i6k s TYR 230 Ca -0.01 1.61 0.04 0.00 -2.44 0.00 0.00 57.07 56.27 1i6k s TYR 230 Cb -0.03 -3.16 0.19 0.00 0.35 0.00 0.00 41.96 39.31 1i6k s TYR 230 CO -0.00 -0.16 0.77 0.34 -1.34 0.00 0.00 175.55 175.16 1i6k s ASP 231 N 1.07 -1.24 0.26 4.32 -1.08 -1.26 -5.05 116.67 113.70 1i6k s ASP 231 Ca 0.49 -1.12 -0.06 0.00 -0.52 0.00 0.00 52.55 51.34 1i6k s ASP 231 Cb -0.19 1.60 0.49 0.00 -1.46 0.00 0.00 42.92 43.36 1i6k s ASP 231 CO 0.21 -0.08 1.62 0.50 0.52 0.00 0.00 175.17 177.93 1i6k h LYS 232 N 5.58 0.08 0.08 4.34 3.64 -1.93 0.47 116.57 128.82 1i6k h LYS 232 Ca 0.04 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1i6k h LYS 232 Cb 1.15 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1i6k h LYS 232 CO 0.02 0.05 -0.04 0.93 -2.27 0.00 0.00 179.45 178.14 1i6k h GLU 233 N 0.08 -0.10 0.15 1.90 4.39 -1.97 -3.01 114.58 116.03 1i6k h GLU 233 Ca 0.45 0.01 -0.29 0.00 0.34 0.00 0.00 59.36 59.86 1i6k h GLU 233 Cb 0.81 0.02 0.02 0.00 -0.10 0.00 0.00 28.75 29.50 1i6k h GLU 233 CO -0.73 0.34 -1.28 0.00 -1.16 0.00 0.00 179.01 176.18 1i6k h ALA 234 N 0.27 0.04 -2.12 3.43 0.00 -1.91 -3.39 119.26 115.57 1i6k h ALA 234 Ca -0.01 -0.85 -0.58 0.00 0.00 0.00 0.00 54.91 53.47 1i6k h ALA 234 Cb 0.49 0.07 -0.41 0.00 0.00 0.00 0.00 17.79 17.94 1i6k h ALA 234 CO 0.02 0.85 -0.81 1.63 0.00 0.00 0.00 179.25 180.93 1i6k n LYS 235 N -3.63 1.86 -0.20 0.00 5.02 0.16 -4.96 118.16 116.40 1i6k n LYS 235 Ca -0.11 -4.10 -0.03 0.00 -2.02 0.00 0.00 58.31 52.04 1i6k n LYS 235 Cb 1.03 -1.85 0.07 0.00 -0.02 0.00 0.00 35.03 34.25 1i6k n LYS 235 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1i6k h PRO 236 N 3.95 0.62 0.56 1.97 0.13 -1.62 -1.94 132.00 135.68 1i6k h PRO 236 Ca 0.14 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 65.22 1i6k h PRO 236 Cb 0.74 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 1i6k h PRO 236 CO 0.68 0.41 -0.40 0.78 -0.23 0.00 0.00 178.00 179.25 1i6k h GLY 237 N 0.64 -1.03 1.64 1.56 0.00 -1.83 -1.77 103.07 102.27 1i6k h GLY 237 Ca 0.26 0.45 -0.05 0.00 0.00 0.00 0.00 47.33 47.99 1i6k h GLY 237 CO -0.15 -0.36 -0.02 -2.22 0.00 0.00 0.00 176.54 173.80 1i6k h ILE 238 N -0.93 1.19 -0.41 2.60 1.08 -1.78 -1.73 117.51 117.52 1i6k h ILE 238 Ca -0.07 -0.75 -0.09 0.00 -0.39 0.00 0.00 64.86 63.56 1i6k h ILE 238 Cb 0.77 0.98 -0.01 0.00 -3.07 0.00 0.00 36.82 35.49 1i6k h ILE 238 CO 0.03 0.25 -0.11 0.28 -0.69 0.00 0.00 178.15 177.92 1i6k h SER 239 N 0.44 0.81 -0.68 1.72 0.02 -1.24 0.39 113.55 115.01 1i6k h SER 239 Ca 0.10 -0.37 -0.05 0.00 -0.84 0.00 0.00 61.79 60.63 1i6k h SER 239 Cb 0.32 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 1i6k h SER 239 CO 0.01 0.99 0.24 -1.13 -1.14 0.00 0.00 176.83 175.80 1i6k h ASN 240 N 0.62 0.97 -0.61 3.07 -1.24 -1.14 0.20 115.58 117.45 1i6k h ASN 240 Ca 0.10 -0.19 -0.06 0.00 0.71 0.00 0.00 56.30 56.86 1i6k h ASN 240 Cb 0.64 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 39.41 1i6k h ASN 240 CO 0.04 0.90 0.16 -0.07 -1.29 0.00 0.00 177.43 177.17 1i6k h LEU 241 N 0.98 0.94 -0.94 0.34 3.38 -0.98 -1.22 115.31 117.81 1i6k h LEU 241 Ca 0.22 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1i6k h LEU 241 Cb 0.26 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1i6k h LEU 241 CO -0.01 0.91 0.11 -0.07 0.09 0.00 