#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ck6 s VAL 10 N 0.00 4.77 -0.22 0.44 1.01 0.16 -4.83 120.40 121.73 1ck6 s VAL 10 Ca 0.00 0.64 0.01 0.00 0.00 0.00 0.00 61.98 62.63 1ck6 s VAL 10 Cb 0.00 -3.84 0.03 0.00 0.00 0.00 0.00 36.38 32.57 1ck6 s VAL 10 CO 0.00 -0.95 -0.14 -0.89 0.00 0.00 0.00 175.10 173.12 1ck6 s THR 11 N -2.90 2.33 0.62 3.92 2.01 -1.26 -0.28 115.64 120.09 1ck6 s THR 11 Ca 0.52 -1.09 -0.13 0.00 0.31 0.00 0.00 61.69 61.30 1ck6 s THR 11 Cb -0.11 -2.12 -0.03 0.00 0.01 0.00 0.00 72.50 70.25 1ck6 s THR 11 CO 0.47 0.33 1.04 0.00 -0.69 0.00 0.00 174.62 175.77 1ck6 n PRO 13 N -2.54 -0.05 0.00 0.00 -0.02 -1.26 0.89 135.00 132.03 1ck6 n PRO 13 Ca 0.07 1.29 0.04 0.00 -2.02 0.00 0.00 63.50 62.88 1ck6 n PRO 13 Cb 0.54 -2.41 0.26 0.00 -0.02 0.00 0.00 33.50 31.87 1ck6 n PRO 13 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ck6 n GLY 14 N -1.37 -0.95 2.46 -1.23 0.00 -1.26 -4.87 105.19 97.97 1ck6 n GLY 14 Ca 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1ck6 n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ck6 n GLY 15 N 0.58 0.77 3.85 -0.02 0.00 0.26 -5.02 105.19 105.60 1ck6 n GLY 15 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1ck6 n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ck6 s GLN 16 N -0.03 3.96 -0.05 1.61 1.11 -1.24 -4.76 119.66 120.26 1ck6 s GLN 16 Ca 0.00 0.76 -0.10 0.00 0.01 0.00 0.00 55.36 56.03 1ck6 s GLN 16 Cb 0.00 -2.30 -0.05 0.00 -1.01 0.00 0.00 33.01 29.65 1ck6 s GLN 16 CO 0.00 -0.04 0.27 0.45 0.01 0.00 0.00 175.29 175.98 1ck6 s SER 17 N -2.73 6.57 0.17 5.90 0.15 -1.26 -0.05 113.70 122.44 1ck6 s SER 17 Ca 0.56 0.67 -0.03 0.00 0.70 0.00 0.00 55.95 57.85 1ck6 s SER 17 Cb -0.10 -2.14 -0.03 0.00 -1.71 0.00 0.00 66.02 62.04 1ck6 s SER 17 CO 0.24 0.34 0.14 0.28 1.20 0.00 0.00 173.24 175.44 1ck6 s THR 18 N -1.11 0.06 0.15 6.45 -1.32 0.62 -4.90 115.64 115.59 1ck6 s THR 18 Ca 0.21 -1.84 -0.05 0.00 -1.21 0.00 0.00 61.69 58.80 1ck6 s THR 18 Cb -0.14 -2.19 -0.12 0.00 -1.51 0.00 0.00 72.50 68.54 1ck6 s THR 18 CO 0.10 -0.25 1.40 0.77 -2.21 0.00 0.00 174.62 174.42 1ck6 h SER 19 N 2.70 0.62 -4.99 8.08 4.64 -1.90 0.54 113.55 123.24 1ck6 h SER 19 Ca -0.34 -0.41 -0.16 0.00 -0.47 0.00 0.00 61.79 60.41 1ck6 h SER 19 Cb 1.22 -0.18 -0.20 0.00 -0.31 0.00 0.00 62.40 62.92 1ck6 h SER 19 CO 0.54 1.17 -0.62 0.21 -0.87 0.00 0.00 176.83 177.26 1ck6 s ASN 20 N -7.01 0.17 0.47 4.97 3.84 -1.26 -4.39 114.94 111.73 1ck6 s ASN 20 Ca -0.07 -0.42 0.23 0.00 0.21 0.00 0.00 52.86 52.81 1ck6 s ASN 20 Cb 0.10 0.14 1.19 0.00 -0.55 0.00 0.00 41.25 42.13 1ck6 s ASN 20 CO 0.86 -0.34 1.98 0.77 -2.79 0.00 0.00 177.10 177.57 1ck6 h SER 21 N 4.42 0.00 0.11 -4.21 4.64 -1.97 -2.08 113.55 114.46 1ck6 h SER 21 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1ck6 h SER 21 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1ck6 h SER 21 CO 0.42 0.19 0.00 1.56 -0.87 0.00 0.00 176.83 178.13 1ck6 h GLN 22 N 0.00 0.00 0.00 4.77 4.20 -2.00 -1.72 115.11 120.35 1ck6 h GLN 22 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1ck6 h GLN 22 Cb 0.47 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.25 1ck6 h GLN 22 CO 0.02 0.00 -0.26 0.00 -0.67 0.00 0.00 178.83 177.92 1ck6 h VAL 25 N 0.85 1.12 0.00 0.00 3.04 -1.79 -2.26 116.25 117.21 1ck6 h VAL 25 Ca 0.22 -0.55 -0.02 0.00 -1.01 0.00 0.00 66.70 65.33 1ck6 h VAL 25 Cb 0.01 1.27 -0.00 0.00 -2.01 0.00 0.00 31.29 30.55 1ck6 h VAL 25 CO -0.04 0.16 -0.12 -0.50 -1.01 0.00 0.00 177.57 176.07 1ck6 h TRP 26 N 0.03 0.00 0.00 3.17 4.06 -1.57 -0.33 115.95 121.30 1ck6 h TRP 26 Ca 0.01 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.88 1ck6 h TRP 26 Cb 0.28 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.43 1ck6 h TRP 26 CO 0.00 0.12 -0.37 0.74 -3.56 0.00 0.00 178.44 175.37 1ck6 h PHE 27 N 0.00 0.00 0.03 0.49 0.04 -1.49 0.58 116.94 116.58 1ck6 h PHE 27 Ca -0.00 0.00 -0.27 0.00 2.80 0.00 0.00 57.97 60.50 1ck6 h PHE 27 Cb 0.32 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.49 1ck6 h PHE 27 CO 0.00 0.37 -1.08 -0.44 -0.60 0.00 0.00 178.31 176.56 1ck6 h ASP 28 N 0.00 0.84 1.33 2.17 3.32 -1.21 -2.45 116.42 120.42 1ck6 h ASP 28 Ca -0.00 -0.70 -0.06 0.00 0.02 0.00 0.00 57.03 56.29 1ck6 h ASP 28 Cb 0.73 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 1ck6 h ASP 28 CO 0.05 1.50 -0.27 1.62 -1.72 0.00 0.00 179.24 180.42 1ck6 h VAL 29 N 0.34 0.53 0.16 -1.35 3.04 -1.18 -2.54 116.25 115.24 1ck6 h VAL 29 Ca -0.14 -1.44 0.00 0.00 -1.01 0.00 0.00 66.70 64.11 1ck6 h VAL 29 Cb 1.73 2.02 -0.01 0.00 -2.01 0.00 0.00 31.29 33.03 1ck6 h VAL 29 CO 0.21 0.26 -0.13 0.25 -1.01 0.00 0.00 177.57 177.15 1ck6 h LEU 30 N 0.00 -0.33 -0.73 3.16 5.85 -0.79 -1.34 115.31 121.13 1ck6 h LEU 30 Ca -0.00 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1ck6 h LEU 30 Cb 1.00 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 1ck6 h LEU 30 CO 0.03 -0.20 0.40 0.44 -0.34 0.00 0.00 178.44 178.77 1ck6 h ASP 31 N -0.30 0.91 -0.09 1.25 3.32 -1.26 -0.96 116.42 119.28 1ck6 h ASP 31 Ca -0.00 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 1ck6 h ASP 31 Cb 0.27 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 1ck6 h ASP 31 CO -0.01 0.74 0.02 -0.78 -1.72 0.00 0.00 179.24 177.49 1ck6 h ASP 32 N 1.00 0.14 -0.26 6.45 1.82 -1.33 -1.67 116.42 122.56 1ck6 h ASP 32 Ca 0.26 -0.22 -0.00 0.00 -0.39 0.00 0.00 57.03 56.67 1ck6 h ASP 32 Cb 0.03 -0.04 -0.01 0.00 0.68 0.00 0.00 39.33 39.99 1ck6 h ASP 32 CO -0.04 0.33 0.16 -0.07 -1.61 0.00 0.00 179.24 178.01 1ck6 h LEU 33 N -0.05 0.32 -0.74 2.28 3.38 -1.10 0.32 115.31 119.72 1ck6 h LEU 33 Ca 0.03 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ck6 h LEU 33 Cb 0.24 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 1ck6 h LEU 33 CO 0.00 0.27 0.46 1.56 0.09 0.00 0.00 178.44 180.82 1ck6 h GLN 34 N 0.33 0.99 -0.06 1.13 1.08 -1.12 0.49 115.11 117.96 1ck6 h GLN 34 Ca 0.09 -0.08 -0.23 0.00 -1.45 0.00 0.00 58.65 56.99 1ck6 h GLN 34 Cb 0.01 -0.21 0.01 0.00 -0.05 0.00 0.00 27.48 27.23 1ck6 h GLN 34 CO -0.02 0.69 -0.88 1.15 -0.95 0.00 0.00 178.83 178.82 1ck6 h THR 35 N 1.01 1.33 0.00 -0.54 2.02 -1.10 0.51 112.91 116.14 1ck6 h THR 35 Ca 0.27 -2.20 0.00 0.00 0.77 0.00 0.00 66.41 65.25 1ck6 h THR 35 Cb -0.06 2.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.57 1ck6 h THR 35 CO -0.05 0.67 -0.19 0.59 0.37 0.00 0.00 175.52 176.91 1ck6 n ASN 36 N -3.84 0.52 -0.24 4.18 4.13 0.11 -3.32 115.26 116.80 1ck6 n ASN 36 Ca -0.07 0.08 0.01 0.00 1.68 0.00 0.00 54.58 56.27 1ck6 n ASN 36 Cb 0.79 -0.39 0.13 0.00 -1.54 0.00 0.00 39.78 38.77 1ck6 n ASN 36 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 1ck6 h PHE 37 N -0.19 0.66 -0.61 3.10 3.57 -1.45 -1.88 116.94 120.13 1ck6 h PHE 37 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1ck6 h PHE 37 Cb 0.19 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1ck6 h PHE 37 CO -0.08 0.26 0.00 0.66 -2.23 0.00 0.00 178.31 176.92 1ck6 n TYR 38 N -4.83 0.81 -3.96 0.41 4.01 0.09 -4.84 117.16 108.85 1ck6 n TYR 38 Ca 0.10 -0.41 -0.26 0.00 -0.16 0.00 0.00 57.90 57.18 1ck6 n TYR 38 Cb 0.25 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.26 1ck6 n TYR 38 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1ck6 n GLN 39 N 1.36 -3.45 -1.06 -0.72 6.02 -0.71 -1.14 117.38 117.67 1ck6 n GLN 39 Ca 0.21 0.42 0.00 0.00 -0.01 0.00 0.00 57.00 57.62 1ck6 n GLN 39 Cb 0.54 -4.65 0.00 0.00 1.02 0.00 0.00 30.24 27.15 1ck6 n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ck6 n GLY 40 N -1.90 0.72 3.87 1.08 0.00 -0.00 -4.42 105.19 104.55 1ck6 n GLY 40 Ca -0.26 -0.27 -0.29 0.00 0.00 0.00 0.00 46.02 45.19 1ck6 n GLY 40 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ck6 n SER 41 N 0.11 -5.09 -4.91 1.61 7.64 -0.19 -5.00 113.62 107.78 1ck6 n SER 41 Ca 0.00 -0.74 -0.27 0.00 1.01 0.00 0.00 58.87 58.86 1ck6 n SER 41 Cb 0.24 -4.06 0.00 0.00 -1.01 0.00 0.00 64.21 59.38 1ck6 n SER 41 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1ck6 s LYS 42 N -6.59 3.50 -0.77 1.43 1.02 -0.30 -4.78 119.74 113.25 1ck6 s LYS 42 Ca 0.66 0.17 0.03 0.00 0.02 0.00 0.00 55.97 56.85 1ck6 s LYS 42 Cb -0.33 -2.38 0.23 0.00 -0.52 0.00 0.00 37.83 34.84 1ck6 s LYS 42 CO 0.82 -0.23 0.79 0.00 -0.92 0.00 0.00 175.35 175.81 1ck6 n GLU 44 N 1.49 2.49 -0.31 0.00 1.02 -1.26 -4.81 120.64 119.25 1ck6 n GLU 44 Ca 0.25 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.55 1ck6 n GLU 44 Cb 0.38 0.00 0.33 0.00 -0.02 0.00 0.00 31.44 32.12 1ck6 n GLU 44 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1ck6 h SER 45 N 0.00 0.07 -0.75 1.62 0.87 -1.68 -2.28 113.55 111.40 1ck6 h SER 45 Ca 0.00 0.20 0.10 0.00 -1.23 0.00 0.00 61.79 60.86 1ck6 h SER 45 Cb 0.00 0.26 -0.08 0.00 -0.44 0.00 0.00 62.40 62.14 1ck6 h SER 45 CO 0.00 -0.17 0.38 -0.65 -0.53 0.00 0.00 176.83 175.86 1ck6 h PRO 46 N 0.21 0.61 -0.51 2.24 0.11 -1.91 0.15 132.00 132.90 1ck6 h PRO 46 Ca 0.59 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.63 1ck6 h PRO 46 Cb 1.24 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1ck6 h PRO 46 CO -0.66 0.40 0.17 0.28 -0.21 0.00 0.00 178.00 177.98 1ck6 h VAL 47 N 0.63 1.23 -0.50 3.15 2.07 -1.73 -0.60 116.25 120.50 1ck6 h VAL 47 Ca 0.38 -0.75 -0.09 0.00 0.82 0.00 0.00 66.70 67.05 1ck6 h VAL 47 Cb 0.42 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1ck6 h VAL 47 CO -0.29 0.28 -0.03 0.03 0.02 0.00 0.00 177.57 177.58 1ck6 h ARG 48 N 0.70 0.90 -0.49 1.57 3.08 -1.16 -1.30 114.38 117.68 1ck6 h ARG 48 Ca 0.17 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.88 1ck6 h ARG 48 Cb 0.26 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 1ck6 h ARG 48 CO -0.01 0.95 0.18 0.87 -1.07 0.00 0.00 179.97 180.90 1ck6 h LYS 49 N 0.76 0.74 -0.41 0.04 1.79 -0.94 -2.03 116.57 116.51 1ck6 h LYS 49 Ca 0.14 -0.14 -0.05 0.00 -2.18 0.00 0.00 60.65 58.41 1ck6 h LYS 49 Cb 0.56 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.08 1ck6 h LYS 49 CO 0.03 0.67 0.03 0.97 -1.08 0.00 0.00 179.45 180.06 1ck6 h ILE 50 N 0.65 1.21 -0.65 1.86 -0.00 -0.63 -0.67 117.51 119.28 1ck6 h ILE 50 Ca 0.16 -0.84 -0.06 0.00 -0.00 0.00 0.00 64.86 64.12 1ck6 h ILE 50 Cb 0.21 0.88 -0.03 0.00 -0.00 0.00 0.00 36.82 37.88 1ck6 h ILE 50 CO -0.01 0.29 0.16 -0.07 -0.00 0.00 0.00 178.15 178.52 1ck6 h LEU 51 N 0.61 0.96 -0.43 2.19 3.38 -0.79 -0.24 115.31 121.00 1ck6 h LEU 51 Ca 0.13 -0.19 -0.15 0.00 0.09 0.00 0.00 57.88 57.76 1ck6 h LEU 51 Cb 0.35 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1ck6 h LEU 51 CO 0.01 0.93 -0.33 -0.09 0.09 0.00 0.00 178.44 179.05 1ck6 h ARG 52 N 0.98 0.96 -0.73 1.13 2.43 -0.97 -3.11 114.38 115.08 1ck6 h ARG 52 Ca 0.21 -0.47 -0.04 0.00 -0.81 0.00 0.00 59.98 58.87 1ck6 h ARG 52 Cb 0.34 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 1ck6 h ARG 52 CO 0.00 1.14 0.32 0.82 -1.51 0.00 0.00 179.97 180.74 1ck6 h ILE 53 N 0.80 1.25 -0.40 1.20 2.04 -0.58 -1.31 117.51 120.51 1ck6 h ILE 53 Ca 0.08 -0.73 -0.07 0.00 1.00 0.00 0.00 64.86 65.13 1ck6 h ILE 53 Cb 0.92 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1ck6 h ILE 53 CO 0.09 0.30 -0.05 1.62 0.00 0.00 0.00 178.15 180.11 1ck6 h VAL 54 N 1.04 1.23 0.10 1.67 3.04 -1.02 0.51 116.25 122.82 1ck6 h VAL 54 Ca 0.25 -0.99 -0.00 0.00 -1.01 0.00 0.00 66.70 64.94 1ck6 h VAL 54 Cb 0.17 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 30.43 1ck6 h VAL 54 CO -0.03 0.34 -0.05 0.15 -1.01 0.00 0.00 177.57 176.98 1ck6 h PHE 55 N 0.62 -0.12 0.00 3.17 3.57 -1.46 -0.33 116.94 122.39 1ck6 h PHE 55 Ca 0.12 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.58 1ck6 h PHE 55 Cb 0.46 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 1ck6 h PHE 55 CO 0.02 0.26 -0.18 0.45 -2.23 0.00 0.00 178.31 176.63 1ck6 h HIS 56 N -0.53 0.00 0.05 0.41 3.86 -0.69 -1.07 115.15 117.17 1ck6 h HIS 56 Ca -0.01 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1ck6 h HIS 56 Cb 0.44 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.91 1ck6 h HIS 56 CO 0.05 0.18 -0.03 0.22 0.86 0.00 0.00 177.93 179.22 1ck6 h ASP 57 N 0.00 -0.06 0.05 2.45 3.58 -0.86 -3.35 116.42 118.23 1ck6 h ASP 57 Ca -0.00 -0.58 -0.11 0.00 0.42 0.00 0.00 57.03 56.76 1ck6 h ASP 57 Cb 0.41 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.47 1ck6 h ASP 57 CO 0.02 0.66 -0.35 0.00 -2.88 0.00 0.00 179.24 176.69 1ck6 h ALA 58 N -0.19 1.03 0.00 -0.78 0.00 -0.76 -3.10 119.26 115.46 1ck6 h ALA 58 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1ck6 h ALA 58 Cb 0.63 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1ck6 h ALA 58 CO 0.01 0.59 0.00 1.51 0.00 0.00 0.00 179.25 181.37 1ck6 n ILE 59 N -4.06 0.67 -2.33 0.00 0.13 -0.43 -4.07 119.36 109.26 1ck6 n ILE 59 Ca -0.01 0.17 -0.43 0.00 -1.10 0.00 0.00 62.75 61.38 1ck6 n ILE 59 Cb 0.46 -0.85 0.00 0.00 -0.84 0.00 0.00 39.64 38.42 1ck6 n ILE 59 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1ck6 n GLY 60 N 0.40 3.30 3.45 4.50 0.00 -1.17 -4.71 105.19 110.96 1ck6 n GLY 60 Ca 0.05 -1.57 -0.02 0.00 0.00 0.00 0.00 46.02 44.48 1ck6 n GLY 60 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ck6 s PHE 61 N 3.57 -1.25 -0.26 1.61 5.36 -1.24 -1.74 117.98 124.03 1ck6 s PHE 61 Ca 0.50 1.99 -0.04 0.00 -0.96 0.00 0.00 56.93 58.42 1ck6 s PHE 61 Cb 0.07 0.62 0.09 0.00 -0.34 0.00 0.00 43.02 43.46 1ck6 s PHE 61 CO 0.02 -0.67 0.11 0.45 -1.46 0.00 0.00 175.22 173.67 1ck6 s SER 62 N 2.82 3.33 0.38 6.13 0.15 0.10 -4.41 113.70 122.21 1ck6 s SER 62 Ca 0.00 -1.17 0.11 0.00 0.70 0.00 0.00 55.95 55.59 1ck6 s SER 62 Cb -0.13 -0.41 0.89 0.00 -1.71 0.00 0.00 66.02 64.67 1ck6 s SER 62 CO -0.18 -0.41 1.91 -0.65 1.20 0.00 0.00 173.24 175.11 1ck6 h PRO 63 N 8.36 0.58 -0.34 5.44 0.11 -1.86 -2.21 132.00 142.08 1ck6 h PRO 63 Ca -0.18 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.88 1ck6 h PRO 63 Cb 1.04 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.01 1ck6 h PRO 63 CO 0.41 0.38 0.14 0.00 -0.21 0.00 0.00 178.00 178.73 1ck6 h ALA 64 N 1.62 0.44 -0.61 -0.75 0.00 -1.95 0.20 119.26 118.21 1ck6 h ALA 64 Ca 0.39 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1ck6 h ALA 64 Cb 0.68 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1ck6 h ALA 64 CO -0.15 0.03 0.38 -0.07 0.00 0.00 0.00 179.25 179.44 1ck6 h LEU 65 N 0.40 0.72 0.02 0.00 4.07 -1.75 -0.09 115.31 118.68 1ck6 h LEU 65 Ca 0.11 -0.04 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 1ck6 h LEU 65 Cb 0.17 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.72 1ck6 h LEU 65 CO -0.01 0.55 -0.01 0.74 -1.08 0.00 0.00 178.44 178.63 1ck6 h THR 66 N 0.83 1.00 -0.94 0.22 2.02 -1.06 0.28 112.91 115.25 1ck6 h THR 66 Ca 0.22 -0.04 0.10 0.00 0.77 0.00 0.00 66.41 67.46 1ck6 h THR 66 Cb -0.05 1.02 -0.07 0.00 -1.74 0.00 0.00 68.15 67.31 1ck6 h THR 66 CO -0.04 0.01 0.60 0.00 0.37 0.00 0.00 175.52 176.46 1ck6 h ALA 67 N 0.95 1.58 -0.04 6.16 0.00 -0.17 0.21 119.26 127.94 1ck6 h ALA 67 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ck6 h ALA 67 Cb 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1ck6 h ALA 67 CO 0.00 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.48 1ck6 n ALA 68 N -2.39 2.59 -0.96 0.00 0.00 -0.09 -4.84 120.51 114.83 1ck6 n ALA 68 Ca 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1ck6 n ALA 68 Cb 0.31 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1ck6 n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ck6 n GLY 69 N 0.10 0.58 4.00 0.00 0.00 0.73 -5.03 105.19 105.56 1ck6 n GLY 69 Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 1ck6 n GLY 69 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ck6 s GLN 70 N -0.28 2.88 -0.13 1.61 -0.21 0.93 -4.97 119.66 119.50 1ck6 s GLN 70 Ca 0.00 -1.09 -0.29 0.00 0.02 0.00 0.00 55.36 53.99 1ck6 s GLN 70 Cb 0.00 -2.74 -0.02 0.00 1.00 0.00 0.00 33.01 31.26 1ck6 s GLN 70 CO 0.00 -0.23 1.16 0.12 -2.12 0.00 0.00 175.29 174.22 1ck6 s PHE 71 N -2.36 3.16 -2.52 0.91 5.36 -1.26 -3.31 117.98 117.97 1ck6 s PHE 71 Ca 0.52 1.26 0.26 0.00 -0.96 0.00 0.00 56.93 58.01 1ck6 s PHE 71 Cb -0.10 -3.38 0.67 0.00 -0.34 0.00 0.00 43.02 39.86 1ck6 s PHE 71 CO 0.33 -1.11 1.52 0.41 -1.46 0.00 0.00 175.22 174.91 1ck6 n GLY 72 N 3.39 0.23 0.00 13.12 0.00 -1.26 -4.74 105.19 115.92 1ck6 n GLY 72 Ca 0.12 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1ck6 n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ck6 n GLY 73 N 1.27 2.46 0.97 -0.02 0.00 -1.26 0.02 105.19 108.64 1ck6 n GLY 73 Ca 0.16 -1.75 0.10 0.00 0.00 0.00 0.00 46.02 44.53 1ck6 n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ck6 n GLY 74 N 1.32 1.38 7.00 -0.02 0.00 -1.20 -4.59 105.19 109.09 1ck6 n GLY 74 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1ck6 n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ck6 n GLY 75 N 1.37 1.41 2.33 -0.02 0.00 -0.71 -4.06 105.19 105.50 1ck6 n GLY 75 Ca 0.18 -0.61 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 1ck6 n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ck6 n ALA 76 N 9.48 6.63 0.61 4.61 0.00 -0.16 -4.01 120.51 137.68 1ck6 n ALA 76 Ca 0.00 -2.85 0.10 0.00 0.00 0.00 0.00 53.44 50.69 1ck6 n ALA 76 Cb 0.00 -3.10 0.12 0.00 0.00 0.00 0.00 19.45 16.46 1ck6 n ALA 76 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ck6 n ASP 77 N 3.53 2.82 -0.63 0.00 5.68 -1.26 -4.64 116.55 122.07 1ck6 n ASP 77 Ca 0.64 -1.85 -0.08 0.00 -0.50 0.00 0.00 54.79 53.00 1ck6 n ASP 77 Cb 0.31 -0.08 -0.03 0.00 -1.14 0.00 0.00 41.12 40.18 1ck6 n ASP 77 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ck6 n GLY 78 N 1.14 1.00 0.23 6.12 0.00 -1.26 -3.82 105.19 108.61 1ck6 n GLY 78 Ca 0.13 -0.60 0.09 0.00 0.00 0.00 0.00 46.02 45.64 1ck6 n GLY 78 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ck6 h SER 79 N 0.00 0.00 0.32 1.61 4.64 -1.88 -0.88 113.55 117.36 1ck6 h SER 79 Ca -0.17 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.15 1ck6 h SER 79 Cb 0.56 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1ck6 h SER 79 CO 0.24 0.23 -0.03 -0.29 -0.87 0.00 0.00 176.83 176.11 1ck6 h ILE 80 N 0.00 0.20 0.00 0.95 2.10 -1.91 0.23 117.51 119.08 1ck6 h ILE 80 Ca -0.00 -0.25 -0.22 0.00 1.08 0.00 0.00 64.86 65.46 1ck6 h ILE 80 Cb 0.58 1.20 -0.03 0.00 -1.09 0.00 0.00 36.82 37.48 1ck6 h ILE 80 CO 0.03 0.03 -1.46 -0.38 -1.08 0.00 0.00 178.15 175.29 1ck6 n ILE 81 N -3.30 1.50 0.14 2.19 5.41 -0.42 -2.98 119.36 121.90 1ck6 n ILE 81 Ca -0.02 -0.06 0.06 0.00 1.00 0.00 0.00 62.75 63.73 1ck6 n ILE 81 Cb 0.17 -2.11 0.53 0.00 -0.71 0.00 0.00 39.64 37.51 1ck6 n ILE 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ck6 h ALA 82 N -0.82 1.83 -0.73 -1.39 0.00 -1.27 -2.47 119.26 114.40 1ck6 h ALA 82 Ca -0.33 -0.04 -0.54 0.00 0.00 0.00 0.00 54.91 54.01 1ck6 h ALA 82 Cb 1.19 -0.08 -0.42 0.00 0.00 0.00 0.00 17.79 18.49 1ck6 h ALA 82 CO -0.20 0.15 -0.82 0.72 0.00 0.00 0.00 179.25 179.09 1ck6 n HIS 83 N -4.48 2.68 0.05 0.00 8.25 0.79 -4.80 115.22 117.70 1ck6 n HIS 83 Ca -0.00 -2.21 0.06 0.00 -0.26 0.00 0.00 57.72 55.31 1ck6 n HIS 83 Cb 0.10 -0.34 0.48 0.00 1.12 0.00 0.00 29.99 31.36 1ck6 n HIS 83 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1ck6 h SER 84 N 2.17 0.35 -0.78 0.41 4.64 -1.33 -0.81 113.55 118.20 1ck6 h SER 84 Ca 0.35 -0.01 0.10 0.00 -0.47 0.00 0.00 61.79 61.76 1ck6 h SER 84 Cb 1.53 -0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 63.48 1ck6 h SER 84 CO 0.74 0.25 0.51 -0.55 -0.87 0.00 0.00 176.83 176.90 1ck6 h ASN 85 N 0.41 0.63 0.02 4.97 -0.00 -1.87 -0.03 115.58 119.72 1ck6 h ASN 85 Ca 0.14 0.02 -0.38 0.00 -0.00 0.00 0.00 56.30 56.07 1ck6 h ASN 85 Cb 0.04 -0.12 -0.05 0.00 -0.00 0.00 0.00 38.32 38.19 1ck6 h ASN 85 CO -0.03 0.38 -2.20 2.30 -0.00 0.00 0.00 177.43 177.87 1ck6 n ILE 86 N -4.50 1.56 0.08 6.14 -6.64 -0.44 -4.43 119.36 111.13 1ck6 n ILE 86 Ca 0.13 -0.43 -0.01 0.00 -1.77 0.00 0.00 62.75 60.67 1ck6 n ILE 86 Cb 0.33 -1.74 0.27 0.00 -1.44 0.00 0.00 39.64 37.06 1ck6 n ILE 86 CO 0.00 0.00 0.00 -0.33 -1.77 0.00 0.00 176.55 174.45 1ck6 h GLU 87 N -0.50 0.31 0.00 6.28 5.08 -1.09 -1.92 114.58 122.74 1ck6 h GLU 87 Ca -0.55 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 57.69 1ck6 h GLU 87 Cb 1.72 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.95 1ck6 h GLU 87 CO -0.19 0.57 0.00 1.28 -1.00 0.00 0.00 179.01 179.66 1ck6 n LEU 88 N -4.13 0.00 -0.08 1.33 4.77 -0.04 -1.72 117.00 117.14 1ck6 n LEU 88 Ca -0.01 0.10 0.13 0.00 -0.03 0.00 0.00 56.01 56.20 1ck6 n LEU 88 Cb 0.39 -0.10 0.34 0.00 -2.33 0.00 0.00 43.42 41.73 1ck6 n LEU 88 CO 0.41 -0.03 0.58 0.00 -1.33 0.00 0.00 177.39 177.02 1ck6 n ALA 89 N -1.10 3.26 -1.77 -1.18 0.00 -0.72 -4.68 120.51 114.32 1ck6 n ALA 89 Ca 0.14 -0.34 -0.39 0.00 0.00 0.00 0.00 53.44 52.85 1ck6 n ALA 89 Cb 0.10 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 18.36 1ck6 n ALA 89 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ck6 s PHE 90 N -2.81 3.12 0.44 0.00 0.08 -0.70 -4.93 117.98 113.18 1ck6 s PHE 90 Ca 0.17 1.55 0.22 0.00 0.12 0.00 0.00 56.93 58.99 1ck6 s PHE 90 Cb 0.18 -3.41 1.30 0.00 -0.57 0.00 0.00 43.02 40.52 1ck6 s PHE 90 CO 0.62 -1.29 2.05 -1.00 -0.10 0.00 0.00 175.22 175.50 1ck6 h PRO 91 N 2.86 0.00 0.00 0.24 0.13 -1.89 -1.86 132.00 131.48 1ck6 h PRO 91 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1ck6 h PRO 91 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1ck6 h PRO 91 CO 0.63 0.14 0.00 0.00 -0.23 0.00 0.00 178.00 178.54 1ck6 h ALA 92 N 1.86 1.00 -0.51 -0.56 0.00 -1.93 -3.29 119.26 115.84 1ck6 h ALA 92 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1ck6 h ALA 92 Cb 0.30 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 1ck6 h ALA 92 CO 0.02 0.00 0.09 0.09 0.00 0.00 0.00 179.25 179.44 1ck6 n ASN 93 N -2.39 4.54 -4.79 0.00 3.02 -0.70 -5.00 115.26 109.94 1ck6 n ASN 93 Ca 0.02 -3.14 -0.33 0.00 -0.03 0.00 0.00 54.58 51.10 1ck6 n ASN 93 Cb 0.23 -0.66 0.02 0.00 -0.61 0.00 0.00 39.78 38.76 1ck6 n ASN 93 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ck6 s GLY 94 N -1.42 2.12 -0.27 7.41 0.00 -1.24 -3.72 107.32 110.20 1ck6 s GLY 94 Ca 0.50 0.43 0.00 0.00 0.00 0.00 0.00 44.72 45.65 1ck6 s GLY 94 CO 0.11 0.75 0.00 0.61 0.00 0.00 0.00 173.10 174.58 1ck6 n GLY 95 N -0.88 0.58 0.01 0.20 0.00 -1.26 -4.90 105.19 98.93 1ck6 n GLY 95 Ca 0.09 -0.42 0.06 0.00 0.00 0.00 0.00 46.02 45.75 1ck6 n GLY 95 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ck6 n LEU 96 N -0.29 0.01 -0.29 0.99 4.77 -1.24 -4.74 117.00 116.21 1ck6 n LEU 96 Ca -0.03 -0.01 -0.02 0.00 -0.03 0.00 0.00 56.01 55.93 1ck6 n LEU 96 Cb 0.14 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.28 1ck6 n LEU 96 CO 0.04 0.00 0.63 0.74 -1.33 0.00 0.00 177.39 177.47 1ck6 h THR 97 N 0.00 0.11 -0.85 -5.08 2.02 -1.90 -1.52 112.91 105.69 1ck6 h THR 97 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1ck6 h THR 97 Cb 0.52 0.