#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ic4 s ILE 2 N 0.00 4.67 -0.14 0.53 1.01 -1.26 -4.98 121.20 121.03 1ic4 s ILE 2 Ca 0.00 1.24 -0.07 0.00 0.00 0.00 0.00 60.65 61.82 1ic4 s ILE 2 Cb 0.00 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1ic4 s ILE 2 CO 0.00 -0.41 0.11 0.54 0.00 0.00 0.00 174.94 175.19 1ic4 s VAL 3 N 3.26 5.28 -0.19 2.92 0.11 -1.26 -4.78 120.40 125.74 1ic4 s VAL 3 Ca 0.36 0.13 -0.02 0.00 -2.93 0.00 0.00 61.98 59.52 1ic4 s VAL 3 Cb -0.13 -3.32 -0.00 0.00 -1.53 0.00 0.00 36.38 31.40 1ic4 s VAL 3 CO 0.15 0.57 -0.11 -0.76 -3.33 0.00 0.00 175.10 171.63 1ic4 s LEU 4 N -0.60 2.64 -0.13 2.54 1.02 -1.26 0.82 118.68 123.71 1ic4 s LEU 4 Ca 0.12 -0.45 0.00 0.00 0.02 0.00 0.00 54.13 53.82 1ic4 s LEU 4 Cb -0.12 -1.64 -0.01 0.00 0.02 0.00 0.00 46.19 44.44 1ic4 s LEU 4 CO 0.02 0.02 -0.13 -0.89 0.02 0.00 0.00 176.35 175.39 1ic4 s THR 5 N 1.19 3.03 0.00 5.49 2.01 -0.09 -3.94 115.64 123.34 1ic4 s THR 5 Ca 0.02 -0.67 0.05 0.00 0.31 0.00 0.00 61.69 61.40 1ic4 s THR 5 Cb -0.14 -2.27 -0.03 0.00 0.01 0.00 0.00 72.50 70.07 1ic4 s THR 5 CO -0.04 0.53 -0.14 -1.10 -0.69 0.00 0.00 174.62 173.18 1ic4 s GLN 6 N 0.30 2.33 0.22 4.92 -0.21 -1.26 -0.88 119.66 125.09 1ic4 s GLN 6 Ca -0.10 -0.82 -0.00 0.00 0.02 0.00 0.00 55.36 54.45 1ic4 s GLN 6 Cb -0.16 -2.33 -0.04 0.00 1.00 0.00 0.00 33.01 31.49 1ic4 s GLN 6 CO 0.06 0.58 0.17 -1.54 -2.12 0.00 0.00 175.29 172.44 1ic4 s SER 7 N -1.22 0.35 1.00 5.90 1.04 -0.93 -4.36 113.70 115.48 1ic4 s SER 7 Ca 0.14 -1.42 -0.20 0.00 0.48 0.00 0.00 55.95 54.95 1ic4 s SER 7 Cb -0.11 0.42 -0.12 0.00 0.10 0.00 0.00 66.02 66.30 1ic4 s SER 7 CO 0.04 -0.89 -0.83 -0.81 0.98 0.00 0.00 173.24 171.74 1ic4 n PRO 8 N -0.33 -0.15 0.19 4.02 -0.04 -1.26 -1.44 135.00 135.99 1ic4 n PRO 8 Ca 0.03 -0.04 0.06 0.00 -0.04 0.00 0.00 63.50 63.51 1ic4 n PRO 8 Cb 0.65 -1.15 0.32 0.00 -0.04 0.00 0.00 33.50 33.28 1ic4 n PRO 8 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ic4 h ALA 9 N -1.15 0.95 -3.08 0.55 0.00 -1.83 -3.41 119.26 111.29 1ic4 h ALA 9 Ca -0.43 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.00 1ic4 h ALA 9 Cb 1.33 -0.06 -0.25 0.00 0.00 0.00 0.00 17.79 18.82 1ic4 h ALA 9 CO 0.25 0.43 -0.46 0.99 0.00 0.00 0.00 179.25 180.46 1ic4 s THR 10 N -3.51 0.02 -0.13 0.00 2.01 -1.26 -1.19 115.64 111.58 1ic4 s THR 10 Ca 0.01 -0.16 -0.05 0.00 0.31 0.00 0.00 61.69 61.80 1ic4 s THR 10 Cb 0.10 -0.35 0.06 0.00 0.01 0.00 0.00 72.50 72.33 1ic4 s THR 10 CO 0.68 -0.09 0.27 -0.22 -0.69 0.00 0.00 174.62 174.57 1ic4 s LEU 11 N -0.26 -0.26 -0.08 4.42 0.20 0.36 -4.89 118.68 118.16 1ic4 s LEU 11 Ca -0.04 0.61 -0.03 0.00 0.69 0.00 0.00 54.13 55.36 1ic4 s LEU 11 Cb -0.03 0.73 -0.04 0.00 -0.43 0.00 0.00 46.19 46.43 1ic4 s LEU 11 CO 0.01 -0.23 0.06 -0.94 -0.29 0.00 0.00 176.35 174.96 1ic4 s SER 12 N 2.34 5.71 -0.12 3.68 1.04 -1.26 -1.21 113.70 123.89 1ic4 s SER 12 Ca 0.00 0.26 -0.13 0.00 0.48 0.00 0.00 55.95 56.57 1ic4 s SER 12 Cb -0.12 -1.71 0.03 0.00 0.10 0.00 0.00 66.02 64.33 1ic4 s SER 12 CO -0.09 0.37 0.35 0.54 0.98 0.00 0.00 173.24 175.40 1ic4 s VAL 13 N -0.99 0.01 0.08 5.02 0.11 0.26 -4.80 120.40 120.09 1ic4 s VAL 13 Ca 0.15 -0.04 -0.23 0.00 -2.93 0.00 0.00 61.98 58.93 1ic4 s VAL 13 Cb -0.12 -0.51 -0.06 0.00 -1.53 0.00 0.00 36.38 34.16 1ic4 s VAL 13 CO 0.05 -0.02 0.71 0.42 -3.33 0.00 0.00 175.10 172.92 1ic4 s THR 14 N 0.04 4.65 0.28 5.04 -4.23 -1.26 -1.74 115.64 118.42 1ic4 s THR 14 Ca -0.01 1.52 -0.28 0.00 -1.18 0.00 0.00 61.69 61.73 1ic4 