0.00 178.44 179.46 1i6k h LEU 242 N 0.96 0.83 -0.68 1.67 3.38 -0.40 -0.64 115.31 120.43 1i6k h LEU 242 Ca 0.20 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1i6k h LEU 242 Cb 0.33 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1i6k h LEU 242 CO -0.00 0.83 0.07 0.78 0.09 0.00 0.00 178.44 180.21 1i6k h ASN 243 N 0.84 1.05 -0.26 -0.43 2.35 -0.01 0.49 115.58 119.62 1i6k h ASN 243 Ca 0.18 -0.27 -0.04 0.00 -0.55 0.00 0.00 56.30 55.62 1i6k h ASN 243 Cb 0.35 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1i6k h ASN 243 CO 0.00 1.06 0.00 0.40 -1.65 0.00 0.00 177.43 177.25 1i6k h ILE 244 N 1.01 1.25 0.08 2.81 5.03 -0.88 -1.48 117.51 125.34 1i6k h ILE 244 Ca 0.19 -0.90 -0.00 0.00 -0.12 0.00 0.00 64.86 64.03 1i6k h ILE 244 Cb 0.48 1.34 0.00 0.00 -3.03 0.00 0.00 36.82 35.61 1i6k h ILE 244 CO 0.02 0.28 -0.04 0.22 -0.68 0.00 0.00 178.15 177.95 1i6k h TYR 245 N 0.23 -0.10 0.42 1.37 -0.00 -0.95 -1.31 116.97 116.63 1i6k h TYR 245 Ca 0.07 -0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.79 1i6k h TYR 245 Cb 0.41 0.03 -0.01 0.00 -0.00 0.00 0.00 36.73 37.16 1i6k h TYR 245 CO 0.03 -0.06 -0.29 1.03 -0.00 0.00 0.00 178.16 178.87 1i6k h SER 246 N -0.11 -0.74 -0.85 -2.11 0.87 -0.85 0.17 113.55 109.92 1i6k h SER 246 Ca -0.01 0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.62 1i6k h SER 246 Cb 0.09 0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 62.23 1i6k h SER 246 CO 0.02 -0.45 0.56 0.71 -0.53 0.00 0.00 176.83 177.14 1i6k h THR 247 N -0.69 1.19 0.00 2.23 1.35 -1.26 0.46 112.91 116.19 1i6k h THR 247 Ca -0.04 -0.39 -0.17 0.00 -0.55 0.00 0.00 66.41 65.26 1i6k h THR 247 Cb 0.58 -0.03 -0.02 0.00 -1.73 0.00 0.00 68.15 66.95 1i6k h THR 247 CO 0.02 0.21 -0.81 -0.07 -0.25 0.00 0.00 175.52 174.62 1i6k h LEU 248 N 1.13 0.00 0.00 3.87 3.38 -1.10 -3.33 115.31 119.26 1i6k h LEU 248 Ca 0.32 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.21 1i6k h LEU 248 Cb -0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1i6k h LEU 248 CO -0.08 0.81 -1.56 -1.54 0.09 0.00 0.00 178.44 176.16 1i6k n SER 249 N -3.43 0.50 0.00 -0.43 3.41 0.03 -4.96 113.62 108.74 1i6k n SER 249 Ca 0.00 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.82 1i6k n SER 249 Cb 0.82 0.92 0.00 0.00 -0.26 0.00 0.00 64.21 65.68 1i6k n SER 249 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i6k n GLY 250 N 1.32 1.38 3.81 5.00 0.00 0.14 -5.03 105.19 111.81 1i6k n GLY 250 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1i6k n GLY 250 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1i6k s GLN 251 N -0.43 4.28 0.72 1.61 -0.21 -1.20 -5.00 119.66 119.42 1i6k s GLN 251 Ca 0.00 0.98 -0.11 0.00 0.02 0.00 0.00 55.36 56.25 1i6k s GLN 251 Cb 0.00 -2.64 0.02 0.00 1.00 0.00 0.00 33.01 31.39 1i6k s GLN 251 CO 0.00 0.24 1.08 -1.54 -2.12 0.00 0.00 175.29 172.95 1i6k s SER 252 N -1.87 5.25 0.24 5.90 1.04 -1.26 -4.26 113.70 118.74 1i6k s SER 252 Ca 0.51 1.34 -0.07 0.00 0.48 0.00 0.00 55.95 58.21 1i6k s SER 252 Cb -0.14 -2.18 0.26 0.00 0.10 0.00 0.00 66.02 64.06 1i6k s SER 252 CO 0.19 -1.49 1.90 0.40 0.98 0.00 0.00 173.24 175.22 1i6k h ILE 253 N -0.75 1.18 -0.22 -1.02 1.08 -1.94 -1.14 117.51 114.69 1i6k h ILE 253 Ca -0.45 -0.41 -0.01 0.00 -0.39 0.00 0.00 64.86 63.60 1i6k h ILE 253 