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.00 1ck6 h THR 97 CO 0.00 0.00 0.51 0.44 0.37 0.00 0.00 175.52 176.84 1ck6 h ASP 98 N -0.07 1.01 -0.25 4.18 3.32 -2.01 -1.72 116.42 120.89 1ck6 h ASP 98 Ca 0.31 -0.06 -0.13 0.00 0.02 0.00 0.00 57.03 57.17 1ck6 h ASP 98 Cb 0.58 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 1ck6 h ASP 98 CO -0.83 0.77 -0.37 0.74 -1.72 0.00 0.00 179.24 177.84 1ck6 h THR 99 N 1.17 1.31 -0.70 0.35 2.02 -1.67 -2.78 112.91 112.61 1ck6 h THR 99 Ca 0.30 -1.56 0.03 0.00 0.77 0.00 0.00 66.41 65.95 1ck6 h THR 99 Cb -0.06 1.71 -0.05 0.00 -1.74 0.00 0.00 68.15 68.02 1ck6 h THR 99 CO -0.06 0.50 0.43 0.40 0.37 0.00 0.00 175.52 177.16 1ck6 h ILE 100 N 0.41 1.08 -0.80 3.11 1.08 -0.87 -1.40 117.51 120.12 1ck6 h ILE 100 Ca 0.03 -0.29 -0.04 0.00 -0.39 0.00 0.00 64.86 64.17 1ck6 h ILE 100 Cb 0.96 0.17 -0.04 0.00 -3.07 0.00 0.00 36.82 34.84 1ck6 h ILE 100 CO 0.09 0.15 0.36 -0.33 -0.69 0.00 0.00 178.15 177.73 1ck6 h GLU 101 N 0.84 1.17 -0.57 2.37 4.39 -1.28 0.14 114.58 121.63 1ck6 h GLU 101 Ca 0.28 -0.19 -0.05 0.00 0.34 0.00 0.00 59.36 59.75 1ck6 h GLU 101 Cb 0.04 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.47 1ck6 h GLU 101 CO -0.12 0.92 0.17 0.00 -1.16 0.00 0.00 179.01 178.82 1ck6 h ALA 102 N 1.23 0.75 -0.37 3.43 0.00 -1.19 -2.38 119.26 120.74 1ck6 h ALA 102 Ca 0.27 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 1ck6 h ALA 102 Cb 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ck6 h ALA 102 CO -0.03 0.43 -0.35 -0.07 0.00 0.00 0.00 179.25 179.23 1ck6 h LEU 103 N 0.81 0.90 -0.40 0.00 3.38 -0.88 -2.80 115.31 116.33 1ck6 h LEU 103 Ca 0.18 -0.39 0.06 0.00 0.09 0.00 0.00 57.88 57.82 1ck6 h LEU 103 Cb 0.30 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.75 1ck6 h LEU 103 CO -0.00 1.16 0.06 -0.09 0.09 0.00 0.00 178.44 179.66 1ck6 h ARG 104 N 0.71 0.17 -0.66 1.13 2.43 -0.43 -1.90 114.38 115.83 1ck6 h ARG 104 Ca 0.07 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1ck6 h ARG 104 Cb 0.92 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.40 1ck6 h ARG 104 CO 0.08 0.12 0.35 0.00 -1.51 0.00 0.00 179.97 179.01 1ck6 h ALA 105 N 1.31 0.85 -0.71 2.80 0.00 -1.31 -1.07 119.26 121.13 1ck6 h ALA 105 Ca 0.19 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1ck6 h ALA 105 Cb 0.24 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1ck6 h ALA 105 CO -0.27 0.37 0.37 0.28 0.00 0.00 0.00 179.25 180.00 1ck6 h VAL 106 N 0.90 1.23 0.27 0.00 2.07 -1.16 0.55 116.25 120.10 1ck6 h VAL 106 Ca 0.23 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1ck6 h VAL 106 Cb 0.06 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1ck6 h VAL 106 CO -0.04 0.26 -0.13 1.23 0.02 0.00 0.00 177.57 178.92 1ck6 h GLY 107 N 0.99 -0.38 0.98 2.17 0.00 -0.93 0.13 103.07 106.03 1ck6 h GLY 107 Ca 0.25 0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.71 1ck6 h GLY 107 CO -0.04 -0.14 0.25 -2.22 0.00 0.00 0.00 176.54 174.40 1ck6 h ILE 108 N -0.39 1.15 -0.33 2.60 2.04 -1.05 -0.88 117.51 120.65 1ck6 h ILE 108 Ca -0.04 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.41 1ck6 h ILE 108 Cb 0.30 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 1ck6 h ILE 108 CO 0.06 0.16 -0.01 0.78 0.00 0.00 0.00 178.15 179.14 1ck6 h ASN 109 N 0.58 0.47 0.00 1.72 2.35 -0.62 -2.99 115.58 117.09 1ck6 h ASN 109 Ca 0.16 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1ck6 h ASN 109 Cb 0.03 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.27 1ck6 h ASN 109 CO -0.03 0.55 -0.57 1.41 -1.65 0.00 0.00 177.43 177.15 1ck6 n HIS 110 N -4.28 0.00 -3.10 1.19 8.25 0.01 -4.98 115.22 112.30 1ck6 n HIS 110 Ca 0.01 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.34 1ck6 n HIS 110 Cb 0.24 -0.01 0.05 0.00 1.12 0.00 0.00 29.99 31.40 1ck6 n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ck6 n GLY 111 N 1.43 0.05 3.56 -1.41 0.00 -0.36 -5.05 105.19 103.41 1ck6 n GLY 111 Ca 0.08 -0.13 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 1ck6 n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ck6 s VAL 112 N -3.19 3.14 0.55 1.61 -7.23 -1.07 -5.06 120.40 109.15 1ck6 s VAL 112 Ca 0.29 -1.62 -0.19 0.00 -1.81 0.00 0.00 61.98 58.65 1ck6 s VAL 112 Cb -0.13 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 34.22 1ck6 s VAL 112 CO 0.43 -0.07 1.13 -0.94 -0.31 0.00 0.00 175.10 175.34 1ck6 s SER 113 N -2.69 5.68 0.29 4.85 1.04 -1.26 -4.70 113.70 116.91 1ck6 s SER 113 Ca 0.24 2.15 -0.02 0.00 0.48 0.00 0.00 55.95 58.81 1ck6 s SER 113 Cb -0.09 -2.58 0.43 0.00 0.10 0.00 0.00 66.02 63.88 1ck6 s SER 113 CO 0.14 -1.24 1.90 -0.26 0.98 0.00 0.00 173.24 174.76 1ck6 h PHE 114 N 1.10 0.94 -0.64 5.02 0.04 -1.87 -0.41 116.94 121.12 1ck6 h PHE 114 Ca -0.50 -0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.16 1ck6 h PHE 114 Cb 1.26 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 39.09 1ck6 h PHE 114 CO 0.52 0.68 0.09 0.78 -0.60 0.00 0.00 178.31 179.78 1ck6 h GLY 115 N 1.02 1.16 0.77 -1.45 0.00 -1.82 -1.87 103.07 100.88 1ck6 h GLY 115 Ca 0.24 -0.79 -0.06 0.00 0.00 0.00 0.00 47.33 46.72 1ck6 h GLY 115 CO -0.03 0.73 -0.13 -0.55 0.00 0.00 0.00 176.54 176.56 1ck6 h ASP 116 N 0.99 0.40 -0.98 0.19 3.32 -1.77 -2.98 116.42 115.60 1ck6 h ASP 116 Ca 0.19 -0.45 0.07 0.00 0.02 0.00 0.00 57.03 56.86 1ck6 h ASP 116 Cb 0.46 -0.11 -0.07 0.00 0.22 0.00 0.00 39.33 39.83 1ck6 h ASP 116 CO 0.02 0.77 0.63 0.25 -1.72 0.00 0.00 179.24 179.18 1ck6 h LEU 117 N 0.04 1.00 -0.70 1.55 5.85 -0.88 -0.90 115.31 121.27 1ck6 h LEU 117 Ca 0.03 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.68 1ck6 h LEU 117 Cb 0.64 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 1ck6 h LEU 117 CO 0.03 0.63 0.03 0.40 -0.34 0.00 0.00 178.44 179.20 1ck6 h ILE 118 N 1.14 1.26 -0.60 4.05 2.04 -1.30 0.34 117.51 124.43 1ck6 h ILE 118 Ca 0.43 -1.10 -0.10 0.00 1.00 0.00 0.00 64.86 65.09 1ck6 h ILE 118 Cb 0.18 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1ck6 h ILE 118 CO -0.18 0.40 -0.02 1.56 0.00 0.00 0.00 178.15 179.92 1ck6 h GLN 119 N 0.95 1.08 -0.10 2.37 1.08 -1.24 -2.19 115.11 117.05 1ck6 h GLN 119 Ca 0.18 -0.35 -0.02 0.00 -1.45 0.00 0.00 58.65 57.00 1ck6 h GLN 119 Cb 0.51 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.84 1ck6 h GLN 119 CO 0.02 1.06 -0.03 0.35 -0.95 0.00 0.00 178.83 179.29 1ck6 h PHE 120 N 0.98 0.21 -0.15 2.96 3.57 -1.00 -2.17 116.94 121.35 1ck6 h PHE 120 Ca 0.17 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 1ck6 h PHE 120 Cb 0.58 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 1ck6 h PHE 120 CO 0.04 0.51 -0.06 0.00 -2.23 0.00 0.00 178.31 176.57 1ck6 h ALA 121 N 0.68 1.63 -0.09 2.41 0.00 -0.85 -1.11 119.26 121.93 1ck6 h ALA 121 Ca 0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1ck6 h ALA 121 Cb 0.44 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1ck6 h ALA 121 CO 0.01 0.27 -0.01 1.15 0.00 0.00 0.00 179.25 180.67 1ck6 h THR 122 N 0.21 1.27 -0.69 0.00 2.02 -1.24 0.23 112.91 114.71 1ck6 h THR 122 Ca 0.05 -0.85 -0.03 0.00 0.77 0.00 0.00 66.41 66.35 1ck6 h THR 122 Cb 0.25 1.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 1ck6 h THR 122 CO 0.01 0.24 0.31 0.00 0.37 0.00 0.00 175.52 176.45 1ck6 h ALA 123 N 0.71 0.89 -0.22 6.16 0.00 -1.00 -1.64 119.26 124.17 1ck6 h ALA 123 Ca 0.02 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1ck6 h ALA 123 Cb 0.38 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1ck6 h ALA 123 CO 0.01 0.47 -0.06 0.28 0.00 0.00 0.00 179.25 179.95 1ck6 h VAL 124 N 0.97 1.29 -0.79 0.00 2.07 -1.17 -2.56 116.25 116.06 1ck6 h VAL 124 Ca 0.23 -1.06 0.02 0.00 0.82 0.00 0.00 66.70 66.72 1ck6 h VAL 124 Cb 0.15 1.52 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1ck6 h VAL 124 CO -0.03 0.32 0.51 1.23 0.02 0.00 0.00 177.57 179.63 1ck6 h GLY 125 N 0.16 1.12 1.59 2.17 0.00 -0.82 -2.08 103.07 105.21 1ck6 h GLY 125 Ca 0.06 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 1ck6 h GLY 125 CO 0.02 0.36 0.02 -0.33 0.00 0.00 0.00 176.54 176.62 1ck6 h MET 126 N 1.02 0.52 0.00 4.80 2.86 -1.25 -1.93 114.93 120.94 1ck6 h MET 126 Ca 0.30 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1ck6 h MET 126 Cb -0.05 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.53 1ck6 h MET 126 CO -0.09 0.53 0.00 0.66 1.06 0.00 0.00 176.91 179.07 1ck6 h SER 127 N 0.50 0.00 0.84 1.22 4.64 -0.94 -0.20 113.55 119.62 1ck6 h SER 127 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1ck6 h SER 127 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1ck6 h SER 127 CO 0.01 0.00 -0.26 0.59 -0.87 0.00 0.00 176.83 176.30 1ck6 n ASN 128 N -2.68 0.34 -4.40 4.97 5.03 -0.73 -4.05 115.26 113.74 1ck6 n ASN 128 Ca -0.02 0.18 -0.37 0.00 0.87 0.00 0.00 54.58 55.24 1ck6 n ASN 128 Cb 0.06 -0.17 -0.12 0.00 -1.02 0.00 0.00 39.78 38.53 1ck6 n ASN 128 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ck6 n PRO 130 N 4.91 1.47 0.00 0.00 -0.02 -1.25 -2.30 135.00 137.80 1ck6 n PRO 130 Ca -0.15 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 1ck6 n PRO 130 Cb 0.50 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1ck6 n PRO 130 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ck6 n GLY 131 N 1.60 1.45 3.77 -1.23 0.00 -0.43 -0.72 105.19 109.63 1ck6 n GLY 131 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1ck6 n GLY 131 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ck6 s SER 132 N -2.41 6.35 0.84 1.61 0.01 -0.97 -4.79 113.70 114.33 1ck6 s SER 132 Ca 0.00 2.62 -0.12 0.00 1.31 0.00 0.00 55.95 59.76 1ck6 s SER 132 Cb 0.00 -2.64 0.10 0.00 0.21 0.00 0.00 66.02 63.69 1ck6 s SER 132 CO 0.00 -0.82 1.10 -2.16 0.41 0.00 0.00 173.24 171.77 1ck6 s PRO 133 N -2.23 1.72 -0.38 12.44 0.04 -1.26 -4.57 135.00 140.75 1ck6 s PRO 133 Ca 0.57 0.59 -0.24 0.00 0.04 0.00 0.00 61.00 61.96 1ck6 s PRO 133 Cb -0.37 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.30 1ck6 s PRO 133 CO 0.48 -1.86 0.83 1.03 0.04 0.00 0.00 177.00 177.51 1ck6 s ARG 134 N -5.14 3.72 0.44 4.56 0.52 -1.26 -4.79 118.95 117.00 1ck6 s ARG 134 Ca 0.62 0.32 -0.21 0.00 -0.52 0.00 0.00 55.73 55.95 1ck6 s ARG 134 Cb -0.15 -3.83 -0.10 0.00 0.52 0.00 0.00 34.95 31.39 1ck6 s ARG 134 CO 0.54 -0.93 0.97 -0.51 0.02 0.00 0.00 175.30 175.39 1ck6 s LEU 135 N 3.26 3.92 0.47 2.53 1.02 -1.26 -5.01 118.68 123.60 1ck6 s LEU 135 Ca 0.33 1.73 -0.24 0.00 0.02 0.00 0.00 54.13 55.98 1ck6 s LEU 135 Cb -0.13 -4.54 -0.07 0.00 0.02 0.00 0.00 46.19 41.47 1ck6 s LEU 135 CO 0.19 -0.45 1.26 -0.70 0.02 0.00 0.00 176.35 176.67 1ck6 s GLU 136 N -3.21 3.65 -0.09 1.70 2.12 -1.26 -4.95 118.70 116.67 1ck6 s GLU 136 Ca 0.63 2.02 -0.01 0.00 0.36 0.00 0.00 54.97 57.97 1ck6 s GLU 136 Cb -0.10 -2.47 0.03 0.00 0.26 0.00 0.00 34.13 31.84 1ck6 s GLU 136 CO 0.15 -0.71 -0.03 0.12 -0.54 0.00 0.00 175.26 174.25 1ck6 s PHE 137 N -1.39 0.96 0.04 5.30 5.36 -1.26 -4.96 117.98 122.03 1ck6 s PHE 137 Ca 0.64 -0.37 0.05 0.00 -0.96 0.00 0.00 56.93 56.29 1ck6 s PHE 137 Cb -0.35 -0.95 -0.03 0.00 -0.34 0.00 0.00 43.02 41.34 1ck6 s PHE 137 CO 0.43 -0.39 -0.11 -0.51 -1.46 0.00 0.00 175.22 173.17 1ck6 s LEU 138 N 1.88 2.96 0.15 6.12 1.02 -1.26 -0.90 118.68 128.64 1ck6 s LEU 138 Ca 0.05 -0.29 0.08 0.00 0.02 0.00 0.00 54.13 53.99 1ck6 s LEU 138 Cb -0.12 -1.73 -0.04 0.00 0.02 0.00 0.00 46.19 44.32 1ck6 s LEU 138 CO -0.06 0.25 -0.19 0.28 