s THR 14 Cb -0.03 -4.06 -0.14 0.00 1.34 0.00 0.00 72.50 69.61 1ic4 s THR 14 CO 0.01 0.45 1.00 -2.65 -0.54 0.00 0.00 174.62 172.89 1ic4 n PRO 15 N 2.24 1.28 0.00 3.99 -0.02 -1.26 -2.16 135.00 139.08 1ic4 n PRO 15 Ca -0.05 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1ic4 n PRO 15 Cb 0.50 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1ic4 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ic4 n GLY 16 N 1.32 1.06 3.95 -1.23 0.00 -0.40 -4.93 105.19 104.97 1ic4 n GLY 16 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 1ic4 n GLY 16 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ic4 s ASN 17 N -1.74 4.59 0.02 1.61 0.01 -0.92 -4.54 114.94 113.97 1ic4 s ASN 17 Ca 0.00 0.17 0.02 0.00 -0.71 0.00 0.00 52.86 52.33 1ic4 s ASN 17 Cb 0.00 -0.73 -0.04 0.00 0.41 0.00 0.00 41.25 40.90 1ic4 s ASN 17 CO 0.00 -1.71 0.04 -0.44 -1.51 0.00 0.00 177.10 173.48 1ic4 s SER 18 N -4.59 5.36 0.07 -1.22 0.01 -1.25 -0.51 113.70 111.57 1ic4 s SER 18 Ca 0.63 0.02 -0.09 0.00 1.31 0.00 0.00 55.95 57.81 1ic4 s SER 18 Cb -0.09 -1.44 0.00 0.00 0.21 0.00 0.00 66.02 64.70 1ic4 s SER 18 CO 0.44 0.24 0.20 0.68 0.41 0.00 0.00 173.24 175.22 1ic4 s VAL 19 N -1.21 0.13 -0.04 3.43 -7.23 -0.65 -4.98 120.40 109.85 1ic4 s VAL 19 Ca 0.23 -1.05 -0.03 0.00 -1.81 0.00 0.00 61.98 59.32 1ic4 s VAL 19 Cb -0.12 -1.17 0.01 0.00 0.56 0.00 0.00 36.38 35.67 1ic4 s VAL 19 CO 0.15 -0.58 0.10 -0.94 -0.31 0.00 0.00 175.10 173.52 1ic4 s SER 20 N -2.56 -0.10 -0.02 4.85 1.04 -1.26 -1.15 113.70 114.50 1ic4 s SER 20 Ca 0.01 0.21 0.06 0.00 0.48 0.00 0.00 55.95 56.70 1ic4 s SER 20 Cb 0.03 0.19 -0.03 0.00 0.10 0.00 0.00 66.02 66.31 1ic4 s SER 20 CO -0.08 -0.05 -0.18 -0.76 0.98 0.00 0.00 173.24 173.14 1ic4 s LEU 21 N 0.23 2.52 0.22 2.42 1.43 0.11 -4.89 118.68 120.71 1ic4 s LEU 21 Ca -0.01 -0.32 0.04 0.00 -1.03 0.00 0.00 54.13 52.81 1ic4 s LEU 21 Cb -0.02 -1.49 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 1ic4 s LEU 21 CO -0.01 0.32 0.35 -0.44 0.23 0.00 0.00 176.35 176.80 1ic4 s SER 22 N -0.83 6.33 -0.17 2.29 0.01 -0.52 -0.75 113.70 120.04 1ic4 s SER 22 Ca 0.12 0.13 -0.04 0.00 1.31 0.00 0.00 55.95 57.46 1ic4 s SER 22 Cb -0.10 -1.89 0.09 0.00 0.21 0.00 0.00 66.02 64.32 1ic4 s SER 22 CO 0.01 -0.04 0.27 0.00 0.41 0.00 0.00 173.24 173.89 1ic4 s ARG 24 N 2.42 3.03 -0.04 0.00 3.52 -0.06 -1.71 118.95 126.12 1ic4 s ARG 24 Ca 0.05 -0.42 -0.02 0.00 -0.13 0.00 0.00 55.73 55.21 1ic4 s ARG 24 Cb -0.14 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.42 1ic4 s ARG 24 CO -0.11 0.66 0.09 0.00 -0.81 0.00 0.00 175.30 175.13 1ic4 s ALA 25 N -0.77 3.63 0.39 6.12 0.00 -0.72 -0.91 121.76 129.50 1ic4 s ALA 25 Ca 0.12 -0.81 0.34 0.00 0.00 0.00 0.00 51.96 51.61 1ic4 s ALA 25 Cb -0.11 -1.66 1.71 0.00 0.00 0.00 0.00 23.12 23.05 1ic4 s ALA 25 CO 0.02 0.67 2.13 0.66 0.00 0.00 0.00 175.76 179.25 1ic4 h SER 26 N 4.36 0.00 -5.04 0.00 4.64 0.07 -3.44 113.55 114.14 1ic4 h SER 26 Ca -0.50 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.66 1ic4 h SER 26 Cb 1.19 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.13 1ic4 h SER 26 CO 0.61 0.05 -0.69 -1.58 -0.87 0.00 0.00 176.83 174.35 1ic4 s GLN 27 N -4.02 0.64 0.22 4.77 0.74 -1.26 -4.96 119.66 115.79 1ic4 s GLN 27 Ca -0.02 -1.19 -0.31 0.00 0.05 0.00 0.00 55.36 53.89 1ic4 s GLN 27 Cb 0.12 0.08 -0.11 0.00 1.10 0.00 0.00 33.01 34.20 1ic4 s GLN 27 CO 0.52 -0.08 1.57 0.45 -0.55 0.00 0.00 175.29 177.20 1ic4 s SER 28 N -2.80 6.53 -0.03 6.67 0.15 -1.26 -4.70 113.70 