Cb 1.24 -0.10 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 1i6k h ILE 253 CO 0.61 0.22 0.08 -0.33 -0.69 0.00 0.00 178.15 178.03 1i6k h GLU 254 N 1.18 0.33 -0.28 2.37 5.08 -1.99 -0.86 114.58 120.41 1i6k h GLU 254 Ca 0.35 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.71 1i6k h GLU 254 Cb -0.05 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.08 1i6k h GLU 254 CO -0.10 0.40 -0.15 0.93 -1.00 0.00 0.00 179.01 179.09 1i6k h GLU 255 N 0.20 -0.11 -0.69 2.33 5.08 -1.76 -1.76 114.58 117.87 1i6k h GLU 255 Ca 0.07 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1i6k h GLU 255 Cb 0.19 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 1i6k h GLU 255 CO -0.01 -0.07 0.26 -0.07 -1.00 0.00 0.00 179.01 178.13 1i6k h LEU 256 N -0.11 0.94 -0.90 1.33 3.38 -1.06 0.13 115.31 119.01 1i6k h LEU 256 Ca 0.15 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1i6k h LEU 256 Cb 0.33 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1i6k h LEU 256 CO -0.35 0.85 0.30 -0.33 0.09 0.00 0.00 178.44 179.00 1i6k h GLU 257 N 1.00 1.10 -0.11 1.13 5.08 -0.67 -1.37 114.58 120.74 1i6k h GLU 257 Ca 0.23 -0.19 -0.11 0.00 -1.00 0.00 0.00 59.36 58.29 1i6k h GLU 257 Cb 0.21 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1i6k h GLU 257 CO -0.02 0.89 -0.38 0.00 -1.00 0.00 0.00 179.01 178.50 1i6k h ARG 258 N 1.07 0.45 -0.42 2.33 3.08 -0.98 -2.03 114.38 117.88 1i6k h ARG 258 Ca 0.25 -0.34 0.12 0.00 0.07 0.00 0.00 59.98 60.08 1i6k h ARG 258 Cb 0.20 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1i6k h ARG 258 CO -0.02 0.96 0.31 0.37 -1.07 0.00 0.00 179.97 180.53 1i6k h GLN 259 N 0.02 0.00 -0.27 0.04 4.15 -0.75 -1.40 115.11 116.90 1i6k h GLN 259 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1i6k h GLN 259 Cb 1.01 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.70 1i6k h GLN 259 CO 0.08 0.00 0.00 0.66 -1.93 0.00 0.00 178.83 177.64 1i6k n TYR 260 N -4.34 0.76 -1.69 3.99 4.01 -0.54 -4.93 117.16 114.42 1i6k n TYR 260 Ca 0.07 -0.76 -0.44 0.00 -0.16 0.00 0.00 57.90 56.61 1i6k n TYR 260 Cb 0.51 -0.22 -0.04 0.00 -0.31 0.00 0.00 39.34 39.28 1i6k n TYR 260 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 1i6k n GLU 261 N -0.22 2.48 0.00 -0.72 2.13 -0.53 -0.82 120.64 122.95 1i6k n GLU 261 Ca 0.18 0.90 0.00 0.00 0.66 0.00 0.00 57.16 58.89 1i6k n GLU 261 Cb 0.73 -2.72 0.00 0.00 0.27 0.00 0.00 31.44 29.73 1i6k n GLU 261 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1i6k n GLY 262 N 3.79 2.68 3.89 8.31 0.00 -1.26 -5.00 105.19 117.60 1i6k n GLY 262 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1i6k n GLY 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i6k s LYS 263 N 0.00 3.44 0.47 1.61 1.02 -0.00 -5.10 119.74 121.19 1i6k s LYS 263 Ca 0.00 0.39 0.08 0.00 0.02 0.00 0.00 55.97 56.46 1i6k s LYS 263 Cb 0.00 -2.23 0.03 0.00 -0.52 0.00 0.00 37.83 35.11 1i6k s LYS 263 CO 0.00 -0.45 0.65 0.20 -0.92 0.00 0.00 175.35 174.82 1i6k s GLY 264 N -4.17 1.89 0.46 -3.33 0.00 -1.26 -4.67 107.32 96.23 1i6k s GLY 264 Ca 0.52 -1.75 0.17 0.00 0.00 0.00 0.00 44.72 43.66 1i6k s GLY 264 CO 0.49 -1.49 2.00 -0.97 0.00 0.00 0.00 173.10 173.12 1i6k h TYR 265 N 0.47 0.00 0.21 1.90 0.99 -1.98 -2.98 116.97 115.58 1i6k h TYR 265 Ca -0.38 