0.02 0.00 0.00 176.35 176.65 1ck6 s THR 139 N -1.02 1.79 0.00 5.49 -1.32 0.55 -4.85 115.64 116.28 1ck6 s THR 139 Ca 0.17 -1.83 0.00 0.00 -1.21 0.00 0.00 61.69 58.82 1ck6 s THR 139 Cb -0.11 -1.78 0.00 0.00 -1.51 0.00 0.00 72.50 69.10 1ck6 s THR 139 CO 0.08 -0.25 0.00 0.61 -2.21 0.00 0.00 174.62 172.85 1ck6 n GLY 140 N 0.48 0.62 3.73 6.08 0.00 -1.26 -0.86 105.19 113.98 1ck6 n GLY 140 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 1ck6 n GLY 140 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ck6 s ARG 141 N 0.00 4.15 0.45 1.61 0.52 -1.26 -4.93 118.95 119.49 1ck6 s ARG 141 Ca 0.00 2.52 -0.25 0.00 -0.52 0.00 0.00 55.73 57.49 1ck6 s ARG 141 Cb 0.00 -3.07 -0.09 0.00 0.52 0.00 0.00 34.95 32.31 1ck6 s ARG 141 CO 0.00 -0.65 1.30 0.45 0.02 0.00 0.00 175.30 176.42 1ck6 n SER 142 N 3.21 2.66 0.04 0.23 2.88 -1.26 -4.71 113.62 116.68 1ck6 n SER 142 Ca 0.12 1.08 0.13 0.00 -1.33 0.00 0.00 58.87 58.88 1ck6 n SER 142 Cb 0.37 -1.53 0.52 0.00 -0.75 0.00 0.00 64.21 62.82 1ck6 n SER 142 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1ck6 n ASN 143 N -0.05 0.32 -4.74 -3.46 5.15 -1.26 -4.77 115.26 106.45 1ck6 n ASN 143 Ca 0.07 0.53 -0.41 0.00 -0.60 0.00 0.00 54.58 54.18 1ck6 n ASN 143 Cb 0.41 -0.62 -0.05 0.00 -0.53 0.00 0.00 39.78 38.99 1ck6 n ASN 143 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1ck6 s SER 144 N -3.59 7.42 0.19 1.20 1.04 -1.26 -4.82 113.70 113.88 1ck6 s SER 144 Ca 0.12 1.70 -0.08 0.00 0.48 0.00 0.00 55.95 58.17 1ck6 s SER 144 Cb 0.15 -2.55 -0.01 0.00 0.10 0.00 0.00 66.02 63.71 1ck6 s SER 144 CO 0.53 -0.02 0.29 -0.94 0.98 0.00 0.00 173.24 174.07 1ck6 s SER 145 N -0.13 0.04 0.27 7.02 1.04 -1.26 -5.05 113.70 115.64 1ck6 s SER 145 Ca 0.44 -0.98 0.10 0.00 0.48 0.00 0.00 55.95 55.99 1ck6 s SER 145 Cb -0.23 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 1ck6 s SER 145 CO 0.28 -0.93 -0.04 -1.10 0.98 0.00 0.00 173.24 172.43 1ck6 s GLN 146 N -4.01 2.16 0.42 4.02 -0.21 -1.26 -5.04 119.66 115.73 1ck6 s GLN 146 Ca 0.22 -1.50 -0.25 0.00 0.02 0.00 0.00 55.36 53.84 1ck6 s GLN 146 Cb 0.03 -2.07 -0.08 0.00 1.00 0.00 0.00 33.01 31.89 1ck6 s GLN 146 CO 0.04 0.35 1.29 -2.14 -2.12 0.00 0.00 175.29 172.71 1ck6 s PRO 147 N -3.64 3.91 0.44 2.91 0.02 -1.26 -4.76 135.00 132.62 1ck6 s PRO 147 Ca 0.31 2.12 -0.25 0.00 0.02 0.00 0.00 61.00 63.20 1ck6 s PRO 147 Cb -0.06 -2.70 -0.08 0.00 0.02 0.00 0.00 34.50 31.69 1ck6 s PRO 147 CO 0.19 -0.53 1.28 0.45 -0.33 0.00 0.00 177.00 178.06 1ck6 s SER 148 N -0.82 6.10 0.67 2.53 0.15 -1.26 -4.84 113.70 116.24 1ck6 s SER 148 Ca 0.58 2.59 -0.17 0.00 0.70 0.00 0.00 55.95 59.65 1ck6 s SER 148 Cb -0.37 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.31 1ck6 s SER 148 CO 0.47 -0.99 1.22 -2.84 1.20 0.00 0.00 173.24 172.31 1ck6 s PRO 149 N -2.46 2.50 0.95 5.44 0.02 -1.26 -4.92 135.00 135.27 1ck6 s PRO 149 Ca 0.61 1.84 -0.14 0.00 0.02 0.00 0.00 61.00 63.33 1ck6 s PRO 149 Cb -0.36 -1.87 0.17 0.00 0.02 0.00 0.00 34.50 32.46 1ck6 s PRO 149 CO 0.45 -1.58 1.18 -1.25 -0.33 0.00 0.00 177.00 175.48 1ck6 s PRO 150 N -3.62 0.80 -1.99 5.54 0.04 -1.26 -4.36 135.00 130.14 1ck6 s PRO 150 Ca 0.77 0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.88 1ck6 s PRO 150 Cb -0.31 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1ck6 s PRO 150 CO 0.40 -2.39 0.00 0.43 0.04 0.00 0.00 177.00 175.49 1ck6 n SER 151 N -3.85 -5.39 -0.79 6.66 7.64 -1.26 -4.88 113.62 111.75 1ck6 n SER 151 Ca 0.09 0.39 0.11 0.00 1.01 0.00 0.00 58.87 60.47 1ck6 n SER 151 Cb 0.60 -4.57 0.07 0.00 -1.01 0.00 0.00 64.21 59.30 1ck6 n SER 151 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1ck6 n LEU 152 N -2.32 2.63 -4.62 -3.43 4.77 -1.26 -4.90 117.00 107.87 1ck6 n LEU 152 Ca -0.20 -0.96 -0.37 0.00 -0.03 0.00 0.00 56.01 54.45 1ck6 n LEU 152 Cb 0.65 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.63 1ck6 n LEU 152 CO 0.29 0.45 -0.19 -0.63 -1.33 0.00 0.00 177.39 175.98 1ck6 s ILE 153 N -1.87 5.20 0.41 -0.08 1.01 -1.26 -4.75 121.20 119.86 1ck6 s ILE 153 Ca 0.24 0.13 -0.26 0.00 0.00 0.00 0.00 60.65 60.75 1ck6 s ILE 153 Cb 0.18 -3.43 -0.10 0.00 0.01 0.00 0.00 42.46 39.11 1ck6 s ILE 153 CO 0.31 0.33 1.29 -2.65 0.00 0.00 0.00 174.94 174.22 1ck6 n PRO 154 N 4.46 1.99 -4.32 2.79 -0.02 -1.26 -4.98 135.00 133.66 1ck6 n PRO 154 Ca -0.15 0.71 -0.26 0.00 -2.02 0.00 0.00 63.50 61.77 1ck6 n PRO 154 Cb 0.52 -2.40 -0.10 0.00 -0.02 0.00 0.00 33.50 31.51 1ck6 n PRO 154 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1ck6 s GLY 155 N -0.49 1.73 0.60 -1.23 0.00 -1.26 -5.04 107.32 101.63 1ck6 s GLY 155 Ca 0.60 -1.54 0.39 0.00 0.00 0.00 0.00 44.72 44.17 1ck6 s GLY 155 CO 0.59 -1.57 2.17 -0.56 0.00 0.00 0.00 173.10 173.73 1ck6 h PRO 156 N 2.82 0.00 -0.17 2.90 0.13 -1.96 -1.63 132.00 134.09 1ck6 h PRO 156 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1ck6 h PRO 156 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1ck6 h PRO 156 CO 0.54 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.72 1ck6 n GLY 157 N -0.53 0.77 3.83 1.56 0.00 -1.26 -2.16 105.19 107.40 1ck6 n GLY 157 Ca -0.01 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.12 1ck6 n GLY 157 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ck6 s ASN 158 N -1.72 6.31 0.70 1.61 0.02 -0.62 -5.02 114.94 116.24 1ck6 s ASN 158 Ca 0.34 1.64 -0.11 0.00 -1.02 0.00 0.00 52.86 53.71 1ck6 s ASN 158 Cb 0.20 -2.51 0.01 0.00 0.02 0.00 0.00 41.25 38.97 1ck6 s ASN 158 CO 0.30 -0.80 1.07 0.42 0.02 0.00 0.00 177.10 178.10 1ck6 s THR 159 N -2.62 3.92 0.26 1.60 -4.23 -1.26 -4.72 115.64 108.59 1ck6 s THR 159 Ca 0.60 0.62 -0.05 0.00 -1.18 0.00 0.00 61.69 61.69 1ck6 s THR 159 Cb -0.12 -3.48 0.26 0.00 1.34 0.00 0.00 72.50 70.51 1ck6 s THR 159 CO 0.35 -0.82 1.93 0.58 -0.54 0.00 0.00 174.62 176.12 1ck6 h VAL 160 N -0.68 1.23 -0.61 2.29 2.07 -1.95 -1.46 116.25 117.14 1ck6 h VAL 160 Ca -0.45 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 66.62 1ck6 h VAL 160 Cb 1.22 -0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 1ck6 h VAL 160 CO 0.60 0.24 0.37 0.74 0.02 0.00 0.00 177.57 179.54 1ck6 h THR 161 N 1.31 1.18 -0.17 2.57 2.02 -1.99 0.31 112.91 118.14 1ck6 h THR 161 Ca 0.37 -0.39 0.01 0.00 0.77 0.00 0.00 66.41 67.17 1ck6 h THR 161 Cb -0.10 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 66.63 1ck6 h THR 161 CO -0.09 0.18 0.09 0.00 0.37 0.00 0.00 175.52 176.06 1ck6 h ALA 162 N 1.19 0.20 -0.12 6.16 0.00 -1.71 0.11 119.26 125.08 1ck6 h ALA 162 Ca 0.22 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1ck6 h ALA 162 Cb -0.03 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ck6 h ALA 162 CO -0.04 -0.34 0.05 0.82 0.00 0.00 0.00 179.25 179.74 1ck6 h ILE 163 N 0.19 1.14 -0.79 0.00 2.04 -0.89 -1.39 117.51 117.81 1ck6 h ILE 163 Ca 0.07 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 1ck6 h ILE 163 Cb 0.00 1.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 1ck6 h ILE 163 CO -0.04 0.13 0.41 -0.07 0.00 0.00 0.00 178.15 178.58 1ck6 h LEU 164 N 0.05 0.99 -0.21 1.44 3.38 -0.73 0.91 115.31 121.14 1ck6 h LEU 164 Ca 0.04 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1ck6 h LEU 164 Cb 0.15 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1ck6 h LEU 164 CO -0.00 0.81 0.03 0.44 0.09 0.00 0.00 178.44 179.81 1ck6 h ASP 165 N 1.11 0.33 -0.16 -0.43 3.32 -0.83 0.21 116.42 119.96 1ck6 h ASP 165 Ca 0.28 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 1ck6 h ASP 165 Cb 0.06 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1ck6 h ASP 165 CO -0.04 0.51 0.09 -0.09 -1.72 0.00 0.00 179.24 177.99 1ck6 h ARG 166 N 0.14 0.23 -0.26 3.56 9.65 -0.74 -0.21 114.38 126.74 1ck6 h ARG 166 Ca 0.06 -0.02 -0.08 0.00 -1.10 0.00 0.00 59.98 58.83 1ck6 h ARG 166 Cb 0.32 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.84 1ck6 h ARG 166 CO 0.00 0.22 -0.20 0.52 2.80 0.00 0.00 179.97 183.31 1ck6 h MET 167 N 0.17 0.48 -0.50 0.20 2.86 -0.78 -2.44 114.93 114.91 1ck6 h MET 167 Ca 0.06 -0.16 -0.11 0.00 -2.06 0.00 0.00 59.70 57.43 1ck6 h MET 167 Cb 0.05 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 1ck6 h MET 167 CO -0.01 0.65 -0.12 0.78 1.06 0.00 0.00 176.91 179.27 1ck6 h GLY 168 N 0.98 1.02 0.95 8.32 0.00 -0.15 0.31 103.07 114.50 1ck6 h GLY 168 Ca 0.07 -0.81 -0.00 0.00 0.00 0.00 0.00 47.33 46.59 1ck6 h GLY 168 CO 0.04 0.74 0.10 -1.80 0.00 0.00 0.00 176.54 175.62 1ck6 h ASP 169 N 0.84 0.21 0.14 0.19 3.58 -0.59 -1.64 116.42 119.14 1ck6 h ASP 169 Ca 0.13 -0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.50 1ck6 h ASP 169 Cb 0.66 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 41.66 1ck6 h ASP 169 CO 0.05 0.22 -0.04 0.00 -2.88 0.00 0.00 179.24 176.58 1ck6 h ALA 170 N 1.00 1.40 0.00 -0.78 0.00 -1.19 -3.39 119.26 116.30 1ck6 h ALA 170 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ck6 h ALA 170 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ck6 h ALA 170 CO -0.01 0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.70 1ck6 n GLY 171 N -1.07 0.01 3.85 0.00 0.00 -0.62 -4.99 105.19 102.38 1ck6 n GLY 171 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1ck6 n GLY 171 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ck6 s PHE 172 N -0.95 3.53 0.74 1.61 0.08 0.01 -4.95 117.98 118.04 1ck6 s PHE 172 Ca 0.00 0.47 -0.12 0.00 0.12 0.00 0.00 56.93 57.41 1ck6 s PHE 172 Cb 0.00 -1.91 0.03 0.00 -0.57 0.00 0.00 43.02 40.57 1ck6 s PHE 172 CO 0.00 0.69 1.11 -1.54 -0.10 0.00 0.00 175.22 175.38 1ck6 s SER 173 N -1.03 5.12 0.28 1.36 1.04 -1.26 -3.41 113.70 115.80 1ck6 s SER 173 Ca 0.15 1.13 0.01 0.00 0.48 0.00 0.00 55.95 57.71 1ck6 s SER 173 Cb -0.12 -1.87 0.54 0.00 0.10 0.00 0.00 66.02 64.67 1ck6 s SER 173 CO 0.04 -1.55 1.82 -0.65 0.98 0.00 0.00 173.24 173.88 1ck6 h PRO 174 N -0.80 0.88 -0.54 4.02 0.11 -1.93 -1.57 132.00 132.18 1ck6 h PRO 174 Ca -0.46 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1ck6 h PRO 174 Cb 1.27 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 1ck6 h PRO 174 CO 0.63 0.58 0.35 -0.44 -0.21 0.00 0.00 178.00 178.91 1ck6 h ASP 175 N 0.91 0.62 0.50 -2.05 5.19 -1.93 -2.43 116.42 117.23 1ck6 h ASP 175 Ca 0.49 -0.03 -0.08 0.00 -0.62 0.00 0.00 57.03 56.79 1ck6 h ASP 175 Cb 0.52 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.87 1ck6 h ASP 175 CO -0.28 0.46 -0.36 -0.33 -3.12 0.00 0.00 179.24 175.61 1ck6 h GLU 176 N 0.73 0.00 -0.19 3.56 5.08 -1.67 -1.10 114.58 120.98 1ck6 h GLU 176 Ca 0.20 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1ck6 h GLU 176 Cb -0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1ck6 h GLU 176 CO -0.04 0.36 0.07 0.28 -1.00 0.00 0.00 179.01 178.68 1ck6 h VAL 177 N 0.00 1.18 -0.72 3.13 2.07 -1.01 0.52 116.25 121.42 1ck6 h VAL 177 Ca -0.00 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 1ck6 h VAL 177 Cb 0.71 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 1ck6 h VAL 177 CO 0.05 0.17 0.37 0.58 0.02 0.00 0.00 177.57 178.76 1ck6 h VAL 178 N 0.14 1.23 -0.79 2.57 2.07 -0.90 -2.67 116.25 117.91 1ck6 h VAL 178 Ca 0.06 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 1ck6 h VAL 178 Cb 0.21 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 1ck6 h VAL 178 CO -0.00 0.26 0.40 0.44 0.02 0.00 0.00 177.57 178.69 1ck6 h ASP 179 N 1.00 1.00 -0.20 0.57 3.32 -0.77 -2.27 116.42 119.07 1ck6 h ASP 179 Ca 0.25 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 