118.26 1ic4 s SER 28 Ca 0.06 2.73 0.05 0.00 0.70 0.00 0.00 55.95 59.49 1ic4 s SER 28 Cb 0.05 -2.61 0.07 0.00 -1.71 0.00 0.00 66.02 61.83 1ic4 s SER 28 CO -0.08 -0.84 0.94 2.30 1.20 0.00 0.00 173.24 176.76 1ic4 n ILE 29 N 3.24 0.57 0.00 6.45 -5.35 0.69 -4.99 119.36 119.98 1ic4 n ILE 29 Ca 0.11 -0.67 0.00 0.00 -0.27 0.00 0.00 62.75 61.93 1ic4 n ILE 29 Cb 0.38 0.42 0.00 0.00 -1.74 0.00 0.00 39.64 38.70 1ic4 n ILE 29 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ic4 n GLY 30 N -0.41 2.52 0.58 3.28 0.00 -1.24 -0.98 105.19 108.94 1ic4 n GLY 30 Ca 0.04 -0.07 0.05 0.00 0.00 0.00 0.00 46.02 46.05 1ic4 n GLY 30 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ic4 n ASN 31 N 9.85 2.72 -3.49 1.61 6.94 -1.26 0.24 115.26 131.87 1ic4 n ASN 31 Ca 0.00 -1.90 -0.40 0.00 -0.02 0.00 0.00 54.58 52.25 1ic4 n ASN 31 Cb 0.00 -0.18 -0.01 0.00 -2.36 0.00 0.00 39.78 37.22 1ic4 n ASN 31 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1ic4 n ASN 32 N 0.50 7.63 -3.88 0.53 3.02 -0.16 -2.92 115.26 119.98 1ic4 n ASN 32 Ca 0.10 -2.94 -0.21 0.00 -0.03 0.00 0.00 54.58 51.50 1ic4 n ASN 32 Cb 0.39 -1.46 -0.17 0.00 -0.61 0.00 0.00 39.78 37.94 1ic4 n ASN 32 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1ic4 s LEU 33 N -0.88 1.23 0.32 3.41 1.98 -1.26 -2.03 118.68 121.46 1ic4 s LEU 33 Ca 0.57 -0.14 0.09 0.00 -2.89 0.00 0.00 54.13 51.76 1ic4 s LEU 33 Cb 0.17 -0.48 -0.06 0.00 0.66 0.00 0.00 46.19 46.48 1ic4 s LEU 33 CO -0.07 -0.07 -0.11 -1.00 -1.89 0.00 0.00 176.35 173.21 1ic4 s HIS 34 N 1.08 2.30 0.01 5.38 3.76 0.18 -0.09 115.29 127.91 1ic4 s HIS 34 Ca -0.08 -0.51 0.03 0.00 -0.15 0.00 0.00 55.06 54.35 1ic4 s HIS 34 Cb -0.14 -1.27 -0.01 0.00 1.11 0.00 0.00 32.58 32.27 1ic4 s HIS 34 CO -0.01 0.55 -0.10 -1.58 -0.85 0.00 0.00 174.74 172.75 1ic4 s TRP 35 N -2.67 0.89 0.10 1.40 0.52 -0.16 -1.60 118.94 117.42 1ic4 s TRP 35 Ca 0.31 -0.24 0.05 0.00 0.02 0.00 0.00 56.10 56.25 1ic4 s TRP 35 Cb 0.01 -0.56 -0.03 0.00 -1.15 0.00 0.00 33.47 31.74 1ic4 s TRP 35 CO 0.15 -0.01 -0.13 0.71 0.02 0.00 0.00 176.95 177.69 1ic4 s TYR 36 N -0.49 1.25 -0.04 -1.98 2.02 0.81 0.71 117.35 119.63 1ic4 s TYR 36 Ca 0.02 -0.54 0.07 0.00 -0.37 0.00 0.00 57.07 56.24 1ic4 s TYR 36 Cb -0.05 -0.68 -0.02 0.00 -0.40 0.00 0.00 41.96 40.81 1ic4 s TYR 36 CO 0.00 0.08 -0.24 -1.14 -1.57 0.00 0.00 175.55 172.68 1ic4 s GLN 37 N -2.33 2.34 -0.18 -0.62 0.74 -0.68 -0.68 119.66 118.26 1ic4 s GLN 37 Ca 0.04 -0.88 -0.05 0.00 0.05 0.00 0.00 55.36 54.51 1ic4 s GLN 37 Cb -0.06 -2.14 0.06 0.00 1.10 0.00 0.00 33.01 31.97 1ic4 s GLN 37 CO 0.02 0.50 0.09 -1.14 -0.55 0.00 0.00 175.29 174.21 1ic4 s GLN 38 N -0.45 0.09 0.68 1.67 0.74 -0.27 0.04 119.66 122.15 1ic4 s GLN 38 Ca 0.05 -0.11 -0.08 0.00 0.05 0.00 0.00 55.36 55.27 1ic4 s GLN 38 Cb -0.11 -1.81 0.03 0.00 1.10 0.00 0.00 33.01 32.22 1ic4 s GLN 38 CO 0.01 -0.68 1.02 0.15 -0.55 0.00 0.00 175.29 175.24 1ic4 s LYS 39 N 2.13 2.57 0.26 1.67 3.01 -1.26 -0.12 119.74 127.99 1ic4 s LYS 39 Ca 0.02 0.06 -0.29 0.00 -1.01 0.00 0.00 55.97 54.74 1ic4 s LYS 39 Cb -0.16 -2.14 -0.09 0.00 -1.01 0.00 0.00 37.83 34.43 1ic4 s LYS 39 CO -0.10 -1.06 1.17 0.45 0.51 0.00 0.00 175.35 176.33 1ic4 s SER 40 N -4.42 7.11 -1.30 2.83 0.15 -1.26 -3.12 113.70 113.69 1ic4 s SER 40 Ca 0.58 2.35 0.00 0.00 0.70 0.00 0.00 55.95 59.57 1ic4 s SER 40 Cb -0.11 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 1ic4 s SER 40 CO 0.47 -0.30 0.00 1.41 1.20 0.00 0.00 173.24 176.02 1ic4 n HIS 41 N 1.55 -0.59 -4.17 3.44 8.25 -1.26 -5.00 115.22 117.44 1ic4 n HIS 41 Ca 0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.36 1ic4 n HIS 41 Cb 0.44 -3.02 -0.10 0.00 1.12 0.00 0.00 29.99 28.43 1ic4 n HIS 41 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1ic4 s GLU 42 N -4.51 0.92 0.42 -0.41 8.01 -1.18 -5.15 118.70 116.79 1ic4 s GLU 42 Ca 0.00 -1.42 -0.23 0.00 0.01 0.00 0.00 54.97 53.33 1ic4 s GLU 42 Cb 0.00 0.01 -0.09 0.00 -4.31 0.00 0.00 34.13 29.74 1ic4 s GLU 42 CO 0.00 -0.16 1.03 -1.12 0.01 0.00 0.00 175.26 175.02 1ic4 s SER 43 N -3.07 6.71 0.56 -0.19 0.01 -1.26 -4.66 113.70 111.80 1ic4 s SER 43 Ca 0.19 1.97 -0.20 0.00 1.31 0.00 0.00 55.95 59.22 1ic4 s SER 43 Cb 0.07 -2.57 -0.06 0.00 0.21 0.00 0.00 66.02 63.67 1ic4 s SER 43 CO -0.00 -0.52 1.11 -2.65 0.41 0.00 0.00 173.24 171.58 1ic4 n PRO 44 N -0.30 1.23 -4.14 12.44 -0.02 -1.26 -4.68 135.00 138.26 1ic4 n PRO 44 Ca 0.06 0.46 -0.28 0.00 -2.02 0.00 0.00 63.50 61.72 1ic4 n PRO 44 Cb 0.51 -2.29 -0.17 0.00 -0.02 0.00 0.00 33.50 31.53 1ic4 n PRO 44 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1ic4 s ARG 45 N -2.71 1.94 -0.05 -0.52 3.52 0.11 -4.95 118.95 116.28 1ic4 s ARG 45 Ca 0.73 -0.43 -0.30 0.00 -0.13 0.00 0.00 55.73 55.60 1ic4 s ARG 45 Cb -0.44 -1.79 -0.06 0.00 -1.56 0.00 0.00 34.95 31.10 1ic4 s ARG 45 CO 0.49 -0.18 1.71 -1.17 -0.81 0.00 0.00 175.30 175.34 1ic4 s LEU 46 N 1.36 4.29 -0.23 -0.88 2.96 -1.26 -1.68 118.68 123.24 1ic4 s LEU 46 Ca 0.00 2.25 -0.16 0.00 -0.22 0.00 0.00 54.13 56.01 1ic4 s LEU 46 Cb -0.14 -3.53 -0.10 0.00 0.50 0.00 0.00 46.19 42.93 1ic4 s LEU 46 CO -0.06 -0.98 -0.32 0.18 -1.32 0.00 0.00 176.35 173.85 1ic4 n LEU 47 N 7.36 1.94 -4.14 -0.68 4.77 0.22 -4.97 117.00 121.49 1ic4 n LEU 47 Ca 0.18 0.35 -0.25 0.00 -0.03 0.00 0.00 56.01 56.26 1ic4 n LEU 47 Cb 0.43 -0.80 -0.16 0.00 -2.33 0.00 0.00 43.42 40.56 1ic4 n LEU 47 CO 0.63 0.18 -0.50 -0.63 -1.33 0.00 0.00 177.39 175.74 1ic4 s ILE 48 N -2.65 1.39 0.07 -0.08 -1.09 -1.14 -4.13 121.20 113.56 1ic4 s ILE 48 Ca -0.33 -0.72 0.09 0.00 -2.23 0.00 0.00 60.65 57.46 1ic4 s ILE 48 Cb 0.10 -1.18 -0.03 0.00 -1.58 0.00 0.00 42.46 39.76 1ic4 s ILE 48 CO 0.46 0.40 -0.23 -1.59 -1.23 0.00 0.00 174.94 172.75 1ic4 s LYS 49 N -0.15 1.79 -1.26 2.79 -2.85 -0.35 -0.99 119.74 118.72 1ic4 s LYS 49 Ca 0.01 -1.14 -0.01 0.00 -1.00 0.00 0.00 55.97 53.83 1ic4 s LYS 49 Cb -0.09 -2.04 0.00 0.00 -2.06 0.00 0.00 37.83 33.64 1ic4 s LYS 49 CO 0.01 0.50 0.92 0.66 0.10 0.00 0.00 175.35 177.54 1ic4 n TYR 50 N 1.38 -2.16 0.00 1.78 4.01 -1.14 -0.06 117.16 120.97 1ic4 n TYR 50 Ca -0.17 0.91 0.00 0.00 -0.16 0.00 0.00 57.90 58.49 1ic4 n TYR 50 Cb 0.52 -4.82 0.00 0.00 -0.31 0.00 0.00 39.34 34.73 1ic4 n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ic4 n ALA 51 N -4.27 0.00 -1.19 -0.72 0.00 0.87 -3.96 120.51 111.24 1ic4 n ALA 51 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1ic4 n ALA 51 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1ic4 n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ic4 n SER 52 N 1.48 0.00 -4.63 0.00 3.41 -1.20 -3.03 113.62 109.65 1ic4 n SER 52 Ca 0.00 -1.02 -0.42 0.00 -0.26 0.00 0.00 58.87 57.17 1ic4 n SER 52 Cb 0.00 -0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1ic4 n SER 52 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1ic4 s GLN 53 N 0.00 4.11 0.59 4.33 -0.21 0.92 -4.70 119.66 124.70 1ic4 s GLN 53 Ca 0.00 0.76 -0.20 0.00 0.02 0.00 0.00 55.36 55.95 1ic4 s GLN 53 Cb 0.00 -3.67 -0.04 0.00 1.00 0.00 0.00 33.01 30.30 1ic4 s GLN 53 