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.34 1i6k h TYR 265 Cb 1.28 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.01 1i6k h TYR 265 CO 0.39 0.18 -0.11 0.78 -0.00 0.00 0.00 178.16 179.41 1i6k h GLY 266 N 0.64 -0.31 1.06 3.88 0.00 -1.99 0.10 103.07 106.45 1i6k h GLY 266 Ca -0.00 0.12 -0.09 0.00 0.00 0.00 0.00 47.33 47.36 1i6k h GLY 266 CO 0.02 -0.12 -0.00 -0.24 0.00 0.00 0.00 176.54 176.20 1i6k h VAL 267 N -0.30 1.26 -0.03 4.60 3.04 -1.96 -1.84 116.25 121.02 1i6k h VAL 267 Ca -0.03 -1.13 0.03 0.00 -1.01 0.00 0.00 66.70 64.56 1i6k h VAL 267 Cb 0.24 0.87 -0.04 0.00 -2.01 0.00 0.00 31.29 30.35 1i6k h VAL 267 CO 0.04 0.41 -0.17 0.15 -1.01 0.00 0.00 177.57 176.99 1i6k h PHE 268 N 0.89 -0.43 -0.85 3.17 3.57 -1.36 -1.04 116.94 120.88 1i6k h PHE 268 Ca 0.16 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 1i6k h PHE 268 Cb 0.55 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.45 1i6k h PHE 268 CO 0.04 -0.24 0.44 0.87 -2.23 0.00 0.00 178.31 177.19 1i6k h LYS 269 N -0.26 1.21 -0.67 1.11 1.57 -0.74 0.12 116.57 118.92 1i6k h LYS 269 Ca 0.06 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.60 1i6k h LYS 269 Cb 0.34 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1i6k h LYS 269 CO -0.18 0.91 0.10 0.00 -0.57 0.00 0.00 179.45 179.70 1i6k h ALA 270 N 1.27 0.89 -0.40 3.86 0.00 -0.90 -0.85 119.26 123.13 1i6k h ALA 270 Ca 0.30 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1i6k h ALA 270 Cb 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1i6k h ALA 270 CO -0.04 0.67 -0.30 -0.44 0.00 0.00 0.00 179.25 179.14 1i6k h ASP 271 N 1.04 0.96 -0.13 0.00 3.45 -0.83 -2.45 116.42 118.46 1i6k h ASP 271 Ca 0.20 -0.44 -0.00 0.00 0.43 0.00 0.00 57.03 57.22 1i6k h ASP 271 Cb 0.45 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.95 1i6k h ASP 271 CO 0.01 1.19 0.07 0.25 -1.57 0.00 0.00 179.24 179.19 1i6k h LEU 272 N 0.73 0.17 -1.09 1.55 5.85 -0.49 -1.41 115.31 120.62 1i6k h LEU 272 Ca 0.08 -0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.76 1i6k h LEU 272 Cb 0.88 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.80 1i6k h LEU 272 CO 0.08 0.24 0.61 0.00 -0.34 0.00 0.00 178.44 179.03 1i6k h ALA 273 N 0.94 1.49 -0.61 1.25 0.00 -1.12 0.14 119.26 121.36 1i6k h ALA 273 Ca 0.05 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1i6k h ALA 273 Cb 0.11 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1i6k h ALA 273 CO -0.01 0.35 0.05 0.37 0.00 0.00 0.00 179.25 180.01 1i6k h GLN 274 N 1.06 1.02 -0.52 0.00 5.75 -0.98 -0.36 115.11 121.09 1i6k h GLN 274 Ca 0.42 -0.29 -0.03 0.00 -0.15 0.00 0.00 58.65 58.60 1i6k h GLN 274 Cb 0.24 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.66 1i6k h GLN 274 CO -0.17 0.97 0.19 0.28 -2.65 0.00 0.00 178.83 177.45 1i6k h VAL 275 N 0.95 1.22 -0.59 2.39 2.07 0.01 0.68 116.25 122.97 1i6k h VAL 275 Ca 0.18 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 1i6k h VAL 275 Cb 0.48 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1i6k h VAL 275 CO 0.02 0.26 0.31 0.58 0.02 0.00 0.00 177.57 178.76 1i6k h VAL 276 N 0.70 1.20 -0.76 2.57 2.07 -0.53 -1.87 116.25 119.63 1i6k h VAL 276 Ca 0.17 -0.54 -0.06 0.00 0.82 0.00 0.00 66.70 67.09 1i6k h VAL 276 Cb 0.22 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 1i6k h