57.15 1ck6 h ASP 179 Cb 0.07 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1ck6 h ASP 179 CO -0.04 0.82 -0.01 0.25 -1.72 0.00 0.00 179.24 178.54 1ck6 h LEU 180 N 1.11 0.46 0.00 1.55 5.85 -0.60 -2.65 115.31 121.03 1ck6 h LEU 180 Ca 0.27 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1ck6 h LEU 180 Cb 0.07 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1ck6 h LEU 180 CO -0.04 0.54 0.00 0.18 -0.34 0.00 0.00 178.44 178.78 1ck6 n LEU 181 N -4.28 0.00 0.31 2.25 4.32 -0.85 -2.48 117.00 116.26 1ck6 n LEU 181 Ca 0.01 0.12 0.17 0.00 -0.02 0.00 0.00 56.01 56.29 1ck6 n LEU 181 Cb 0.25 -0.12 1.00 0.00 -1.62 0.00 0.00 43.42 42.93 1ck6 n LEU 181 CO 0.39 -0.06 1.14 0.00 -1.22 0.00 0.00 177.39 177.64 1ck6 h ALA 182 N 2.83 1.39 0.00 -1.18 0.00 -1.55 -1.11 119.26 119.63 1ck6 h ALA 182 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ck6 h ALA 182 Cb 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ck6 h ALA 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1ck6 h ALA 183 N 2.00 1.00 0.00 0.00 0.00 -1.74 -0.31 119.26 120.20 1ck6 h ALA 183 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ck6 h ALA 183 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ck6 h ALA 183 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.97 1ck6 n HIS 184 N -2.91 0.00 0.81 0.00 8.25 -0.42 -1.99 115.22 118.96 1ck6 n HIS 184 Ca -0.02 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.56 1ck6 n HIS 184 Cb 0.13 -0.02 0.50 0.00 1.12 0.00 0.00 29.99 31.72 1ck6 n HIS 184 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1ck6 n SER 185 N -1.02 0.01 -3.08 0.41 2.88 -0.13 -3.51 113.62 109.17 1ck6 n SER 185 Ca 0.17 0.50 -0.24 0.00 -1.33 0.00 0.00 58.87 57.97 1ck6 n SER 185 Cb 0.09 -0.50 -0.04 0.00 -0.75 0.00 0.00 64.21 63.00 1ck6 n SER 185 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1ck6 n LEU 186 N -1.51 3.13 -3.84 2.46 4.32 -0.84 -4.24 117.00 116.48 1ck6 n LEU 186 Ca 0.06 -5.41 -0.10 0.00 -0.02 0.00 0.00 56.01 50.53 1ck6 n LEU 186 Cb 0.28 -0.15 -0.08 0.00 -1.62 0.00 0.00 43.42 41.85 1ck6 n LEU 186 CO 0.22 2.29 -0.09 0.00 -1.22 0.00 0.00 177.39 178.58 1ck6 s ALA 187 N -2.93 -0.36 0.35 -1.18 0.00 -1.23 -4.71 121.76 111.71 1ck6 s ALA 187 Ca 0.45 -0.31 0.03 0.00 0.00 0.00 0.00 51.96 52.13 1ck6 s ALA 187 Cb 0.28 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.69 1ck6 s ALA 187 CO -0.11 -0.38 0.39 -1.54 0.00 0.00 0.00 175.76 174.12 1ck6 s SER 188 N -2.17 1.43 0.16 0.00 1.04 -1.26 -1.32 113.70 111.58 1ck6 s SER 188 Ca -0.04 -1.67 0.08 0.00 0.48 0.00 0.00 55.95 54.80 1ck6 s SER 188 Cb -0.00 0.63 -0.04 0.00 0.10 0.00 0.00 66.02 66.70 1ck6 s SER 188 CO -0.05 -1.21 -0.17 0.00 0.98 0.00 0.00 173.24 172.79 1ck6 s GLN 189 N -3.15 1.25 0.00 4.02 1.03 -0.94 -4.89 119.66 116.98 1ck6 s GLN 189 Ca 0.36 -1.40 0.00 0.00 0.04 0.00 0.00 55.36 54.36 1ck6 s GLN 189 Cb 0.01 -1.26 0.00 0.00 0.03 0.00 0.00 33.01 31.78 1ck6 s GLN 189 CO 0.25 0.25 0.00 0.39 -2.54 0.00 0.00 175.29 173.65 1ck6 n GLU 190 N 0.27 2.21 0.00 9.60 1.02 -1.26 -1.19 120.64 131.29 1ck6 n GLU 190 Ca -0.13 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.07 1ck6 n GLU 190 Cb 0.57 -0.76 0.02 0.00 -0.02 0.00 0.00 31.44 31.26 1ck6 n GLU 190 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ck6 n GLY 191 N 1.69 -0.10 0.11 0.62 0.00 -1.26 -3.99 105.19 102.26 1ck6 n GLY 191 Ca 0.00 -0.37 -0.17 0.00 0.00 0.00 0.00 46.02 45.48 1ck6 n GLY 191 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ck6 h LEU 192 N 1.90 0.37 -6.39 0.99 4.07 -1.89 -3.42 115.31 110.94 1ck6 h LEU 192 Ca 0.00 -0.54 -0.38 0.00 0.08 0.00 0.00 57.88 57.04 1ck6 h LEU 192 Cb 0.48 -0.12 -0.32 0.00 1.08 0.00 0.00 40.66 41.78 1ck6 h LEU 192 CO 0.00 1.45 -0.70 0.21 -1.08 0.00 0.00 178.44 178.32 1ck6 s ASN 193 N -6.94 1.38 0.34 -0.43 3.04 -1.26 -1.70 114.94 109.36 1ck6 s ASN 193 Ca -0.09 -1.55 0.26 0.00 0.04 0.00 0.00 52.86 51.51 1ck6 s ASN 193 Cb 0.07 0.47 1.17 0.00 -1.54 0.00 0.00 41.25 41.42 1ck6 s ASN 193 CO 0.85 -0.28 1.77 0.77 -3.04 0.00 0.00 177.10 177.17 1ck6 h SER 194 N 7.18 0.00 0.73 -4.21 4.64 -1.83 -2.23 113.55 117.83 1ck6 h SER 194 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1ck6 h SER 194 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1ck6 h SER 194 CO 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.18 1ck6 h ALA 195 N 2.14 1.00 -2.10 5.18 0.00 -1.94 -3.10 119.26 120.44 1ck6 h ALA 195 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 1ck6 h ALA 195 Cb 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.64 1ck6 h ALA 195 CO 0.00 0.00 -0.99 0.44 0.00 0.00 0.00 179.25 178.70 1ck6 n ILE 196 N -2.86 0.93 -1.67 0.00 -5.35 -0.84 -4.95 119.36 104.62 1ck6 n ILE 196 Ca 0.00 -4.89 -0.44 0.00 -0.27 0.00 0.00 62.75 57.15 1ck6 n ILE 196 Cb 0.23 -0.82 -0.02 0.00 -1.74 0.00 0.00 39.64 37.29 1ck6 n ILE 196 CO 0.00 0.00 0.00 0.33 -1.76 0.00 0.00 176.55 175.12 1ck6 n PHE 197 N 0.22 2.15 -2.61 4.28 7.35 -1.17 -1.98 117.46 125.69 1ck6 n PHE 197 Ca 0.27 0.48 -0.21 0.00 -0.76 0.00 0.00 57.45 57.23 1ck6 n PHE 197 Cb 0.55 -2.44 0.00 0.00 0.35 0.00 0.00 39.48 37.95 1ck6 n PHE 197 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1ck6 n ARG 198 N 1.60 -2.71 -2.23 -4.13 1.74 -0.33 -4.81 116.66 105.79 1ck6 n ARG 198 Ca 0.10 0.95 -0.42 0.00 -0.77 0.00 0.00 57.85 57.71 1ck6 n ARG 198 Cb 0.33 -5.68 -0.03 0.00 -1.02 0.00 0.00 32.46 26.06 1ck6 n ARG 198 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1ck6 s SER 199 N -2.26 6.88 0.66 0.55 1.04 -0.84 -0.63 113.70 119.11 1ck6 s SER 199 Ca 0.10 2.19 -0.16 0.00 0.48 0.00 0.00 55.95 58.56 1ck6 s SER 199 Cb -0.04 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1ck6 s SER 199 CO 0.12 -0.65 1.17 -2.84 0.98 0.00 0.00 173.24 172.02 1ck6 s PRO 200 N 1.62 2.62 0.09 4.02 0.02 -1.25 -2.20 135.00 139.91 1ck6 s PRO 200 Ca 0.63 1.65 0.23 0.00 0.02 0.00 0.00 61.00 63.53 1ck6 s PRO 200 Cb -0.33 -1.90 0.14 0.00 0.02 0.00 0.00 34.50 32.43 1ck6 s PRO 200 CO 0.29 -1.44 1.12 1.28 -0.33 0.00 0.00 177.00 177.92 1ck6 n LEU 201 N -2.28 0.65 -4.13 -5.54 4.32 -0.43 -0.92 117.00 108.67 1ck6 n LEU 201 Ca 0.12 0.10 -0.14 0.00 -0.02 0.00 0.00 56.01 56.08 1ck6 n LEU 201 Cb 0.51 -0.12 -0.06 0.00 -1.62 0.00 0.00 43.42 42.12 1ck6 n LEU 201 CO 0.46 -0.01 0.02 1.51 -1.22 0.00 0.00 177.39 178.15 1ck6 s ASP 202 N -4.17 0.63 0.00 -1.43 1.47 -1.26 -4.84 116.67 107.07 1ck6 s ASP 202 Ca 0.04 -1.38 0.21 0.00 1.18 0.00 0.00 52.55 52.59 1ck6 s ASP 202 Cb 0.14 0.56 0.95 0.00 -0.34 0.00 0.00 42.92 44.22 1ck6 s ASP 202 CO 0.77 -1.12 1.66 -1.54 0.68 0.00 0.00 175.17 175.63 1ck6 n SER 203 N -0.93 0.00 -3.38 2.11 3.41 -1.26 -4.05 113.62 109.51 1ck6 n SER 203 Ca 0.02 0.32 -0.26 0.00 -0.26 0.00 0.00 58.87 58.68 1ck6 n SER 203 Cb 0.63 -0.42 -0.08 0.00 -0.26 0.00 0.00 64.21 64.07 1ck6 n SER 203 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1ck6 n THR 204 N -1.42 0.97 0.28 6.66 -2.24 -1.26 -4.94 114.28 112.33 1ck6 n THR 204 Ca 0.07 -4.64 0.03 0.00 -2.27 0.00 0.00 64.05 57.24 1ck6 n THR 204 Cb 0.21 -2.03 0.15 0.00 -2.10 0.00 0.00 70.33 66.57 1ck6 n THR 204 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1ck6 n PRO 205 N 1.29 0.06 -0.16 -0.78 -0.04 -1.26 -1.45 135.00 132.67 1ck6 n PRO 205 Ca 0.26 0.27 0.05 0.00 -0.04 0.00 0.00 63.50 64.04 1ck6 n PRO 205 Cb 0.45 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.54 1ck6 n PRO 205 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1ck6 n GLN 206 N -1.35 2.83 -4.35 0.54 6.02 -1.26 -4.29 117.38 115.52 1ck6 n GLN 206 Ca 0.03 -2.03 -0.25 0.00 -0.01 0.00 0.00 57.00 54.74 1ck6 n GLN 206 Cb 0.06 -1.28 -0.17 0.00 1.02 0.00 0.00 30.24 29.87 1ck6 n GLN 206 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1ck6 s VAL 207 N -1.31 1.08 -0.82 5.09 1.01 -0.53 -3.96 120.40 120.96 1ck6 s VAL 207 Ca 0.20 -0.41 -0.25 0.00 0.00 0.00 0.00 61.98 61.52 1ck6 s VAL 207 Cb 0.12 -1.02 0.05 0.00 0.00 0.00 0.00 36.38 35.53 1ck6 s VAL 207 CO 0.10 0.35 1.27 0.12 0.00 0.00 0.00 175.10 176.95 1ck6 s PHE 208 N 1.00 2.47 0.33 5.22 5.36 0.11 -4.70 117.98 127.76 1ck6 s PHE 208 Ca -0.08 -0.44 0.06 0.00 -0.96 0.00 0.00 56.93 55.50 1ck6 s PHE 208 Cb -0.15 -4.58 -0.03 0.00 -0.34 0.00 0.00 43.02 37.93 1ck6 s PHE 208 CO -0.00 -1.94 0.31 0.16 -1.46 0.00 0.00 175.22 172.29 1ck6 s ASP 209 N 4.08 1.52 0.07 6.13 1.47 -1.26 -4.44 116.67 124.23 1ck6 s ASP 209 Ca 0.36 -1.71 0.19 0.00 1.18 0.00 0.00 52.55 52.57 1ck6 s ASP 209 Cb -0.07 0.57 0.80 0.00 -0.34 0.00 0.00 42.92 43.88 1ck6 s ASP 209 CO 0.06 -1.10 1.60 0.41 0.68 0.00 0.00 175.17 176.82 1ck6 n THR 210 N -0.60 0.80 -0.26 2.11 -1.04 -1.26 -4.19 114.28 109.83 1ck6 n THR 210 Ca 0.06 0.18 0.17 0.00 -2.04 0.00 0.00 64.05 62.43 1ck6 n THR 210 Cb 0.62 -0.94 0.47 0.00 -1.82 0.00 0.00 70.33 68.66 1ck6 n THR 210 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 1ck6 h GLN 211 N 0.00 0.48 -0.78 -2.82 1.08 -1.93 -0.99 115.11 110.15 1ck6 h GLN 211 Ca 0.00 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.15 1ck6 h GLN 211 Cb 0.34 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.62 1ck6 h GLN 211 CO 0.00 0.32 0.41 0.35 -0.95 0.00 0.00 178.83 178.96 1ck6 h PHE 212 N 0.49 1.07 -0.09 2.96 3.57 -1.89 -0.28 116.94 122.78 1ck6 h PHE 212 Ca 0.48 -0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.78 1ck6 h PHE 212 Cb 1.06 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 1ck6 h PHE 212 CO -0.00 0.75 -0.66 1.88 -2.23 0.00 0.00 178.31 178.04 1ck6 h TYR 213 N 1.09 0.48 -0.00 0.41 0.05 -1.49 -2.48 116.97 115.02 1ck6 h TYR 213 Ca 0.27 -0.20 -0.00 0.00 0.05 0.00 0.00 58.73 58.86 1ck6 h TYR 213 Cb 0.04 -0.08 -0.00 0.00 1.01 0.00 0.00 36.73 37.70 1ck6 h TYR 213 CO 0.01 0.92 -0.00 0.82 -1.05 0.00 0.00 178.16 178.86 1ck6 h ILE 214 N 0.26 1.37 0.00 -2.88 2.04 -1.32 -3.25 117.51 113.73 1ck6 h ILE 214 Ca -0.02 -1.09 -0.10 0.00 1.00 0.00 0.00 64.86 64.66 1ck6 h ILE 214 Cb 1.21 2.10 -0.01 0.00 -0.74 0.00 0.00 36.82 39.38 1ck6 h ILE 214 CO 0.11 0.28 -0.45 -0.33 0.00 0.00 0.00 178.15 177.76 1ck6 h GLU 215 N -0.46 0.00 0.00 2.37 5.08 -1.06 -2.54 114.58 117.97 1ck6 h GLU 215 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ck6 h GLU 215 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1ck6 h GLU 215 CO 0.00 0.45 0.00 1.79 -1.00 0.00 0.00 179.01 180.25 1ck6 h THR 216 N 0.00 0.00 0.00 1.13 1.35 -1.53 -3.02 112.91 110.84 1ck6 h THR 216 Ca -0.00 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 1ck6 h THR 216 Cb 0.89 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 1ck6 h THR 216 CO 0.06 0.00 -0.62 -0.11 -0.25 0.00 0.00 175.52 174.60 1ck6 n LEU 217 N -2.64 0.63 -4.78 3.87 7.94 -0.97 -4.80 117.00 116.26 1ck6 n LEU 217 Ca 0.03 0.16 -0.34 0.00 -1.11 0.00 0.00 56.01 54.76 1ck6 n LEU 217 Cb 0.36 -0.20 0.02 0.00 0.53 0.00 0.00 43.42 44.14 1ck6 n LEU 217 CO 0.27 -0.01 0.75 -0.76 -1.11 0.00 0.00 177.39 176.54 1ck6 s LEU 218 N -3.90 3.55 0.18 -1.96 1.43 -1.14 -0.98 118.68 115.86 1ck6 s LEU 218 Ca 0.07 2.03 -0.32 0.00 -1.03 0.00 0.00 54.13 54.88 1ck6 s LEU 218 Cb 0.14 -4.56 -0.11 0.00 0.03 0.00 0.00 46.19 41.69 1ck6 s LEU 218 CO 0.72 -1.37 1.71 -0.54 0.23 0.00 0.00 176.35 177.10 1ck6 s LYS 219 N -3.77 4.15 -0.27 1.70 1.02 -0.26 -4.79 119.74 117.51 1ck6 s LYS 219 Ca 0.68 2.55 -0.29 0.00 0.02 0.00 0.00 55.97 58.94 1ck6 s LYS 219 Cb -0.21 -3.20 -0.02 0.00 -0.52 0.00 