CO 0.00 -0.54 1.16 0.43 -2.12 0.00 0.00 175.29 174.22 1ic4 n SER 54 N 6.00 1.67 -4.00 5.90 7.64 -1.26 -1.21 113.62 128.36 1ic4 n SER 54 Ca 0.04 0.87 -0.27 0.00 1.01 0.00 0.00 58.87 60.52 1ic4 n SER 54 Cb 0.48 -1.48 -0.17 0.00 -1.01 0.00 0.00 64.21 62.03 1ic4 n SER 54 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1ic4 s ILE 55 N -1.40 1.24 0.20 0.44 1.01 -1.26 -4.85 121.20 116.59 1ic4 s ILE 55 Ca 0.76 -0.48 -0.31 0.00 0.00 0.00 0.00 60.65 60.62 1ic4 s ILE 55 Cb -0.41 -1.17 -0.16 0.00 0.01 0.00 0.00 42.46 40.72 1ic4 s ILE 55 CO 0.46 0.39 0.94 -0.24 0.00 0.00 0.00 174.94 176.49 1ic4 n SER 56 N 4.36 0.55 0.00 3.58 2.88 -1.26 -2.13 113.62 121.59 1ic4 n SER 56 Ca -0.18 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.51 1ic4 n SER 56 Cb 0.51 -1.15 0.00 0.00 -0.75 0.00 0.00 64.21 62.82 1ic4 n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ic4 n GLY 57 N 1.72 0.90 3.40 0.46 0.00 -1.26 -5.04 105.19 105.38 1ic4 n GLY 57 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1ic4 n GLY 57 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ic4 s ILE 58 N -3.60 2.48 0.29 -0.61 -0.00 -0.91 -5.08 121.20 113.77 1ic4 s ILE 58 Ca 0.00 -1.25 -0.27 0.00 -0.00 0.00 0.00 60.65 59.13 1ic4 s ILE 58 Cb 0.00 -2.00 -0.15 0.00 -0.00 0.00 0.00 42.46 40.32 1ic4 s ILE 58 CO 0.00 0.37 0.77 -2.65 -0.00 0.00 0.00 174.94 173.44 1ic4 n PRO 59 N 1.73 0.79 0.00 0.37 -0.02 -1.26 -4.89 135.00 131.72 1ic4 n PRO 59 Ca -0.17 0.28 0.10 0.00 -2.02 0.00 0.00 63.50 61.69 1ic4 n PRO 59 Cb 0.52 -1.52 0.46 0.00 -0.02 0.00 0.00 33.50 32.94 1ic4 n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ic4 n SER 60 N 1.47 0.00 0.25 2.55 3.41 -1.26 -3.02 113.62 117.02 1ic4 n SER 60 Ca 0.12 0.36 0.17 0.00 -0.26 0.00 0.00 58.87 59.26 1ic4 n SER 60 Cb 0.31 -0.44 0.73 0.00 -0.26 0.00 0.00 64.21 64.55 1ic4 n SER 60 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 1ic4 h ARG 61 N 0.00 0.00 -6.37 4.33 0.11 -1.93 -3.42 114.38 107.10 1ic4 h ARG 61 Ca 0.00 0.00 -0.54 0.00 0.10 0.00 0.00 59.98 59.54 1ic4 h ARG 61 Cb 0.31 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.35 1ic4 h ARG 61 CO 0.00 0.00 0.14 -0.06 0.10 0.00 0.00 179.97 180.15 1ic4 s PHE 62 N -3.67 3.81 0.03 4.08 0.40 -1.17 -1.27 117.98 120.20 1ic4 s PHE 62 Ca 0.01 1.51 -0.20 0.00 -0.60 0.00 0.00 56.93 57.64 1ic4 s PHE 62 Cb 0.10 -2.75 0.04 0.00 0.51 0.00 0.00 43.02 40.91 1ic4 s PHE 62 CO 0.47 0.41 0.45 -1.54 0.70 0.00 0.00 175.22 175.71 1ic4 s SER 63 N -0.63 -0.34 0.17 1.36 1.04 -0.32 -4.99 113.70 109.98 1ic4 s SER 63 Ca 0.36 0.11 0.05 0.00 0.48 0.00 0.00 55.95 56.95 1ic4 s SER 63 Cb -0.21 0.44 -0.05 0.00 0.10 0.00 0.00 66.02 66.30 1ic4 s SER 63 CO 0.24 -0.65 -0.09 -0.83 0.98 0.00 0.00 173.24 172.88 1ic4 s GLY 64 N -1.85 1.21 0.26 7.32 0.00 -1.26 0.21 107.32 113.21 1ic4 s GLY 64 Ca -0.07 -1.57 -0.15 0.00 0.00 0.00 0.00 44.72 42.94 1ic4 s GLY 64 CO -0.00 -1.63 0.55 -1.35 0.00 0.00 0.00 173.10 170.67 1ic4 s SER 65 N -3.22 -0.13 0.00 1.64 1.04 -0.90 -4.25 113.70 107.88 1ic4 s SER 65 Ca 0.20 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.78 1ic4 s SER 65 Cb 0.03 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.78 1ic4 s SER 65 CO 0.03 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.65 1ic4 n GLY 66 N -0.41 1.39 3.59 7.32 0.00 -1.26 -0.98 105.19 114.84 1ic4 n GLY 66 Ca -0.02 -2.25 -0.04 0.00 0.00 0.00 0.00 46.02 43.71 1ic4 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ic4 s SER 67 N 0.00 -0.15 0.00 1.61 