VAL 276 CO -0.01 0.22 0.25 0.40 0.02 0.00 0.00 177.57 178.46 1i6k h ILE 277 N 0.81 1.26 -0.64 4.57 2.04 -0.71 -0.16 117.51 124.68 1i6k h ILE 277 Ca 0.21 -0.89 -0.02 0.00 1.00 0.00 0.00 64.86 65.16 1i6k h ILE 277 Cb 0.08 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 1i6k h ILE 277 CO -0.03 0.35 0.32 -0.33 0.00 0.00 0.00 178.15 178.47 1i6k h GLU 278 N 1.12 0.89 0.07 2.37 5.08 -0.51 -0.33 114.58 123.28 1i6k h GLU 278 Ca 0.25 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1i6k h GLU 278 Cb 0.29 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1i6k h GLU 278 CO -0.01 0.68 -0.04 1.15 -1.00 0.00 0.00 179.01 179.79 1i6k h THR 279 N 0.90 1.21 -0.11 1.13 2.02 -0.91 -3.37 112.91 113.78 1i6k h THR 279 Ca 0.22 -1.21 -0.15 0.00 0.77 0.00 0.00 66.41 66.05 1i6k h THR 279 Cb 0.07 1.97 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 1i6k h THR 279 CO -0.03 0.29 -0.57 -0.07 0.37 0.00 0.00 175.52 175.51 1i6k h LEU 280 N -0.67 0.39 -0.20 2.58 3.38 -0.87 -3.33 115.31 116.59 1i6k h LEU 280 Ca -0.01 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 57.80 1i6k h LEU 280 Cb 0.55 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.12 1i6k h LEU 280 CO 0.02 0.87 -0.27 -0.09 0.09 0.00 0.00 178.44 179.06 1i6k h ARG 281 N 0.26 -0.29 -0.32 1.13 2.43 -1.21 0.13 114.38 116.51 1i6k h ARG 281 Ca 0.00 0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 1i6k h ARG 281 Cb 1.08 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.68 1i6k h ARG 281 CO 0.09 -0.20 -0.09 -1.00 -1.51 0.00 0.00 179.97 177.26 1i6k h PRO 282 N -0.31 0.54 -0.20 0.20 0.13 -1.77 -1.24 132.00 129.35 1i6k h PRO 282 Ca 0.12 -0.15 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1i6k h PRO 282 Cb 0.49 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.55 1i6k h PRO 282 CO -0.37 0.63 0.09 0.82 -0.23 0.00 0.00 178.00 178.94 1i6k h ILE 283 N 0.50 1.14 -0.83 -3.56 2.04 -1.52 -1.66 117.51 113.62 1i6k h ILE 283 Ca 0.10 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 1i6k h ILE 283 Cb 0.47 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 1i6k h ILE 283 CO 0.03 0.14 0.49 1.56 0.00 0.00 0.00 178.15 180.36 1i6k h GLN 284 N 0.19 1.13 -0.39 2.37 4.20 -0.37 0.19 115.11 122.43 1i6k h GLN 284 Ca 0.07 -0.11 -0.12 0.00 0.06 0.00 0.00 58.65 58.55 1i6k h GLN 284 Cb 0.13 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1i6k h GLN 284 CO -0.01 0.80 -0.23 0.93 -0.67 0.00 0.00 178.83 179.65 1i6k h GLU 285 N 1.14 0.79 -0.55 1.46 4.39 -0.98 -1.82 114.58 119.00 1i6k h GLU 285 Ca 0.30 -0.32 -0.10 0.00 0.34 0.00 0.00 59.36 59.58 1i6k h GLU 285 Cb -0.03 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 1i6k h GLU 285 CO -0.05 0.94 -0.04 0.00 -1.16 0.00 0.00 179.01 178.69 1i6k h ARG 286 N 0.68 0.98 -0.29 2.33 3.08 -0.88 -2.87 114.38 117.42 1i6k h ARG 286 Ca 0.09 -0.32 0.03 0.00 0.07 0.00 0.00 59.98 59.85 1i6k h ARG 286 Cb 0.75 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.68 1i6k h ARG 286 CO 0.06 0.99 0.11 -0.92 -1.07 0.00 0.00 179.97 179.14 1i6k h TYR 287 N 0.89 0.20 -0.22 3.04 3.20 -0.32 -0.35 116.97 123.42 1i6k h TYR 287 Ca 0.15 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.99 1i6k h TYR 287 Cb 0.58 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 1i6k h TYR 