0.00 37.83 33.88 1ck6 s LYS 219 CO 0.35 -0.74 1.75 0.20 -0.92 0.00 0.00 175.35 175.98 1ck6 s GLY 220 N 1.50 0.96 -0.03 -3.33 0.00 -1.26 -4.25 107.32 100.91 1ck6 s GLY 220 Ca 0.75 0.39 0.02 0.00 0.00 0.00 0.00 44.72 45.88 1ck6 s GLY 220 CO 0.33 3.20 0.00 2.41 0.00 0.00 0.00 173.10 179.03 1ck6 n THR 221 N 7.02 0.19 -4.87 0.90 -1.04 0.89 -4.79 114.28 112.58 1ck6 n THR 221 Ca 0.22 -0.11 -0.31 0.00 -2.04 0.00 0.00 64.05 61.81 1ck6 n THR 221 Cb 0.46 -0.87 -0.14 0.00 -1.82 0.00 0.00 70.33 67.96 1ck6 n THR 221 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ck6 s THR 222 N -2.07 2.52 -0.35 12.58 2.01 0.10 -4.89 115.64 125.56 1ck6 s THR 222 Ca -0.02 -1.17 -0.11 0.00 0.31 0.00 0.00 61.69 60.70 1ck6 s THR 222 Cb 0.01 -2.00 0.00 0.00 0.01 0.00 0.00 72.50 70.52 1ck6 s THR 222 CO 0.11 0.42 0.20 -1.58 -0.69 0.00 0.00 174.62 173.08 1ck6 s GLN 223 N -1.15 3.17 0.37 4.92 0.74 -1.26 -0.31 119.66 126.13 1ck6 s GLN 223 Ca 0.13 -0.85 0.19 0.00 0.05 0.00 0.00 55.36 54.88 1ck6 s GLN 223 Cb -0.10 -3.70 0.55 0.00 1.10 0.00 0.00 33.01 30.86 1ck6 s GLN 223 CO 0.03 -0.54 1.67 -1.00 -0.55 0.00 0.00 175.29 174.89 1ck6 h PRO 224 N 8.43 0.00 0.00 1.67 0.13 -1.89 -3.47 132.00 136.87 1ck6 h PRO 224 Ca -0.29 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.37 1ck6 h PRO 224 Cb 1.13 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.19 1ck6 h PRO 224 CO 0.65 0.36 -0.31 0.41 -0.23 0.00 0.00 178.00 178.88 1ck6 n GLY 225 N 0.55 3.45 0.30 1.56 0.00 -1.26 -4.69 105.19 105.09 1ck6 n GLY 225 Ca 0.01 -2.31 0.05 0.00 0.00 0.00 0.00 46.02 43.77 1ck6 n GLY 225 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ck6 h PRO 226 N 0.00 0.45 0.00 1.61 0.13 -1.92 -3.45 132.00 128.82 1ck6 h PRO 226 Ca -0.29 -0.03 -0.34 0.00 -0.87 0.00 0.00 66.00 64.47 1ck6 h PRO 226 Cb 0.94 -0.10 -0.09 0.00 0.13 0.00 0.00 31.00 31.88 1ck6 h PRO 226 CO 0.48 0.30 -0.28 -1.13 -0.23 0.00 0.00 178.00 177.14 1ck6 n SER 227 N -4.49 -0.92 -4.88 1.44 3.41 -1.26 -5.15 113.62 101.78 1ck6 n SER 227 Ca 0.02 -2.83 -0.36 0.00 -0.26 0.00 0.00 58.87 55.44 1ck6 n SER 227 Cb 0.07 1.87 -0.06 0.00 -0.26 0.00 0.00 64.21 65.83 1ck6 n SER 227 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ck6 s LEU 228 N 0.00 4.39 0.00 1.04 2.01 -1.26 -4.90 118.68 119.96 1ck6 s LEU 228 Ca 0.31 0.53 0.00 0.00 0.01 0.00 0.00 54.13 54.99 1ck6 s LEU 228 Cb 0.00 -2.36 0.01 0.00 0.01 0.00 0.00 46.19 43.86 1ck6 s LEU 228 CO 0.22 0.34 0.06 0.61 1.01 0.00 0.00 176.35 178.59 1ck6 n GLY 229 N 1.60 1.44 3.70 -3.19 0.00 -1.26 -4.98 105.19 102.49 1ck6 n GLY 229 Ca -0.16 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.38 1ck6 n GLY 229 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ck6 s PHE 230 N 0.43 2.52 -1.35 1.61 5.36 -0.69 -2.40 117.98 123.46 1ck6 s PHE 230 Ca 0.05 0.33 -0.03 0.00 -0.96 0.00 0.00 56.93 56.31 1ck6 s PHE 230 Cb -0.00 -4.00 0.02 0.00 -0.34 0.00 0.00 43.02 38.70 1ck6 s PHE 230 CO 0.03 -3.96 0.25 0.00 -1.46 0.00 0.00 175.22 170.08 1ck6 n ALA 231 N 5.23 -0.86 -2.49 11.12 0.00 -1.26 -4.84 120.51 127.41 1ck6 n ALA 231 Ca 0.16 0.15 -0.38 0.00 0.00 0.00 0.00 53.44 53.37 1ck6 n ALA 231 Cb 0.40 -2.46 -0.06 0.00 0.00 0.00 0.00 19.45 17.33 1ck6 n ALA 231 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ck6 s GLU 232 N -5.41 3.93 0.33 0.00 2.12 -1.01 -0.29 118.70 118.37 1ck6 s GLU 232 Ca 0.16 0.43 0.10 0.00 0.36 0.00 0.00 54.97 56.02 1ck6 s GLU 232 Cb -0.08 -3.22 -0.06 0.00 0.26 0.00 0.00 34.13 31.04 1ck6 s GLU 232 CO 0.20 0.69 -0.07 -1.21 -0.54 0.00 0.00 175.26 174.33 1ck6 s GLU 233 N -1.10 1.91 0.33 4.30 0.41 -0.35 -4.83 118.70 119.37 1ck6 s GLU 233 Ca 0.24 -1.84 -0.28 0.00 -0.41 0.00 0.00 54.97 52.68 1ck6 s GLU 233 Cb -0.17 -1.80 -0.10 0.00 -1.78 0.00 0.00 34.13 30.28 1ck6 s GLU 233 CO 0.14 0.17 1.25 -0.51 -0.49 0.00 0.00 175.26 175.81 1ck6 s LEU 234 N -3.64 4.42 0.55 1.80 1.02 -1.26 -4.24 118.68 117.33 1ck6 s LEU 234 Ca 0.33 2.56 0.06 0.00 0.02 0.00 0.00 54.13 57.10 1ck6 s LEU 234 Cb 0.00 -3.69 0.05 0.00 0.02 0.00 0.00 46.19 42.57 1ck6 s LEU 234 CO 0.17 -0.47 0.48 -0.94 0.02 0.00 0.00 176.35 175.61 1ck6 s SER 235 N -0.65 4.73 0.22 2.29 1.04 0.58 -4.36 113.70 117.54 1ck6 s SER 235 Ca 0.49 -1.16 0.25 0.00 0.48 0.00 0.00 55.95 56.00 1ck6 s SER 235 Cb -0.37 0.38 0.53 0.00 0.10 0.00 0.00 66.02 66.66 1ck6 s SER 235 CO 0.49 -1.14 1.55 1.55 0.98 0.00 0.00 173.24 176.66 1ck6 h PRO 236 N 0.65 0.00 -2.39 4.02 0.13 -1.85 0.39 132.00 132.94 1ck6 h PRO 236 Ca -0.35 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.82 1ck6 h PRO 236 Cb 1.30 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.27 1ck6 h PRO 236 CO 0.54 0.00 0.37 -0.59 -0.23 0.00 0.00 178.00 178.09 1ck6 s PHE 237 N -3.16 -0.45 0.20 1.56 -0.12 -1.26 -4.73 117.98 110.01 1ck6 s PHE 237 Ca 0.08 0.41 -0.31 0.00 -0.05 0.00 0.00 56.93 57.06 1ck6 s PHE 237 Cb 0.11 0.52 -0.16 0.00 -0.63 0.00 0.00 43.02 42.86 1ck6 s PHE 237 CO 0.66 -0.63 1.00 -2.30 -0.05 0.00 0.00 175.22 173.90 1ck6 n PRO 238 N -0.03 0.91 0.00 1.99 -0.02 -1.25 -2.35 135.00 134.24 1ck6 n PRO 238 Ca -0.13 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1ck6 n PRO 238 Cb 0.62 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 1ck6 n PRO 238 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ck6 n GLY 239 N 1.77 2.92 3.79 -1.23 0.00 -1.26 -0.83 105.19 110.34 1ck6 n GLY 239 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1ck6 n GLY 239 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ck6 s GLU 240 N -0.16 4.22 -0.10 1.61 2.12 -0.99 -3.88 118.70 121.52 1ck6 s GLU 240 Ca 0.00 0.66 -0.06 0.00 0.36 0.00 0.00 54.97 55.93 1ck6 s GLU 240 Cb 0.00 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 31.05 1ck6 s GLU 240 CO 0.00 0.49 0.14 0.12 -0.54 0.00 0.00 175.26 175.47 1ck6 s PHE 241 N -0.58 3.56 -0.10 5.30 2.19 -0.10 -4.66 117.98 123.59 1ck6 s PHE 241 Ca 0.29 0.47 0.01 0.00 0.33 0.00 0.00 56.93 58.03 1ck6 s PHE 241 Cb -0.18 -1.91 0.02 0.00 -1.31 0.00 0.00 43.02 39.64 1ck6 s PHE 241 CO 0.17 0.70 -0.13 0.50 1.83 0.00 0.00 175.22 178.29 1ck6 s ARG 242 N -1.20 1.99 0.07 10.12 3.52 -1.26 -4.43 118.95 127.76 1ck6 s ARG 242 Ca 0.17 -0.47 -0.02 0.00 -0.13 0.00 0.00 55.73 55.28 1ck6 s ARG 242 Cb -0.12 -1.74 -0.04 0.00 -1.56 0.00 0.00 34.95 31.48 1ck6 s ARG 242 CO 0.07 -0.09 0.25 0.00 -0.81 0.00 0.00 175.30 174.71 1ck6 s MET 243 N 1.08 3.49 0.16 5.12 0.23 -1.26 -1.21 119.30 126.91 1ck6 s MET 243 Ca -0.05 -0.33 -0.19 0.00 -1.03 0.00 0.00 55.69 54.08 1ck6 s MET 243 Cb -0.15 -3.00 0.06 0.00 -1.53 0.00 0.00 34.83 30.22 1ck6 s MET 243 CO -0.02 0.58 1.66 -0.09 -2.03 0.00 0.00 175.02 175.12 1ck6 h ARG 244 N 3.12 -0.07 -1.00 3.16 2.43 -0.81 -2.13 114.38 119.08 1ck6 h ARG 244 Ca -0.46 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 58.78 1ck6 h ARG 244 Cb 1.16 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.66 1ck6 h ARG 244 CO 0.74 -0.05 0.64 0.66 -1.51 0.00 0.00 179.97 180.46 1ck6 h SER 245 N -0.07 1.03 -0.36 -3.80 4.64 -1.72 0.48 113.55 113.75 1ck6 h SER 245 Ca 0.17 0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 61.43 1ck6 h SER 245 Cb 0.32 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1ck6 h SER 245 CO -0.38 0.65 -0.02 0.44 -0.87 0.00 0.00 176.83 176.65 1ck6 h ASP 246 N 1.16 0.64 -0.47 4.97 3.32 -1.80 0.23 116.42 124.47 1ck6 h ASP 246 Ca 0.43 -0.32 0.01 0.00 0.02 0.00 0.00 57.03 57.17 1ck6 h ASP 246 Cb 0.18 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 1ck6 h ASP 246 CO -0.18 0.82 0.30 0.00 -1.72 0.00 0.00 179.24 178.45 1ck6 h ALA 247 N 0.85 0.60 -0.39 3.45 0.00 -0.58 -1.75 119.26 121.45 1ck6 h ALA 247 Ca 0.10 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1ck6 h ALA 247 Cb 0.50 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1ck6 h ALA 247 CO 0.02 0.01 -0.18 -0.07 0.00 0.00 0.00 179.25 179.03 1ck6 h LEU 248 N 0.60 0.82 -0.93 0.00 4.07 -0.87 -3.01 115.31 115.99 1ck6 h LEU 248 Ca 0.18 -0.40 -0.10 0.00 0.08 0.00 0.00 57.88 57.64 1ck6 h LEU 248 Cb -0.02 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.48 1ck6 h LEU 248 CO -0.07 1.04 -0.30 -0.07 -1.08 0.00 0.00 178.44 177.96 1ck6 h LEU 249 N 0.60 0.42 -1.55 1.67 3.38 -0.79 0.11 115.31 119.15 1ck6 h LEU 249 Ca 0.09 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1ck6 h LEU 249 Cb 0.73 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1ck6 h LEU 249 CO 0.05 0.71 -0.07 0.00 0.09 0.00 0.00 178.44 179.23 1ck6 h ALA 250 N 1.32 1.63 0.00 1.53 0.00 -1.22 -3.23 119.26 119.29 1ck6 h ALA 250 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ck6 h ALA 250 Cb 0.72 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1ck6 h ALA 250 CO 0.05 0.27 -1.65 0.54 0.00 0.00 0.00 179.25 178.46 1ck6 n ARG 251 N -4.35 0.65 -2.23 0.00 1.74 -0.95 -4.40 116.66 107.12 1ck6 n ARG 251 Ca -0.01 -0.14 -0.40 0.00 -0.77 0.00 0.00 57.85 56.54 1ck6 n ARG 251 Cb 0.21 -1.43 -0.02 0.00 -1.02 0.00 0.00 32.46 30.19 1ck6 n ARG 251 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ck6 s ASP 252 N -3.87 6.79 0.62 0.55 -1.08 0.35 -4.77 116.67 115.25 1ck6 s ASP 252 Ca -0.04 2.52 0.36 0.00 -0.52 0.00 0.00 52.55 54.87 1ck6 s ASP 252 Cb 0.12 -2.64 2.05 0.00 -1.46 0.00 0.00 42.92 41.00 1ck6 s ASP 252 CO 0.78 -0.50 2.29 0.77 0.52 0.00 0.00 175.17 179.03 1ck6 h SER 253 N 3.27 0.00 1.41 -0.34 4.64 -1.91 0.14 113.55 120.75 1ck6 h SER 253 Ca -0.48 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.82 1ck6 h SER 253 Cb 1.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1ck6 h SER 253 CO 0.65 0.01 -0.09 0.03 -0.87 0.00 0.00 176.83 176.55 1ck6 h ARG 254 N 0.00 0.00 0.00 4.77 3.08 -1.94 -3.37 114.38 116.92 1ck6 h ARG 254 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ck6 h ARG 254 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1ck6 h ARG 254 CO 0.00 0.09 -0.07 0.25 -1.07 0.00 0.00 179.97 179.18 1ck6 n THR 255 N -3.16 0.00 -0.36 2.04 -2.24 -0.60 -4.85 114.28 105.11 1ck6 n THR 255 Ca 0.02 -0.26 0.04 0.00 -2.27 0.00 0.00 64.05 61.58 1ck6 n THR 255 Cb 0.46 0.92 0.20 0.00 -2.10 0.00 0.00 70.33 69.81 1ck6 n THR 255 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ck6 h ALA 256 N 0.00 1.45 -0.09 6.98 0.00 -0.90 -1.50 119.26 125.20 1ck6 h ALA 256 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 1ck6 h ALA 256 Cb 0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1ck6 h ALA 256 CO 0.00 0.37 -0.73 0.00 0.00 0.00 0.00 179.25 178.89 1ck6 h ARG 258 N 0.31 0.98 -0.62 0.00 9.65 -1.85 -1.34 114.38 121.50 1ck6 h ARG 258 Ca -0.03 -0.38 0.02 0.00 -1.10 0.00 0.00 59.98 58.49 1ck6 h ARG 258 Cb 1.31 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 29.80 1ck6 h ARG 258 CO 0.13 1.05 0.39 2.35 2.80 0.00 0.00 179.97 186.70 1ck6 h TRP 259 N 0.84 0.74 -0.42 2.20 2.91 -1.17 -2.35 115.95 118.71 1ck6 h TRP 259 Ca 0.13 0.02 -0.09 0.00 1.13 0.00 0.00 58.89 60.08 1ck6 h TRP 259 Cb 0.69 -0.25 -0.02 0.00 -0.51 0.00 0.00 29.16 29.08 1ck6 h TRP 259 CO 0.05 0.44 -0.09 0.37 -1.03 0.00 0.00 178.44 178.18 1ck6 h GLN 260 N 0.79 0.74 0.00 2.65 4.15 -1.17 -2.69 115.11 119.57 1ck6 h GLN 260 Ca 0.24 -0.23 -0.02 0.00 0.77 0.00 0.00 58.65 59.41 1ck6 h GLN 260 Cb -0.02 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.60 1ck6 h GLN 260 CO -0.08 0.81 -0.10 0.66 -1.93 0.00 0.00 178.83 178.18 1ck6 h SER 261 N 0.68 0.00 0.84 -0.69 4.64 -0.72 -2.39 113.55 115.90 1ck6 h SER 261 