1.04 -1.09 -4.90 113.70 110.22 1ic4 s SER 67 Ca 0.00 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.42 1ic4 s SER 67 Cb 0.00 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.28 1ic4 s SER 67 CO 0.00 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.57 1ic4 n GLY 68 N -0.11 1.54 0.00 7.32 0.00 0.14 -3.21 105.19 110.87 1ic4 n GLY 68 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1ic4 n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ic4 n THR 69 N 0.00 0.00 -3.98 2.61 -1.04 -1.26 -0.22 114.28 110.38 1ic4 n THR 69 Ca 0.00 -0.09 -0.34 0.00 -2.04 0.00 0.00 64.05 61.58 1ic4 n THR 69 Cb 0.00 0.53 -0.15 0.00 -1.82 0.00 0.00 70.33 68.90 1ic4 n THR 69 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1ic4 s ASP 70 N -0.69 4.18 0.07 8.00 1.01 -1.20 -1.76 116.67 126.28 1ic4 s ASP 70 Ca 0.00 -0.83 0.07 0.00 0.71 0.00 0.00 52.55 52.49 1ic4 s ASP 70 Cb 0.00 -1.64 -0.03 0.00 1.01 0.00 0.00 42.92 42.26 1ic4 s ASP 70 CO 0.00 -0.11 -0.18 -0.36 0.21 0.00 0.00 175.17 174.73 1ic4 s PHE 71 N 1.32 1.56 0.04 4.23 0.40 -0.69 -2.65 117.98 122.19 1ic4 s PHE 71 Ca 0.01 -0.40 0.01 0.00 -0.60 0.00 0.00 56.93 55.95 1ic4 s PHE 71 Cb -0.16 -0.90 -0.03 0.00 0.51 0.00 0.00 43.02 42.45 1ic4 s PHE 71 CO -0.05 0.11 -0.05 0.95 0.70 0.00 0.00 175.22 176.87 1ic4 s THR 72 N -1.00 0.36 -0.11 0.64 -4.23 -0.15 -1.70 115.64 109.44 1ic4 s THR 72 Ca 0.04 -1.14 0.03 0.00 -1.18 0.00 0.00 61.69 59.44 1ic4 s THR 72 Cb -0.09 -0.63 0.01 0.00 1.34 0.00 0.00 72.50 73.12 1ic4 s THR 72 CO 0.02 -0.52 -0.21 -0.22 -0.54 0.00 0.00 174.62 173.16 1ic4 s LEU 73 N -1.76 2.00 0.05 4.79 2.96 0.07 -2.12 118.68 124.67 1ic4 s LEU 73 Ca -0.09 -0.53 0.07 0.00 -0.22 0.00 0.00 54.13 53.36 1ic4 s LEU 73 Cb -0.07 -1.32 -0.03 0.00 0.50 0.00 0.00 46.19 45.26 1ic4 s LEU 73 CO -0.01 0.11 -0.17 -0.44 -1.32 0.00 0.00 176.35 174.51 1ic4 s SER 74 N 0.58 3.86 -0.20 3.68 0.01 0.13 0.05 113.70 121.81 1ic4 s SER 74 Ca -0.14 -0.42 0.01 0.00 1.31 0.00 0.00 55.95 56.71 1ic4 s SER 74 Cb -0.17 -0.63 0.05 0.00 0.21 0.00 0.00 66.02 65.48 1ic4 s SER 74 CO 0.04 0.25 -0.09 -0.63 0.41 0.00 0.00 173.24 173.22 1ic4 s ILE 75 N -0.95 1.60 0.05 1.44 1.01 -0.30 -1.18 121.20 122.87 1ic4 s ILE 75 Ca 0.15 -1.03 -0.32 0.00 0.00 0.00 0.00 60.65 59.45 1ic4 s ILE 75 Cb -0.11 -1.72 -0.17 0.00 0.01 0.00 0.00 42.46 40.47 1ic4 s ILE 75 CO 0.06 0.12 1.46 0.78 0.00 0.00 0.00 174.94 177.36 1ic4 h ASN 76 N 7.97 -0.96 -2.96 3.58 4.21 -1.48 -1.72 115.58 124.23 1ic4 h ASN 76 Ca -0.26 0.03 -0.53 0.00 1.21 0.00 0.00 56.30 56.75 1ic4 h ASN 76 Cb 1.09 0.25 -0.40 0.00 -1.12 0.00 0.00 38.32 38.14 1ic4 h ASN 76 CO 0.46 -0.68 -0.77 -0.44 -1.29 0.00 0.00 177.43 174.71 1ic4 s SER 77 N -3.69 3.44 0.19 5.81 0.01 -1.26 -3.87 113.70 114.34 1ic4 s SER 77 Ca -0.17 -1.24 -0.32 0.00 1.31 0.00 0.00 55.95 55.53 1ic4 s SER 77 Cb 0.02 -0.49 -0.15 0.00 0.21 0.00 0.00 66.02 65.61 1ic4 s SER 77 CO 0.50 -0.41 1.19 0.55 0.41 0.00 0.00 173.24 175.48 1ic4 n VAL 78 N 5.14 1.01 -4.05 3.43 3.14 0.33 -4.57 118.33 122.75 1ic4 n VAL 78 Ca -0.05 -0.25 -0.24 0.00 -2.96 0.00 0.00 64.34 60.83 1ic4 n VAL 78 Cb 0.43 -0.96 -0.04 0.00 -1.06 0.00 0.00 33.84 32.21 1ic4 n VAL 78 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 1ic4 s GLU 79 N -0.50 3.09 0.54 1.45 2.56 -1.26 -1.27 118.70 123.32 1ic4 s GLU 79 Ca 0.71 -0.87 0.33 0.00 0.00 0.00 0.00 54.97 55.14 1ic4 s GLU 79 Cb -0.80 -2.71 1.45 0.00 2.00 0.00 0.00 34.13 34.07 1ic4 s GLU 79 CO 0.52 0.45 2.02 1.79 -0.56 0.00 0.00 175.26 