287 CO 0.04 0.10 -0.07 0.45 -1.64 0.00 0.00 178.16 177.03 1i6k h HIS 288 N 0.25 0.35 0.01 -3.82 3.86 -1.23 -2.67 115.15 111.90 1i6k h HIS 288 Ca 0.13 -0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1i6k h HIS 288 Cb 0.08 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.45 1i6k h HIS 288 CO -0.12 0.41 -0.01 1.25 0.86 0.00 0.00 177.93 180.32 1i6k h HIS 289 N 0.32 -0.02 0.00 2.45 -0.00 -1.16 -2.89 115.15 113.86 1i6k h HIS 289 Ca 0.07 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.44 1i6k h HIS 289 Cb 0.34 0.01 0.00 0.00 -0.00 0.00 0.00 27.41 27.75 1i6k h HIS 289 CO 0.01 0.27 0.00 0.91 -0.00 0.00 0.00 177.93 179.12 1i6k n TRP 290 N -4.96 0.00 0.00 5.26 7.02 -0.21 -2.34 117.44 122.21 1i6k n TRP 290 Ca -0.08 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.40 1i6k n TRP 290 Cb 0.16 -0.13 0.00 0.00 -2.42 0.00 0.00 31.31 28.92 1i6k n TRP 290 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1i6k n GLU 292 N 1.23 0.00 -4.09 -0.99 1.02 -1.09 -4.54 120.64 112.18 1i6k n GLU 292 Ca 0.00 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.82 1i6k n GLU 292 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.35 1i6k n GLU 292 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1i6k s SER 293 N 0.00 5.55 0.37 1.62 0.15 -0.99 -4.98 113.70 115.43 1i6k s SER 293 Ca 0.00 0.05 0.26 0.00 0.70 0.00 0.00 55.95 56.96 1i6k s SER 293 Cb 0.00 -1.53 0.82 0.00 -1.71 0.00 0.00 66.02 63.60 1i6k s SER 293 CO 0.00 0.22 1.76 -0.33 1.20 0.00 0.00 173.24 176.09 1i6k h GLU 294 N 3.67 0.00 0.00 5.44 5.08 -1.92 -3.12 114.58 123.72 1i6k h GLU 294 Ca -0.48 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.86 1i6k h GLU 294 Cb 1.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 1i6k h GLU 294 CO 0.64 0.00 -0.12 0.93 -1.00 0.00 0.00 179.01 179.46 1i6k h GLU 295 N 0.00 0.00 -0.20 2.33 4.39 -1.93 -2.71 114.58 116.46 1i6k h GLU 295 Ca 0.00 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.73 1i6k h GLU 295 Cb 0.71 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.32 1i6k h GLU 295 CO 0.00 0.12 -0.01 1.25 -1.16 0.00 0.00 179.01 179.21 1i6k h LEU 296 N 0.00 -0.10 -1.02 1.33 5.85 -1.78 -1.24 115.31 118.36 1i6k h LEU 296 Ca -0.00 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.69 1i6k h LEU 296 Cb 0.38 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1i6k h LEU 296 CO 0.02 -0.02 -0.13 0.44 -0.34 0.00 0.00 178.44 178.40 1i6k h ASP 297 N 0.05 0.53 -0.54 1.25 3.32 -1.71 -2.55 116.42 116.78 1i6k h ASP 297 Ca 0.10 -0.15 -0.09 0.00 0.02 0.00 0.00 57.03 56.91 1i6k h ASP 297 Cb 0.12 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1i6k h ASP 297 CO -0.17 0.70 -0.00 0.03 -1.72 0.00 0.00 179.24 178.08 1i6k h ARG 298 N 0.50 0.99 -0.16 3.56 3.08 -1.35 0.16 114.38 121.16 1i6k h ARG 298 Ca 0.09 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 1i6k h ARG 298 Cb 0.53 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 1i6k h ARG 298 CO 0.03 0.97 0.06 0.28 -1.07 0.00 0.00 179.97 180.25 1i6k h VAL 299 N 0.91 1.15 -0.77 2.04 2.07 -1.04 -1.70 116.25 118.90 1i6k h VAL 299 Ca 0.16 -0.45 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 1i6k h VAL 299 Cb 0.53 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 1i6k h VAL 299 CO 0.03 0.14 0.29 -0.07 0.02 0.00 0.00 177.57 177.98 1i6k h LEU 300 N 0.10 1.08 -0.00 2.57 3.38 -1.23 -0.50 115.31 120.70 1i6k h LEU 300 Ca 0.05 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.86 1i6k h LEU 300 Cb 0.16 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1i6k h LEU 300 CO -0.00 0.97 -0.06 0.44 0.09 0.00 0.00 178.44 179.87 1i6k h ASP 301 N 1.13 -0.18 -0.53 -0.43 3.32 -0.50 0.46 116.42 119.69 1i6k h ASP 301 Ca 0.26 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.28 1i6k h ASP 301 Cb 0.24 0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.84 1i6k h ASP 301 CO -0.02 -0.09 0.15 -0.33 -1.72 0.00 0.00 179.24 177.23 1i6k h GLU 302 N -0.11 0.88 -0.19 3.56 5.08 -1.11 -1.57 114.58 121.12 1i6k h GLU 302 Ca 0.03 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 1i6k h GLU 302 Cb 0.14 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1i6k h GLU 302 CO -0.07 0.78 0.03 0.78 -1.00 0.00 0.00 179.01 179.53 1i6k h GLY 303 N 0.99 0.35 1.38 -3.84 0.00 -0.74 -2.49 103.07 98.72 1i6k h GLY 303 Ca 0.19 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 1i6k h GLY 303 CO -0.00 0.22 0.20 0.00 0.00 0.00 0.00 176.54 176.95 1i6k h ALA 304 N 0.82 1.33 -0.12 3.60 0.00 -0.65 -0.54 119.26 123.71 1i6k h ALA 304 Ca 0.06 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1i6k h ALA 304 Cb 0.32 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1i6k h ALA 304 CO 0.00 0.49 0.07 1.49 0.00 0.00 0.00 179.25 181.31 1i6k h GLU 305 N 0.78 0.16 -0.27 0.00 4.22 -1.13 0.34 114.58 118.68 1i6k h GLU 305 Ca 0.18 -0.02 -0.06 0.00 0.08 0.00 0.00 59.36 59.55 1i6k h GLU 305 Cb 0.18 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1i6k h GLU 305 CO -0.01 0.18 -0.07 -0.22 -2.18 0.00 0.00 179.01 176.71 1i6k h LYS 306 N 0.10 0.53 -0.57 1.92 1.63 -1.18 -2.27 116.57 116.72 1i6k h LYS 306 Ca 0.04 -0.20 0.02 0.00 -0.85 0.00 0.00 60.65 59.66 1i6k h LYS 306 Cb 0.06 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1i6k h LYS 306 CO -0.01 0.73 0.36 0.00 -3.45 0.00 0.00 179.45 177.09 1i6k h ALA 307 N 0.78 0.74 -0.85 5.00 0.00 -1.04 -2.37 119.26 121.52 1i6k h ALA 307 Ca 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1i6k h ALA 307 Cb 0.54 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1i6k h ALA 307 CO 0.03 0.12 0.47 -0.91 0.00 0.00 0.00 179.25 178.95 1i6k h ASN 308 N 0.73 1.06 -0.61 0.00 2.35 -0.85 0.12 115.58 118.38 1i6k h ASN 308 Ca 0.22 -0.10 -0.03 0.00 -0.55 0.00 0.00 56.30 55.85 1i6k h ASN 308 Cb -0.03 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.04 1i6k h ASN 308 CO -0.07 0.85 0.27 0.03 -1.65 0.00 0.00 177.43 176.86 1i6k h ARG 309 N 1.18 0.88 -0.01 0.81 3.08 -0.99 -0.78 114.38 118.55 1i6k h ARG 309 Ca 0.30 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 60.15 1i6k h ARG 309 Cb 0.02 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 29.92 1i6k h ARG 309 CO -0.05 0.73 -0.21 0.28 -1.07 0.00 0.00 179.97 179.65 1i6k h VAL 310 N 0.83 1.52 -0.43 2.04 2.07 -1.21 -3.24 116.25 117.84 1i6k h VAL 310 Ca 0.21 -1.83 -0.14 0.00 0.82 0.00 0.00 66.70 65.75 1i6k h VAL 310 Cb 0.15 2.