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1ck6 h SER 261 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1ck6 h SER 261 CO 0.03 0.10 0.00 0.23 -0.87 0.00 0.00 176.83 176.33 1ck6 n MET 262 N -3.41 0.12 0.13 4.77 2.81 -1.02 -4.13 117.12 116.38 1ck6 n MET 262 Ca -0.01 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1ck6 n MET 262 Cb 0.27 -1.50 0.08 0.00 -0.71 0.00 0.00 33.22 31.36 1ck6 n MET 262 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1ck6 h THR 263 N 0.00 1.17 -0.01 2.03 1.35 -1.48 -3.40 112.91 112.57 1ck6 h THR 263 Ca 0.00 -2.36 0.00 0.00 -0.55 0.00 0.00 66.41 63.50 1ck6 h THR 263 Cb 0.42 2.38 0.00 0.00 -1.73 0.00 0.00 68.15 69.22 1ck6 h THR 263 CO 0.00 0.61 -0.28 -1.54 -0.25 0.00 0.00 175.52 174.06 1ck6 n SER 264 N -3.40 1.57 -3.64 5.36 3.41 -1.26 -4.86 113.62 110.80 1ck6 n SER 264 Ca 0.01 -1.28 -0.26 0.00 -0.26 0.00 0.00 58.87 57.07 1ck6 n SER 264 Cb 0.72 0.43 -0.17 0.00 -0.26 0.00 0.00 64.21 64.93 1ck6 n SER 264 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1ck6 s SER 265 N -1.71 2.36 0.37 4.04 0.15 -1.26 -4.81 113.70 112.83 1ck6 s SER 265 Ca 0.12 -0.60 0.09 0.00 0.70 0.00 0.00 55.95 56.26 1ck6 s SER 265 Cb 0.12 -0.29 0.71 0.00 -1.71 0.00 0.00 66.02 64.84 1ck6 s SER 265 CO 0.35 -0.34 1.86 0.78 1.20 0.00 0.00 173.24 177.09 1ck6 h ASN 266 N 8.39 0.20 -0.27 5.45 2.35 -1.90 -1.18 115.58 128.63 1ck6 h ASN 266 Ca -0.15 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.50 1ck6 h ASN 266 Cb 1.14 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.45 1ck6 h ASN 266 CO 0.29 0.43 -0.02 -0.08 -1.65 0.00 0.00 177.43 176.41 1ck6 h GLU 267 N 0.19 0.49 -0.30 0.81 4.81 -1.97 -1.25 114.58 117.35 1ck6 h GLU 267 Ca 0.03 -0.16 -0.09 0.00 -0.13 0.00 0.00 59.36 59.00 1ck6 h GLU 267 Cb 0.50 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 1ck6 h GLU 267 CO 0.03 0.66 -0.18 0.28 -0.73 0.00 0.00 179.01 179.08 1ck6 h VAL 268 N 0.26 1.30 -0.25 0.32 2.07 -1.93 -2.54 116.25 115.47 1ck6 h VAL 268 Ca 0.07 -1.30 0.05 0.00 0.82 0.00 0.00 66.70 66.34 1ck6 h VAL 268 Cb 0.45 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 31.66 1ck6 h VAL 268 CO 0.02 0.42 -0.06 -0.03 0.02 0.00 0.00 177.57 177.93 1ck6 h MET 269 N 0.41 0.00 -0.88 1.57 1.85 -1.16 -1.91 114.93 114.82 1ck6 h MET 269 Ca 0.06 -0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 59.14 1ck6 h MET 269 Cb 0.72 -0.00 -0.04 0.00 0.43 0.00 0.00 31.60 32.71 1ck6 h MET 269 CO 0.05 0.00 0.49 0.78 -0.40 0.00 0.00 176.91 177.83 1ck6 h GLY 270 N 0.00 1.30 1.02 1.39 0.00 -1.17 -0.04 103.07 105.57 1ck6 h GLY 270 Ca 0.12 -0.57 -0.08 0.00 0.00 0.00 0.00 47.33 46.79 1ck6 h GLY 270 CO -0.25 0.55 -0.01 0.06 0.00 0.00 0.00 176.54 176.89 1ck6 h GLN 271 N 1.22 0.90 -0.24 4.80 3.07 -1.18 -0.40 115.11 123.27 1ck6 h GLN 271 Ca 0.31 -0.29 -0.05 0.00 0.09 0.00 0.00 58.65 58.71 1ck6 h GLN 271 Cb 0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 27.48 27.48 1ck6 h GLN 271 CO -0.05 0.93 -0.03 0.00 0.09 0.00 0.00 178.83 179.76 1ck6 h ARG 272 N 0.76 0.45 -0.47 0.06 3.08 -1.06 -2.32 114.38 114.88 1ck6 h ARG 272 Ca 0.14 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 1ck6 h ARG 272 Cb 0.53 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 1ck6 h ARG 272 CO 0.03 0.66 0.19 -0.92 -1.07 0.00 0.00 179.97 178.86 1ck6 h TYR 273 N 0.21 0.70 -0.80 3.04 3.20 -0.93 -1.65 116.97 120.74 1ck6 h TYR 273 Ca 0.06 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 61.94 1ck6 h TYR 273 Cb 0.48 -0.21 -0.06 0.00 1.54 0.00 0.00 36.73 38.48 1ck6 h TYR 273 CO 0.05 0.59 0.49 -0.09 -1.64 0.00 0.00 178.16 177.56 1ck6 h ARG 274 N 0.61 0.88 -0.22 1.82 2.43 -0.96 -0.78 114.38 118.16 1ck6 h ARG 274 Ca 0.16 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1ck6 h ARG 274 Cb 0.19 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1ck6 h ARG 274 CO -0.01 0.58 0.02 0.00 -1.51 0.00 0.00 179.97 179.05 1ck6 h ALA 275 N 1.38 0.30 -0.51 2.80 0.00 -1.17 -1.65 119.26 120.40 1ck6 h ALA 275 Ca 0.34 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1ck6 h ALA 275 Cb 0.14 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1ck6 h ALA 275 CO -0.16 -0.00 -0.09 0.00 0.00 0.00 0.00 179.25 178.99 1ck6 h ALA 276 N 0.82 0.87 -0.49 0.00 0.00 -1.03 -2.47 119.26 116.95 1ck6 h ALA 276 Ca 0.07 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 1ck6 h ALA 276 Cb 0.36 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1ck6 h ALA 276 CO 0.01 0.65 0.02 0.52 0.00 0.00 0.00 179.25 180.45 1ck6 h MET 277 N 0.85 0.80 -0.76 0.00 2.07 -1.10 -0.34 114.93 116.44 1ck6 h MET 277 Ca 0.14 -0.21 -0.03 0.00 -2.07 0.00 0.00 59.70 57.53 1ck6 h MET 277 Cb 0.63 -0.10 -0.04 0.00 -1.87 0.00 0.00 31.60 30.22 1ck6 h MET 277 CO 0.04 0.79 0.35 0.00 1.07 0.00 0.00 176.91 179.17 1ck6 h ALA 278 N 1.27 1.19 -0.08 6.32 0.00 -0.99 -0.55 119.26 126.40 1ck6 h ALA 278 Ca 0.15 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ck6 h ALA 278 Cb 0.43 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1ck6 h ALA 278 CO 0.02 0.61 0.02 -0.22 0.00 0.00 0.00 179.25 179.68 1ck6 h LYS 279 N 1.09 0.14 -0.44 0.00 3.64 -0.98 -3.03 116.57 116.99 1ck6 h LYS 279 Ca 0.26 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1ck6 h LYS 279 Cb 0.13 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1ck6 h LYS 279 CO -0.03 0.34 0.21 1.98 -2.27 0.00 0.00 179.45 179.68 1ck6 h MET 280 N -0.09 0.60 0.00 1.90 4.05 -0.76 -2.69 114.93 117.94 1ck6 h MET 280 Ca 0.03 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1ck6 h MET 280 Cb 0.27 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 30.95 1ck6 h MET 280 CO 0.00 0.47 0.00 0.66 0.23 0.00 0.00 176.91 178.27 1ck6 h SER 281 N 0.61 0.00 -0.18 1.39 4.64 -0.98 -2.85 113.55 116.19 1ck6 h SER 281 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1ck6 h SER 281 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1ck6 h SER 281 CO -0.02 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.27 1ck6 n VAL 282 N -3.01 1.74 -1.70 0.95 0.24 -1.02 -4.76 118.33 110.78 1ck6 n VAL 282 Ca -0.01 -1.66 -0.42 0.00 -2.04 0.00 0.00 64.34 60.21 1ck6 n VAL 282 Cb 0.20 0.02 -0.03 0.00 -1.47 0.00 0.00 33.84 32.55 1ck6 n VAL 282 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1ck6 s LEU 283 N -2.19 4.39 0.00 1.34 1.02 -1.08 -0.70 118.68 121.46 1ck6 s LEU 283 Ca 0.30 2.81 0.00 0.00 0.02 0.00 0.00 54.13 57.26 1ck6 s LEU 283 Cb 0.23 -3.58 0.00 0.00 0.02 0.00 0.00 46.19 42.87 1ck6 s LEU 283 CO 0.08 -1.01 0.00 0.61 0.02 0.00 0.00 176.35 176.05 1ck6 n GLY 284 N 4.18 0.75 3.19 -3.19 0.00 -1.26 -0.99 105.19 107.87 1ck6 n GLY 284 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 1ck6 n GLY 284 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ck6 s PHE 285 N -2.68 0.99 -0.35 1.61 0.40 0.12 -4.94 117.98 113.13 1ck6 s PHE 285 Ca 0.00 -1.09 -0.11 0.00 -0.60 0.00 0.00 56.93 55.13 1ck6 s PHE 285 Cb 0.00 -0.57 0.01 0.00 0.51 0.00 0.00 43.02 42.97 1ck6 s PHE 285 CO 0.00 -0.33 0.19 0.34 0.70 0.00 0.00 175.22 176.12 1ck6 s ASP 286 N -3.09 5.69 0.58 1.36 2.15 -1.26 -4.93 116.67 117.16 1ck6 s ASP 286 Ca 0.21 -0.81 0.33 0.00 0.43 0.00 0.00 52.55 52.71 1ck6 s ASP 286 Cb 0.07 -2.02 1.77 0.00 -0.30 0.00 0.00 42.92 42.44 1ck6 s ASP 286 CO 0.01 -0.32 2.18 0.08 -0.17 0.00 0.00 175.17 176.95 1ck6 h ARG 287 N 8.41 0.00 0.00 4.34 0.11 -1.96 0.18 114.38 125.46 1ck6 h ARG 287 Ca -0.28 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.80 1ck6 h ARG 287 Cb 1.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.20 1ck6 h ARG 287 CO 0.65 0.05 0.00 0.09 0.10 0.00 0.00 179.97 180.86 1ck6 n ASN 288 N -3.45 0.28 -0.37 0.08 5.03 -1.26 -1.47 115.26 114.09 1ck6 n ASN 288 Ca -0.02 0.56 0.13 0.00 0.87 0.00 0.00 54.58 56.12 1ck6 n ASN 288 Cb 0.17 -0.62 0.34 0.00 -1.02 0.00 0.00 39.78 38.66 1ck6 n ASN 288 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ck6 n ALA 289 N -1.61 3.00 -2.89 5.41 0.00 0.61 -4.96 120.51 120.07 1ck6 n ALA 289 Ca 0.04 -0.46 -0.21 0.00 0.00 0.00 0.00 53.44 52.81 1ck6 n ALA 289 Cb 0.23 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 1ck6 n ALA 289 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ck6 s LEU 290 N -2.36 4.20 -0.15 0.00 1.43 -0.54 -4.95 118.68 116.30 1ck6 s LEU 290 Ca 0.27 -0.01 -0.07 0.00 -1.03 0.00 0.00 54.13 53.29 1ck6 s LEU 290 Cb 0.19 -2.76 -0.04 0.00 0.03 0.00 0.00 46.19 43.61 1ck6 s LEU 290 CO 0.48 -0.11 0.09 -0.89 0.23 0.00 0.00 176.35 176.15 1ck6 s THR 291 N -2.03 5.04 -0.29 5.49 2.01 -0.04 -4.90 115.64 120.92 1ck6 s THR 291 Ca 0.35 0.04 -0.28 0.00 0.31 0.00 0.00 61.69 62.11 1ck6 s THR 291 Cb -0.09 -3.23 0.01 0.00 0.01 0.00 0.00 72.50 69.21 1ck6 s THR 291 CO 0.29 0.53 1.03 -0.62 -0.69 0.00 0.00 174.62 175.15 1ck6 s ASP 292 N -0.26 6.95 -0.26 3.53 -1.08 -1.26 -0.33 116.67 123.95 1ck6 s ASP 292 Ca 0.09 1.10 0.09 0.00 -0.52 0.00 0.00 52.55 53.31 1ck6 s ASP 292 Cb -0.12 -2.52 0.45 0.00 -1.46 0.00 0.00 42.92 39.27 1ck6 s ASP 292 CO 0.01 -0.78 1.20 0.00 0.52 0.00 0.00 175.17 176.12 1ck6 h SER 294 N 1.84 0.00 0.28 0.00 0.02 -1.85 -1.37 113.55 112.46 1ck6 h SER 294 Ca 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1ck6 h SER 294 Cb 1.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.92 1ck6 h SER 294 CO 0.52 0.19 0.00 -0.90 -1.14 0.00 0.00 176.83 175.50 1ck6 n ASP 295 N -3.99 0.39 0.19 3.07 5.68 -1.26 -1.79 116.55 118.83 1ck6 n ASP 295 Ca -0.02 0.64 0.06 0.00 -0.50 0.00 0.00 54.79 54.97 1ck6 n ASP 295 Cb 0.27 -0.71 0.31 0.00 -1.14 0.00 0.00 41.12 39.86 1ck6 n ASP 295 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1ck6 h VAL 296 N 0.00 0.82 -2.93 2.12 2.07 -1.63 -3.45 116.25 113.25 1ck6 h VAL 296 Ca 0.00 -1.55 -0.56 0.00 0.82 0.00 0.00 66.70 65.41 1ck6 h VAL 296 Cb 0.14 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.85 1ck6 h VAL 296 CO 0.00 0.36 0.86 -0.63 0.02 0.00 0.00 177.57 178.18 1ck6 s ILE 297 N -3.52 4.19 0.68 4.57 -1.09 -0.74 -5.01 121.20 120.27 1ck6 s ILE 297 Ca 0.01 1.47 -0.12 0.00 -2.23 0.00 0.00 60.65 59.77 1ck6 s ILE 297 Cb 0.10 -3.94 0.01 0.00 -1.58 0.00 0.00 42.46 37.04 1ck6 s ILE 297 CO 0.69 -0.09 1.07 -2.16 -1.23 0.00 0.00 174.94 173.22 1ck6 s PRO 298 N 3.14 2.87 0.43 2.79 0.04 -1.26 -5.04 135.00 137.98 1ck6 s PRO 298 Ca 0.57 1.12 -0.22 0.00 0.04 0.00 0.00 61.00 62.50 1ck6 s PRO 298 Cb -0.24 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 1ck6 s PRO 298 CO 0.18 -1.16 1.03 -1.12 0.04 0.00 0.00 177.00 175.98 1ck6 s SER 299 N -3.30 6.62 0.48 6.66 0.01 -1.26 -4.79 113.70 118.12 1ck6 s SER 299 Ca 0.61 1.96 -0.03 0.00 1.31 0.00 0.00 55.95 59.80 1ck6 s SER 299 Cb -0.16 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.48 1ck6 s SER 299 CO 0.49 -0.58 0.75 0.00 0.41 0.00 0.00 173.24 174.30 1ck6 s ALA 300 N -1.83 3.52 0.37 1.44 0.00 -1.26 -4.93 121.76 119.08 1ck6 s ALA 300 Ca 0.62 -0.76 -0.25 0.00 0.00 0.00 0.00 51.96 51.56 1ck6 s ALA 300 Cb -0.19 -2.40 -0.09 0.00 0.00 0.00 0.00 23.12 20.44 1ck6 s ALA 300 CO 0.23 -0.42 1.04 0.54 0.00 0.00 0.00 175.76 177.15 1ck6 s VAL 301 N -2.69 3.77 0.52 0.00 0.11 -1.26 -4.87 120.40 115.99 1ck6 s VAL 301 Ca 0.48 1.42 -0.20 0.00 -2.93 0.00 0.00 61.98 60.76 1ck6 s VAL 301 Cb -0.10 -3.77 -0.07 0.00 -1.53 0.00 0.00 36.38 30.92 1ck6 s VAL 301 CO 0.42 0.07 1.11 -0.44 -3.33 0.00 0.00 175.10 172.92 1ck6 s SER 302 N -1.49 5.91 -0.24 3.54 0.01 -1.26 -1.32 113.70 118.85 1ck6 s SER 