179.49 1ic4 h THR 80 N 1.64 0.18 0.00 -1.70 1.35 -2.00 -2.08 112.91 110.31 1ic4 h THR 80 Ca -0.49 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 1ic4 h THR 80 Cb 1.22 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 69.10 1ic4 h THR 80 CO 0.63 0.06 0.00 -1.84 -0.25 0.00 0.00 175.52 174.11 1ic4 n GLU 81 N -3.22 0.07 0.16 4.72 0.28 -1.26 -3.13 120.64 118.26 1ic4 n GLU 81 Ca -0.00 0.38 0.12 0.00 -0.16 0.00 0.00 57.16 57.49 1ic4 n GLU 81 Cb 0.28 -1.65 0.10 0.00 1.43 0.00 0.00 31.44 31.60 1ic4 n GLU 81 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1ic4 h ASP 82 N 0.00 0.00 -3.09 -1.84 3.32 -1.77 -3.47 116.42 109.56 1ic4 h ASP 82 Ca 0.00 -0.01 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 1ic4 h ASP 82 Cb 0.21 0.00 0.07 0.00 0.22 0.00 0.00 39.33 39.83 1ic4 h ASP 82 CO 0.00 0.00 0.89 -0.36 -1.72 0.00 0.00 179.24 178.05 1ic4 s PHE 83 N -3.28 2.89 -5.00 4.55 0.08 -1.18 -4.82 117.98 111.23 1ic4 s PHE 83 Ca 0.04 0.69 0.00 0.00 0.12 0.00 0.00 56.93 57.78 1ic4 s PHE 83 Cb 0.07 -4.01 0.00 0.00 -0.57 0.00 0.00 43.02 38.51 1ic4 s PHE 83 CO 0.72 -3.56 0.00 0.41 -0.10 0.00 0.00 175.22 172.69 1ic4 n GLY 84 N 2.89 -0.19 3.82 4.36 0.00 -0.77 -4.79 105.19 110.51 1ic4 n GLY 84 Ca 0.11 -1.11 -0.32 0.00 0.00 0.00 0.00 46.02 44.70 1ic4 n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ic4 s MET 85 N -2.00 3.11 -0.10 1.61 -1.94 0.83 -0.23 119.30 120.58 1ic4 s MET 85 Ca 0.00 -0.53 0.03 0.00 -1.71 0.00 0.00 55.69 53.48 1ic4 s MET 85 Cb 0.00 -2.87 0.01 0.00 2.01 0.00 0.00 34.83 33.97 1ic4 s MET 85 CO 0.00 0.61 -0.20 0.71 -0.01 0.00 0.00 175.02 176.14 1ic4 s TYR 86 N -1.34 2.23 -0.00 -0.03 2.02 -0.66 -1.12 117.35 118.45 1ic4 s TYR 86 Ca 0.28 -0.96 0.03 0.00 -0.37 0.00 0.00 57.07 56.05 1ic4 s TYR 86 Cb -0.12 -1.54 -0.01 0.00 -0.40 0.00 0.00 41.96 39.89 1ic4 s TYR 86 CO 0.20 -0.43 -0.10 -0.06 -1.57 0.00 0.00 175.55 173.59 1ic4 s PHE 87 N 0.60 0.90 0.13 2.71 0.08 0.14 -1.34 117.98 121.20 1ic4 s PHE 87 Ca -0.14 -0.19 0.04 0.00 0.12 0.00 0.00 56.93 56.76 1ic4 s PHE 87 Cb -0.17 -0.58 -0.04 0.00 -0.57 0.00 0.00 43.02 41.67 1ic4 s PHE 87 CO 0.04 -0.01 0.12 0.00 -0.10 0.00 0.00 175.22 175.27 1ic4 s GLN 89 N -2.82 0.55 0.07 0.00 -2.07 -0.63 -0.92 119.66 113.83 1ic4 s GLN 89 Ca 0.31 0.11 0.04 0.00 -1.82 0.00 0.00 55.36 53.99 1ic4 s GLN 89 Cb -0.11 0.25 -0.04 0.00 -1.09 0.00 0.00 33.01 32.02 1ic4 s GLN 89 CO 0.23 -0.12 0.01 1.14 -1.32 0.00 0.00 175.29 175.23 1ic4 s GLN 90 N -0.65 2.65 -0.00 9.60 1.03 -0.52 -0.65 119.66 131.12 1ic4 s GLN 90 Ca -0.07 -0.76 0.00 0.00 0.04 0.00 0.00 55.36 54.57 1ic4 s GLN 90 Cb -0.04 -2.60 0.01 0.00 0.03 0.00 0.00 33.01 30.41 1ic4 s GLN 90 CO 0.03 0.56 0.84 -1.13 -2.54 0.00 0.00 175.29 173.05 1ic4 n SER 91 N 0.75 1.36 -0.31 12.60 3.41 -0.86 -3.48 113.62 127.09 1ic4 n SER 91 Ca -0.11 -1.70 -0.04 0.00 -0.26 0.00 0.00 58.87 56.75 1ic4 n SER 91 Cb 0.52 -0.01 0.08 0.00 -0.26 0.00 0.00 64.21 64.54 1ic4 n SER 91 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1ic4 h ASN 92 N 0.00 0.99 -4.69 4.04 -1.24 -1.86 -3.46 115.58 109.36 1ic4 h ASN 92 Ca 0.00 -0.06 -0.24 0.00 0.71 0.00 0.00 56.30 56.71 1ic4 h ASN 92 Cb 0.67 -0.25 -0.18 0.00 0.73 0.00 0.00 38.32 39.30 1ic4 h ASN 92 CO 0.00 0.76 -0.71 -0.44 -1.29 0.00 0.00 177.43 175.74 1ic4 s SER 93 N -6.04 1.00 -0.66 1.15 0.01 -1.26 -5.13 113.70 102.76 1ic4 s SER 93 Ca -0.13 -0.80 -0.17 0.00 1.31 0.00 0.00 55.95 56.16 1ic4 s SER 93 Cb 0.16 0.07 0.13 0.00 0.21 0.00 0.00 66.02 66.59 1ic4 s SER 93 