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.57 1i6k h VAL 310 CO -0.02 0.50 -0.28 0.00 0.02 0.00 0.00 177.57 177.79 1i6k h ALA 311 N 0.30 0.69 -0.51 1.67 0.00 -0.75 -3.08 119.26 117.58 1i6k h ALA 311 Ca -0.02 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1i6k h ALA 311 Cb 0.93 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1i6k h ALA 311 CO 0.04 0.67 0.27 0.77 0.00 0.00 0.00 179.25 181.00 1i6k h SER 312 N 0.78 0.63 0.00 0.00 0.02 -1.26 -0.57 113.55 113.15 1i6k h SER 312 Ca 0.09 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1i6k h SER 312 Cb 0.85 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1i6k h SER 312 CO 0.07 0.52 0.00 1.21 -1.14 0.00 0.00 176.83 177.50 1i6k n GLU 313 N -4.40 0.62 0.00 3.45 4.07 -1.17 -1.66 120.64 121.56 1i6k n GLU 313 Ca 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 1i6k n GLU 313 Cb 0.11 -1.20 0.00 0.00 -0.06 0.00 0.00 31.44 30.29 1i6k n GLU 313 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1i6k n VAL 315 N 0.66 0.00 0.02 6.31 0.31 -0.22 -1.64 118.33 123.76 1i6k n VAL 315 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.22 1i6k n VAL 315 Cb 0.30 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.17 1i6k n VAL 315 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1i6k h ARG 316 N 0.00 0.02 -0.98 5.55 2.43 -1.58 0.78 114.38 120.60 1i6k h ARG 316 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1i6k h ARG 316 Cb 0.00 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1i6k h ARG 316 CO 0.00 0.01 0.00 1.63 -1.51 0.00 0.00 179.97 180.10 1i6k n LYS 317 N -5.10 0.00 0.00 0.20 5.02 -0.65 -0.98 118.16 116.65 1i6k n LYS 317 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1i6k n LYS 317 Cb 0.05 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1i6k n LYS 317 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1i6k n GLU 319 N 0.74 0.00 -0.28 1.97 1.02 0.27 -1.21 120.64 123.14 1i6k n GLU 319 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.12 1i6k n GLU 319 Cb 0.00 0.00 0.16 0.00 -0.02 0.00 0.00 31.44 31.58 1i6k n GLU 319 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1i6k h GLN 320 N 0.00 1.13 -0.40 3.49 4.15 -1.30 0.62 115.11 122.79 1i6k h GLN 320 Ca 0.00 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.31 1i6k h GLN 320 Cb 0.00 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 27.46 1i6k h GLN 320 CO 0.00 0.81 0.00 0.00 -1.93 0.00 0.00 178.83 177.71 1i6k n ALA 321 N -2.41 1.41 -1.86 3.38 0.00 -0.35 -4.73 120.51 115.95 1i6k n ALA 321 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1i6k n ALA 321 Cb 0.08 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1i6k n ALA 321 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i6k n GLY 323 N 0.43 0.36 3.76 0.00 0.00 0.07 -4.83 105.19 104.98 1i6k n GLY 323 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1i6k n GLY 323 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i6k s LEU 324 N 0.00 3.11 0.00 0.99 1.43 -0.38 -4.79 118.68 119.04 1i6k s LEU 324 Ca 0.00 1.91 0.00 0.00 -1.03 0.00 0.00 54.13 55.01 1i6k s LEU 324 Cb 0.00 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.69 1i6k s LEU 324 CO 0.00 -2.03 0.00 0.61 0.23 0.00 0.00 176.35 175.16 1i6k n GLY 325 N -0.88 3.51 0.00 -3.19 0.00 -1.26 -4.59 105.19 98.78 1i6k n GLY 325 Ca 0.10 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1i6k n GLY 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86