302 Ca 0.55 2.11 -0.13 0.00 1.31 0.00 0.00 55.95 59.79 1ck6 s SER 302 Cb -0.23 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.38 1ck6 s SER 302 CO 0.28 -1.09 0.29 0.21 0.41 0.00 0.00 173.24 173.35 1ck6 s ASN 303 N -1.81 6.25 0.00 2.44 2.47 -1.26 -4.56 114.94 118.46 1ck6 s ASN 303 Ca 0.71 0.28 0.17 0.00 0.42 0.00 0.00 52.86 54.44 1ck6 s ASN 303 Cb -0.22 -2.17 0.02 0.00 -1.45 0.00 0.00 41.25 37.42 1ck6 s ASN 303 CO 0.25 -0.06 0.92 0.59 -3.72 0.00 0.00 177.10 175.08 1ck6 n ASN 304 N 4.69 1.82 -4.75 -4.21 5.03 -1.26 -4.91 115.26 111.66 1ck6 n ASN 304 Ca -0.11 -1.41 -0.40 0.00 0.87 0.00 0.00 54.58 53.53 1ck6 n ASN 304 Cb 0.51 0.39 -0.04 0.00 -1.02 0.00 0.00 39.78 39.62 1ck6 n ASN 304 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ck6 s ALA 305 N -1.90 3.39 0.55 5.41 0.00 -1.26 -5.05 121.76 122.91 1ck6 s ALA 305 Ca 0.15 0.85 -0.13 0.00 0.00 0.00 0.00 51.96 52.83 1ck6 s ALA 305 Cb 0.14 -3.32 -0.06 0.00 0.00 0.00 0.00 23.12 19.88 1ck6 s ALA 305 CO 0.40 -0.12 0.98 0.00 0.00 0.00 0.00 175.76 177.01 1ck6 s ALA 306 N -1.02 3.11 0.43 0.00 0.00 -1.26 -5.04 121.76 117.99 1ck6 s ALA 306 Ca 0.45 0.01 -0.26 0.00 0.00 0.00 0.00 51.96 52.16 1ck6 s ALA 306 Cb -0.31 -3.05 -0.09 0.00 0.00 0.00 0.00 23.12 19.67 1ck6 s ALA 306 CO 0.39 -0.42 1.37 -2.30 0.00 0.00 0.00 175.76 174.79 1ck6 n PRO 307 N -2.10 2.14 -4.01 0.00 -0.02 -1.26 -5.03 135.00 124.71 1ck6 n PRO 307 Ca 0.06 0.76 -0.08 0.00 -2.02 0.00 0.00 63.50 62.22 1ck6 n PRO 307 Cb 0.54 -2.52 -0.10 0.00 -0.02 0.00 0.00 33.50 31.40 1ck6 n PRO 307 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1ck6 s VAL 308 N -1.19 0.17 -0.34 -1.45 -7.23 -1.26 -3.78 120.40 105.31 1ck6 s VAL 308 Ca 0.61 -1.40 -0.15 0.00 -1.81 0.00 0.00 61.98 59.22 1ck6 s VAL 308 Cb -0.48 -1.11 -0.01 0.00 0.56 0.00 0.00 36.38 35.34 1ck6 s VAL 308 CO 0.58 -0.78 0.35 -0.63 -0.31 0.00 0.00 175.10 174.32 1ck6 s ILE 309 N -3.13 5.18 0.76 -0.62 1.01 0.51 -4.96 121.20 119.95 1ck6 s ILE 309 Ca -0.00 0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.54 1ck6 s ILE 309 Cb 0.02 -3.82 0.04 0.00 0.01 0.00 0.00 42.46 38.72 1ck6 s ILE 309 CO -0.07 -0.09 1.10 -2.16 0.00 0.00 0.00 174.94 173.71 1ck6 s PRO 310 N 1.99 2.43 -1.70 2.79 0.04 -1.26 -1.82 135.00 137.46 1ck6 s PRO 310 Ca 0.11 0.58 -0.17 0.00 0.04 0.00 0.00 61.00 61.56 1ck6 s PRO 310 Cb -0.17 -1.96 0.15 0.00 0.04 0.00 0.00 34.50 32.56 1ck6 s PRO 310 CO 0.12 -1.36 0.65 0.41 0.04 0.00 0.00 177.00 176.86 1ck6 n GLY 311 N -2.47 -0.39 1.73 0.56 0.00 -1.26 -1.85 105.19 101.51 1ck6 n GLY 311 Ca 0.07 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1ck6 n GLY 311 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ck6 n GLY 312 N -1.47 1.52 3.75 -0.02 0.00 -0.85 -3.24 105.19 104.88 1ck6 n GLY 312 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1ck6 n GLY 312 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ck6 s LEU 313 N 0.00 2.40 0.00 0.99 1.43 -0.77 -4.97 118.68 117.76 1ck6 s LEU 313 Ca 0.00 1.45 0.01 0.00 -1.03 0.00 0.00 54.13 54.56 1ck6 s LEU 313 Cb 0.00 -3.94 -0.00 0.00 0.03 0.00 0.00 46.19 42.27 1ck6 s LEU 313 CO 0.00 -2.41 0.03 0.35 0.23 0.00 0.00 176.35 174.55 1ck6 n THR 314 N -3.73 0.00 0.23 5.49 -2.24 -1.26 -4.66 114.28 108.11 1ck6 n THR 314 Ca 0.07 -0.40 0.08 0.00 -2.27 0.00 0.00 64.05 61.53 1ck6 n THR 314 Cb 0.55 0.17 0.57 0.00 -2.10 0.00 0.00 70.33 69.53 1ck6 n THR 314 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1ck6 h VAL 315 N 1.14 0.90 0.00 2.28 2.07 -1.96 -0.33 116.25 120.35 1ck6 h VAL 315 Ca -0.05 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 1ck6 h VAL 315 Cb 0.20 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1ck6 h VAL 315 CO 0.07 0.18 -0.01 0.44 0.02 0.00 0.00 177.57 178.28 1ck6 h ASP 316 N 0.00 0.00 0.49 0.57 3.32 -2.01 -1.07 116.42 117.72 1ck6 h ASP 316 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ck6 h ASP 316 Cb 0.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1ck6 h ASP 316 CO 0.02 0.01 -0.24 0.47 -1.72 0.00 0.00 179.24 177.78 1ck6 n ASP 317 N -3.12 0.50 -4.84 6.45 8.00 -0.13 -4.82 116.55 118.58 1ck6 n ASP 317 Ca -0.01 -0.35 -0.37 0.00 0.71 0.00 0.00 54.79 54.77 1ck6 n ASP 317 Cb 0.22 -0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.25 1ck6 n ASP 317 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1ck6 s ILE 318 N -2.74 5.34 -1.21 0.53 -5.25 -0.41 -1.11 121.20 116.35 1ck6 s ILE 318 Ca 0.20 0.43 -0.17 0.00 -0.99 0.00 0.00 60.65 60.12 1ck6 s ILE 318 Cb 0.19 -3.52 0.11 0.00 2.95 0.00 0.00 42.46 42.18 1ck6 s ILE 318 CO 0.56 0.57 1.56 -1.61 -1.79 0.00 0.00 174.94 174.24 1ck6 s GLU 319 N -0.77 3.96 0.12 0.37 2.02 -0.15 -4.93 118.70 119.31 1ck6 s GLU 319 Ca 0.17 -2.10 -0.31 0.00 0.02 0.00 0.00 54.97 52.76 1ck6 s GLU 319 Cb -0.13 -5.32 -0.10 0.00 0.10 0.00 0.00 34.13 28.68 1ck6 s GLU 319 CO 0.06 -2.05 1.84 0.08 0.02 0.00 0.00 175.26 175.21 1ck6 s VAL 320 N 3.28 2.56 -0.05 2.63 1.01 -1.26 -4.88 120.40 123.70 1ck6 s VAL 320 Ca 0.48 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.51 1ck6 s VAL 320 Cb 0.01 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1ck6 s VAL 320 CO 0.02 -0.00 0.45 -1.20 0.00 0.00 0.00 175.10 174.37 1ck6 n SER 321 N 5.80 0.91 -4.44 3.32 7.64 -1.26 -4.94 113.62 120.65 1ck6 n SER 321 Ca 0.18 -0.95 -0.43 0.00 1.01 0.00 0.00 58.87 58.67 1ck6 n SER 321 Cb 0.38 0.12 -0.09 0.00 -1.01 0.00 0.00 64.21 63.62 1ck6 n SER 321 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ck6 h PRO 323 N 8.71 0.00 0.02 0.00 0.13 -1.97 -3.29 132.00 135.61 1ck6 h PRO 323 Ca -0.27 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.53 1ck6 h PRO 323 Cb 1.11 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.19 1ck6 h PRO 323 CO 0.81 0.00 -1.93 -1.13 -0.23 0.00 0.00 178.00 175.51 1ck6 n SER 324 N -2.70 0.92 -4.34 1.44 3.41 -1.26 -4.94 113.62 106.15 1ck6 n SER 324 Ca 0.02 0.27 -0.32 0.00 -0.26 0.00 0.00 58.87 58.58 1ck6 n SER 324 Cb 0.30 0.03 -0.15 0.00 -0.26 0.00 0.00 64.21 64.13 1ck6 n SER 324 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1ck6 s GLU 325 N -2.57 2.44 0.62 4.33 1.03 -1.24 -5.11 118.70 118.20 1ck6 s GLU 325 Ca -0.10 -0.85 -0.18 0.00 0.03 0.00 0.00 54.97 53.88 1ck6 s GLU 325 Cb 0.07 -2.21 -0.02 0.00 -0.80 0.00 0.00 34.13 31.18 1ck6 s GLU 325 CO 0.81 0.50 1.19 -1.25 -1.33 0.00 0.00 175.26 175.18 1ck6 s PRO 326 N -0.44 2.83 0.26 -4.83 0.04 -1.26 -4.78 135.00 126.82 1ck6 s PRO 326 Ca 0.05 1.76 -0.30 0.00 0.04 0.00 0.00 61.00 62.55 1ck6 s PRO 326 Cb -0.12 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.40 1ck6 s PRO 326 CO 0.01 -1.30 1.45 0.12 0.04 0.00 0.00 177.00 177.32 1ck6 s PHE 327 N -1.75 2.98 0.71 0.56 5.36 -1.26 -4.97 117.98 119.61 1ck6 s PHE 327 Ca 0.76 1.02 -0.16 0.00 -0.96 0.00 0.00 56.93 57.58 1ck6 s PHE 327 Cb -0.29 -3.85 0.02 0.00 -0.34 0.00 0.00 43.02 38.57 1ck6 s PHE 327 CO 0.36 -2.75 1.26 -1.25 -1.46 0.00 0.00 175.22 171.38 1ck6 s PRO 328 N -0.49 2.22 -0.59 10.12 0.04 -1.26 -4.93 135.00 140.11 1ck6 s PRO 328 Ca 0.59 1.94 -0.28 0.00 0.04 0.00 0.00 61.00 63.30 1ck6 s PRO 328 Cb -0.43 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.30 1ck6 s PRO 328 CO 0.45 -1.82 1.45 -2.00 0.04 0.00 0.00 177.00 175.12 1ck6 s GLU 329 N -3.67 3.21 0.06 4.56 2.56 -1.26 -4.98 118.70 119.18 1ck6 s GLU 329 Ca 0.79 0.38 0.04 0.00 0.00 0.00 0.00 54.97 56.18 1ck6 s GLU 329 Cb -0.34 -4.16 -0.04 0.00 2.00 0.00 0.00 34.13 31.59 1ck6 s GLU 329 CO 0.44 -2.06 -0.02 0.42 -0.56 0.00 0.00 175.26 173.48 1ck6 s ILE 330 N 6.36 3.90 0.51 -3.70 1.01 -1.26 -5.07 121.20 122.95 1ck6 s ILE 330 Ca 0.52 -0.91 -0.21 0.00 0.00 0.00 0.00 60.65 60.05 1ck6 s ILE 330 Cb -0.11 -2.81 -0.06 0.00 0.01 0.00 0.00 42.46 39.50 1ck6 s ILE 330 CO 0.23 0.22 1.18 0.00 0.00 0.00 0.00 174.94 176.56 1ck6 s ALA 331 N -1.20 2.83 0.25 9.38 0.00 -1.25 -4.83 121.76 126.95 1ck6 s ALA 331 Ca 0.22 0.94 0.07 0.00 0.00 0.00 0.00 51.96 53.20 1ck6 s ALA 331 Cb -0.11 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 1ck6 s ALA 331 CO 0.14 -0.81 0.19 0.95 0.00 0.00 0.00 175.76 176.24 1ck6 s THR 332 N -1.60 4.40 -0.11 0.00 -4.23 -1.26 -0.36 115.64 112.48 1ck6 s THR 332 Ca 0.69 -1.42 -0.01 0.00 -1.18 0.00 0.00 61.69 59.76 1ck6 s THR 332 Cb -0.28 -3.38 -0.03 0.00 1.34 0.00 0.00 72.50 70.15 1ck6 s THR 332 CO 0.33 -0.35 -0.06 0.00 -0.54 0.00 0.00 174.62 174.01 1ck6 s ALA 333 N -2.14 2.99 -1.44 3.99 0.00 -0.76 -4.83 121.76 119.57 1ck6 s ALA 333 Ca 0.33 -0.86 -0.12 0.00 0.00 0.00 0.00 51.96 51.32 1ck6 s ALA 333 Cb -0.08 -1.37 0.05 0.00 0.00 0.00 0.00 23.12 21.72 1ck6 s ALA 333 CO 0.25 0.42 2.28 0.43 0.00 0.00 0.00 175.76 179.14 1ck6 n SER 334 N 2.78 5.20 -2.79 0.00 7.64 -1.26 -2.00 113.62 123.18 1ck6 n SER 334 Ca -0.18 -2.87 -0.12 0.00 1.01 0.00 0.00 58.87 56.71 1ck6 n SER 334 Cb 0.53 -1.59 -0.02 0.00 -1.01 0.00 0.00 64.21 62.13 1ck6 n SER 334 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ck6 n GLY 335 N 3.58 1.90 3.82 0.23 0.00 -1.26 -4.94 105.19 108.53 1ck6 n GLY 335 Ca 0.54 -1.51 -0.30 0.00 0.00 0.00 0.00 46.02 44.76 1ck6 n GLY 335 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ck6 s PRO 336 N -2.58 2.33 0.08 1.61 0.04 -1.26 -2.78 135.00 132.44 1ck6 s PRO 336 Ca 0.24 0.64 -0.31 0.00 0.04 0.00 0.00 61.00 61.61 1ck6 s PRO 336 Cb -0.02 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.48 1ck6 s PRO 336 CO 0.17 -1.45 1.83 -1.17 0.04 0.00 0.00 177.00 176.43 1ck6 s LEU 337 N -5.67 4.40 0.89 -3.56 2.96 -1.20 -4.36 118.68 112.14 1ck6 s LEU 337 Ca 0.60 2.67 -0.11 0.00 -0.22 0.00 0.00 54.13 57.07 1ck6 s LEU 337 Cb -0.14 -3.55 0.13 0.00 0.50 0.00 0.00 46.19 43.13 1ck6 s LEU 337 CO 0.54 -1.00 1.10 -2.16 -1.32 0.00 0.00 176.35 173.51 1ck6 s PRO 338 N 3.26 1.28 -0.10 0.98 0.04 -1.26 -4.97 135.00 134.23 1ck6 s PRO 338 Ca 0.82 1.20 0.00 0.00 0.04 0.00 0.00 61.00 63.06 1ck6 s PRO 338 Cb -0.44 -1.78 0.02 0.00 0.04 0.00 0.00 34.50 32.34 1ck6 s PRO 338 CO 0.37 -2.33 -0.09 0.45 0.04 0.00 0.00 177.00 175.44 1ck6 s SER 339 N -3.06 2.09 -0.04 6.66 0.15 -1.26 -3.95 113.70 114.29 1ck6 s SER 339 Ca 0.64 -0.31 -0.17 0.00 0.70 0.00 0.00 55.95 56.82 1ck6 s SER 339 Cb -0.20 -0.85 -0.05 0.00 -1.71 0.00 0.00 66.02 63.21 1ck6 s SER 339 CO 0.58 -0.08 0.47 -0.76 1.20 0.00 0.00 173.24 174.65 1ck6 s LEU 340 N 1.44 4.39 0.59 3.45 1.43 -0.01 -4.95 118.68 125.03 1ck6 s LEU 340 Ca 0.00 0.95 -0.14 0.00 -1.03 0.00 0.00 54.13 53.91 1ck6 s LEU 340 Cb -0.13 -2.69 -0.04 0.00 0.03 0.00 0.00 46.19 43.35 1ck6 s LEU 340 CO -0.05 0.17 1.03 0.00 0.23 0.00 0.00 176.35 177.72 1ck6 s ALA 341 N -0.29 2.89 0.66 4.21 0.00 -1.26 -4.37 121.76 123.60 1ck6 s ALA 341 Ca 0.26 0.18 -0.18 0.00 0.00 0.00 0.00 51.96 52.22 1ck6 s ALA 341 Cb -0.16 -3.16 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 1ck6 s ALA 341 CO 0.13 -0.69 1.17 -0.35 0.00 0.00 0.00 175.76 176.02 1ck6 n PRO 342 N -2.23 0.94 -2.09 0.00 -0.04 -1.26 -4.60 135.00 125.72 1ck6 n PRO 342 Ca 0.07 0.37 -0.40 0.00 -0.04 0.00 0.00 63.50 63.51 1ck6 n PRO 342 Cb 0.54 -2.40 -0.01 0.00 -0.04 0.00 0.00 33.50 31.58 1ck6 n PRO 342 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ck6 s ALA 343 N -1.50 3.37 -2.00 0.55 0.00 0.20 -4.96 121.76 117.42 1ck6 s ALA 343 Ca 0.80 1.24 0.19 0.00 0.00 0.00 0.00 51.96 54.19 1ck6 s ALA 343 Cb -0.38 -3.48 1.13 0.00 0.00 0.00 0.00 23.12 20.39 1ck6 s ALA 343 CO 0.43 -0.73 1.52 -0.35 0.00 0.00 0.00 175.76 176.63