CO 0.80 -0.35 0.72 0.86 0.41 0.00 0.00 173.24 175.68 1ic4 s TRP 94 N -2.61 3.20 -0.16 2.43 -0.11 -1.26 -3.16 118.94 117.27 1ic4 s TRP 94 Ca 0.02 -1.26 -0.10 0.00 1.22 0.00 0.00 56.10 55.97 1ic4 s TRP 94 Cb -0.02 -3.97 -0.05 0.00 -1.50 0.00 0.00 33.47 27.94 1ic4 s TRP 94 CO -0.03 -1.21 0.18 -1.25 -4.62 0.00 0.00 176.95 170.03 1ic4 s PRO 95 N 2.01 3.97 0.47 5.86 0.04 -1.26 -5.05 135.00 141.03 1ic4 s PRO 95 Ca 0.13 -0.10 -0.24 0.00 0.04 0.00 0.00 61.00 60.83 1ic4 s PRO 95 Cb -0.21 -3.34 -0.07 0.00 0.04 0.00 0.00 34.50 30.92 1ic4 s PRO 95 CO 0.01 0.45 1.34 0.71 0.04 0.00 0.00 177.00 179.55 1ic4 s TYR 96 N -0.10 2.56 0.08 0.56 2.02 -1.19 -4.81 117.35 116.46 1ic4 s TYR 96 Ca 0.13 1.37 0.03 0.00 -0.37 0.00 0.00 57.07 58.22 1ic4 s TYR 96 Cb -0.12 -3.76 -0.03 0.00 -0.40 0.00 0.00 41.96 37.65 1ic4 s TYR 96 CO 0.02 -2.53 -0.09 0.95 -1.57 0.00 0.00 175.55 172.33 1ic4 s THR 97 N -1.28 0.76 0.19 -0.71 -4.23 -1.23 -5.02 115.64 104.12 1ic4 s THR 97 Ca 0.63 -1.53 0.09 0.00 -1.18 0.00 0.00 61.69 59.70 1ic4 s THR 97 Cb -0.39 -1.20 -0.04 0.00 1.34 0.00 0.00 72.50 72.21 1ic4 s THR 97 CO 0.49 -0.57 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.56 1ic4 s PHE 98 N -2.36 2.64 0.72 3.99 0.08 -1.26 -1.44 117.98 120.35 1ic4 s PHE 98 Ca 0.02 -0.22 -0.06 0.00 0.12 0.00 0.00 56.93 56.79 1ic4 s PHE 98 Cb -0.03 -1.28 0.09 0.00 -0.57 0.00 0.00 43.02 41.23 1ic4 s PHE 98 CO -0.01 0.52 1.02 0.20 -0.10 0.00 0.00 175.22 176.86 1ic4 s GLY 99 N -2.91 1.73 0.33 4.36 0.00 -0.10 -4.55 107.32 106.18 1ic4 s GLY 99 Ca 0.26 -1.16 0.25 0.00 0.00 0.00 0.00 44.72 44.06 1ic4 s GLY 99 CO 0.16 -0.69 1.76 -1.33 0.00 0.00 0.00 173.10 172.99 1ic4 h GLY 100 N -0.65 0.00 0.00 0.20 0.00 -1.91 -3.44 103.07 97.27 1ic4 h GLY 100 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1ic4 h GLY 100 CO 0.53 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.68 1ic4 n GLY 101 N -0.42 1.04 3.25 4.60 0.00 -1.26 -5.04 105.19 107.37 1ic4 n GLY 101 Ca 0.01 -1.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.11 1ic4 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ic4 s THR 102 N -2.34 1.87 -0.17 2.61 2.01 -0.45 -4.67 115.64 114.50 1ic4 s THR 102 Ca 0.00 -0.99 -0.13 0.00 0.31 0.00 0.00 61.69 60.88 1ic4 s THR 102 Cb 0.00 -1.56 -0.05 0.00 0.01 0.00 0.00 72.50 70.90 1ic4 s THR 102 CO 0.00 0.53 0.27 -0.75 -0.69 0.00 0.00 174.62 173.98 1ic4 s LYS 103 N -0.37 4.24 -0.26 4.92 2.20 -0.33 -1.65 119.74 128.49 1ic4 s LYS 103 Ca 0.04 0.04 -0.08 0.00 -0.36 0.00 0.00 55.97 55.61 1ic4 s LYS 103 Cb -0.11 -3.44 -0.03 0.00 -1.51 0.00 0.00 37.83 32.74 1ic4 s LYS 103 CO 0.01 0.22 0.10 -1.17 -0.36 0.00 0.00 175.35 174.15 1ic4 s LEU 104 N 0.54 3.58 0.04 5.43 2.96 0.68 -0.49 118.68 131.43 1ic4 s LEU 104 Ca 0.15 -0.16 0.03 0.00 -0.22 0.00 0.00 54.13 53.93 1ic4 s LEU 104 Cb -0.13 -1.97 -0.02 0.00 0.50 0.00 0.00 46.19 44.57 1ic4 s LEU 104 CO 0.03 -0.04 -0.10 -1.61 -1.32 0.00 0.00 176.35 173.31 1ic4 s GLU 105 N 1.65 0.65 0.18 1.98 2.02 -0.35 -1.84 118.70 122.99 1ic4 s GLU 105 Ca 0.07 -0.75 -0.32 0.00 0.02 0.00 0.00 54.97 53.99 1ic4 s GLU 105 Cb -0.15 -0.53 -0.11 0.00 0.10 0.00 0.00 34.13 33.44 1ic4 s GLU 105 CO 0.05 0.12 1.60 -1.50 0.02 0.00 0.00 175.26 175.55 1ic4 s ILE 106 N -1.14 2.47 -2.02 -1.63 2.07 -1.26 -0.57 121.20 119.12 1ic4 s ILE 106 Ca -0.05 0.34 0.32 0.00 -1.41 0.00 0.00 60.65 59.85 1ic4 s ILE 106 Cb -0.09 -3.22 0.90 0.00 0.13 0.00 0.00 42.46 40.18 1ic4 s ILE 106 CO 0.01 0.03 2.21 1.17 -1.91 0.00 0.00 174.94 176.45