#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l4i s VAL 2 N 0.00 4.87 0.05 1.61 -7.23 -1.26 -2.78 120.40 115.66 1l4i s VAL 2 Ca 0.00 0.50 -0.06 0.00 -1.81 0.00 0.00 61.98 60.61 1l4i s VAL 2 Cb 0.00 -3.67 -0.01 0.00 0.56 0.00 0.00 36.38 33.26 1l4i s VAL 2 CO 0.00 -0.26 0.12 0.00 -0.31 0.00 0.00 175.10 174.65 1l4i s ALA 3 N -2.04 -0.08 0.14 1.32 0.00 -0.30 -4.99 121.76 115.81 1l4i s ALA 3 Ca 0.49 -0.59 0.07 0.00 0.00 0.00 0.00 51.96 51.92 1l4i s ALA 3 Cb -0.11 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.28 1l4i s ALA 3 CO 0.25 -0.37 -0.05 -0.51 0.00 0.00 0.00 175.76 175.08 1l4i s LEU 4 N -2.36 3.20 0.00 0.00 1.43 -1.26 -1.33 118.68 118.36 1l4i s LEU 4 Ca -0.02 -0.38 0.20 0.00 -1.03 0.00 0.00 54.13 52.90 1l4i s LEU 4 Cb 0.01 -1.92 0.54 0.00 0.03 0.00 0.00 46.19 44.85 1l4i s LEU 4 CO -0.06 0.13 1.44 0.61 0.23 0.00 0.00 176.35 178.70 1l4i n GLY 5 N 0.28 1.18 3.45 -3.19 0.00 0.14 -4.94 105.19 102.10 1l4i n GLY 5 Ca -0.11 -0.57 -0.15 0.00 0.00 0.00 0.00 46.02 45.19 1l4i n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l4i s ALA 6 N -1.51 -1.60 -0.36 4.61 0.00 -1.26 -4.86 121.76 116.77 1l4i s ALA 6 Ca 0.35 0.81 0.17 0.00 0.00 0.00 0.00 51.96 53.30 1l4i s ALA 6 Cb 0.19 0.45 -0.23 0.00 0.00 0.00 0.00 23.12 23.53 1l4i s ALA 6 CO 0.27 -0.56 0.53 0.25 0.00 0.00 0.00 175.76 176.25 1l4i n THR 7 N 0.27 0.00 -3.70 0.00 -2.24 -1.26 -5.00 114.28 102.34 1l4i n THR 7 Ca -0.18 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.23 1l4i n THR 7 Cb 0.61 0.50 -0.05 0.00 -2.10 0.00 0.00 70.33 69.29 1l4i n THR 7 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1l4i s ARG 8 N -2.94 1.08 -0.06 -0.78 1.70 -1.26 -3.81 118.95 112.88 1l4i s ARG 8 Ca -0.01 -0.80 0.01 0.00 -0.47 0.00 0.00 55.73 54.46 1l4i s ARG 8 Cb 0.12 0.45 0.02 0.00 -0.57 0.00 0.00 34.95 34.97 1l4i s ARG 8 CO 0.71 -0.42 -0.06 0.08 -1.08 0.00 0.00 175.30 174.53 1l4i s VAL 9 N -3.83 0.70 -0.18 4.99 1.01 -0.25 -4.95 120.40 117.89 1l4i s VAL 9 Ca 0.05 -0.19 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 1l4i s VAL 9 Cb 0.02 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 1l4i s VAL 9 CO -0.10 0.27 0.10 -0.63 0.00 0.00 0.00 175.10 174.75 1l4i s ILE 10 N 1.05 5.17 -0.35 2.22 1.09 -1.26 -1.27 121.20 127.85 1l4i s ILE 10 Ca -0.09 0.10 -0.04 0.00 -1.10 0.00 0.00 60.65 59.52 1l4i s ILE 10 Cb -0.14 -3.33 0.06 0.00 -1.06 0.00 0.00 42.46 37.99 1l4i s ILE 10 CO -0.00 0.48 0.10 -0.47 -0.10 0.00 0.00 174.94 174.94 1l4i s TYR 11 N 0.13 3.33 -0.04 3.97 5.04 0.10 -4.93 117.35 124.95 1l4i s TYR 11 Ca 0.07 -1.80 -0.27 0.00 -2.44 0.00 0.00 57.07 52.63 1l4i s TYR 11 Cb -0.12 -2.47 -0.03 0.00 0.35 0.00 0.00 41.96 39.70 1l4i s TYR 11 CO -0.00 -0.82 0.85 -1.25 -1.34 0.00 0.00 175.55 172.99 1l4i s PRO 12 N 1.29 4.49 0.35 4.97 0.05 -1.26 0.04 135.00 144.93 1l4i s PRO 12 Ca -0.01 1.16 -0.28 0.00 0.05 0.00 0.00 61.00 61.92 1l4i s PRO 12 Cb -0.21 -3.46 -0.12 0.00 0.05 0.00 0.00 34.50 30.76 1l4i s PRO 12 CO -0.00 -0.01 1.34 -1.91 0.05 0.00 0.00 177.00 176.47 1l4i n GLU 13 N 3.91 2.26 0.00 4.56 2.13 -0.13 -2.19 120.64 131.18 1l4i n GLU 13 Ca 0.03 0.79 0.00 0.00 0.66 0.00 0.00 57.16 58.64 1l4i n GLU 13 Cb 0.51 -2.41 0.00 0.00 0.27 0.00 0.00 31.44 29.81 1l4i n GLU 13 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1l4i n GLY 14 N 0.76 2.00 3.75 8.31 0.00 -1.26 -4.71 105.19 114.04 1l4i n GLY 14 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1l4i n GLY 14 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1l4i s GLN 15 N -0.06 4.58 0.37 1.61 -1.52 -0.93 -4.93 119.66 118.78 1l4i s GLN 15 Ca 0.00 1.82 0.20 0.00 -1.95 0.00 0.00 55.36 55.42 1l4i s GLN 15 Cb 0.00 -3.22 0.46 0.00 -0.22 0.00 0.00 33.01 30.03 1l4i s GLN 15 CO 0.00 0.09 1.63 -0.22 -0.25 0.00 0.00 175.29 176.53 1l4i h LYS 16 N 4.48 0.00 -2.31 2.91 3.64 -1.95 -3.43 116.57 119.91 1l4i h LYS 16 Ca -0.46 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.05 1l4i h LYS 16 Cb 1.21 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.90 1l4i h LYS 16 CO 0.70 0.31 0.49 1.14 -2.27 0.00 0.00 179.45 179.82 1l4i s GLN 17 N -3.28 0.93 0.05 1.90 -2.07 -1.26 -4.35 119.66 111.58 1l4i s GLN 17 Ca 0.03 -0.40 0.01 0.00 -1.82 0.00 0.00 55.36 53.18 1l4i s GLN 17 Cb 0.08 0.39 -0.03 0.00 -1.09 0.00 0.00 33.01 32.36 1l4i s GLN 17 CO 0.69 -0.41 -0.05 0.08 -1.32 0.00 0.00 175.29 174.28 1l4i s VAL 18 N -3.17 0.38 0.24 3.63 1.01 -0.40 -4.97 120.40 117.12 1l4i s VAL 18 Ca 0.07 -1.36 0.11 0.00 0.00 0.00 0.00 61.98 60.80 1l4i s VAL 18 Cb -0.01 -0.92 -0.05 0.00 0.00 0.00 0.00 36.38 35.41 1l4i s VAL 18 CO -0.06 -0.64 -0.16 -1.10 0.00 0.00 0.00 175.10 173.13 1l4i s GLN 19 N -2.49 1.79 -0.04 2.72 -0.21 -1.26 -0.64 119.66 119.53 1l4i s GLN 19 Ca -0.04 -1.58 -0.02 0.00 0.02 0.00 0.00 55.36 53.75 1l4i s GLN 19 Cb -0.03 -1.91 0.03 0.00 1.00 0.00 0.00 33.01 32.10 1l4i s GLN 19 CO -0.03 0.37 0.05 -1.17 -2.12 0.00 0.00 175.29 172.38 1l4i s LEU 20 N -3.22 0.32 0.13 2.90 2.96 -0.17 -4.95 118.68 116.64 1l4i s LEU 20 Ca 0.27 0.05 -0.27 0.00 -0.22 0.00 0.00 54.13 53.96 1l4i s LEU 20 Cb -0.07 -0.18 -0.07 0.00 0.50 0.00 0.00 46.19 46.38 1l4i s LEU 20 CO 0.14 -0.23 0.84 0.00 -1.32 0.00 0.00 176.35 175.79 1l4i s ALA 21 N 2.01 3.36 -0.13 5.97 0.00 -1.26 -0.33 121.76 131.37 1l4i s ALA 21 Ca 0.03 0.42 0.02 0.00 0.00 0.00 0.00 51.96 52.43 1l4i s ALA 21 Cb -0.12 -3.08 0.02 0.00 0.00 0.00 0.00 23.12 19.94 1l4i s ALA 21 CO -0.03 0.14 -0.18 0.08 0.00 0.00 0.00 175.76 175.77 1l4i s VAL 22 N -0.54 1.76 0.14 0.00 1.01 -0.43 -0.69 120.40 121.65 1l4i s VAL 22 Ca 0.40 -0.79 0.07 0.00 0.00 0.00 0.00 61.98 61.66 1l4i s VAL 22 Cb -0.23 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 1l4i s VAL 22 CO 0.27 0.49 -0.16 0.42 0.00 0.00 0.00 175.10 176.12 1l4i s THR 23 N 1.05 1.54 -0.08 3.92 -4.23 -0.44 -0.74 115.64 116.66 1l4i s THR 23 Ca -0.03 -1.77 0.00 0.00 -1.18 0.00 0.00 61.69 58.71 1l4i s THR 23 Cb -0.14 -1.64 0.02 0.00 1.34 0.00 0.00 72.50 72.08 1l4i s THR 23 CO -0.05 -0.35 -0.07 0.21 -0.54 0.00 0.00 174.62 173.83 1l4i s ASN 24 N -2.48 1.68 0.01 3.99 2.47 -0.36 -1.15 114.94 119.10 1l4i s ASN 24 Ca 0.11 -0.22 0.23 0.00 0.42 0.00 0.00 52.86 53.40 1l4i s ASN 24 Cb -0.06 -0.67 0.18 0.00 -1.45 0.00 0.00 41.25 39.25 1l4i s ASN 24 CO 0.04 -0.08 1.17 -0.46 -3.72 0.00 0.00 177.10 174.06 1l4i n ASN 25 N 4.48 0.68 -4.53 -4.21 6.94 -1.12 -1.42 115.26 116.09 1l4i n ASN 25 Ca -0.17 -0.49 -0.42 0.00 -0.02 0.00 0.00 54.58 53.49 1l4i n ASN 25 Cb 0.51 0.60 -0.08 0.00 -2.36 0.00 0.00 39.78 38.44 1l4i n ASN 25 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1l4i s ASP 26 N -3.18 6.24 0.50 0.53 -1.08 -1.26 -4.64 116.67 113.78 1l4i s ASP 26 Ca 0.09 -0.29 0.18 0.00 -0.52 0.00 0.00 52.55 52.00 1l4i s ASP 26 Cb 0.16 -2.24 1.23 0.00 -1.46 0.00 0.00 42.92 40.62 1l4i s ASP 26 CO 0.77 -0.49 2.07 -0.78 0.52 0.00 0.00 175.17 177.27 1l4i h ASP 27 N 8.56 0.10 1.10 -0.34 1.82 -1.89 -2.53 116.42 123.25 1l4i h ASP 27 Ca -0.28 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.36 1l4i h ASP 27 Cb 1.12 -0.02 0.00 0.00 0.68 0.00 0.00 39.33 41.11 1l4i h ASP 27 CO 0.76 0.07 -0.55 0.11 -1.61 0.00 0.00 179.24 178.02 1l4i h LYS 28 N 0.11 0.00 -6.19 0.28 1.79 -1.93 -3.39 116.57 107.24 1l4i h LYS 28 Ca 0.13 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 58.09 1l4i h LYS 28 Cb 0.38 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.98 1l4i h LYS 28 CO -0.02 0.00 -0.51 -1.12 -1.08 0.00 0.00 179.45 176.72 1l4i s SER 29 N -4.73 5.68 0.01 0.86 0.01 -0.95 -4.95 113.70 109.64 1l4i s SER 29 Ca 0.05 -0.16 0.02 0.00 1.31 0.00 0.00 55.95 57.18 1l4i s SER 29 Cb 0.11 -1.50 -0.01 0.00 0.21 0.00 0.00 66.02 64.83 1l4i s SER 29 CO 0.71 -0.02 -0.08 -0.44 0.41 0.00 0.00 173.24 173.82 1l4i s SER 30 N -3.73 0.92 0.03 2.44 0.01 -1.26 -0.84 113.70 111.28 1l4i s SER 30 Ca 0.33 -0.26 -0.00 0.00 1.31 0.00 0.00 55.95 57.33 1l4i s SER 30 Cb -0.08 -0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.06 1l4i s SER 30 CO 0.25 0.02 -0.03 -0.31 0.41 0.00 0.00 173.24 173.58 1l4i s TYR 31 N -0.51 0.33 -0.13 2.43 1.51 0.09 -1.14 117.35 119.94 1l4i s TYR 31 Ca -0.00 -0.67 -0.05 0.00 -1.01 0.00 0.00 57.07 55.34 1l4i s TYR 31 Cb -0.05 -0.25 -0.04 0.00 -0.11 0.00 0.00 41.96 41.52 1l4i s TYR 31 CO 0.00 -0.24 0.04 -0.51 -1.11 0.00 0.00 175.55 173.74 1l4i s LEU 32 N -1.85 3.79 -0.16 -1.29 1.43 0.10 -0.43 118.68 120.27 1l4i s LEU 32 Ca -0.10 0.17 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 1l4i s LEU 32 Cb -0.05 -1.91 0.02 0.00 0.03 0.00 0.00 46.19 44.28 1l4i s LEU 32 CO -0.03 0.31 -0.16 -0.63 0.23 0.00 0.00 176.35 176.07 1l4i s ILE 33 N -0.44 1.69 -0.03 -0.59 -1.09 0.19 -0.14 121.20 120.80 1l4i s ILE 33 Ca 0.09 -0.71 0.06 0.00 -2.23 0.00 0.00 60.65 57.86 1l4i s ILE 33 Cb -0.12 -1.57 -0.02 0.00 -1.58 0.00 0.00 42.46 39.17 1l4i s ILE 33 CO 0.02 0.48 -0.21 -1.58 -1.23 0.00 0.00 174.94 172.42 1l4i s GLN 34 N 1.42 2.28 0.04 2.79 0.74 -0.26 -1.17 119.66 125.51 1l4i s GLN 34 Ca 0.05 -0.84 -0.04 0.00 0.05 0.00 0.00 55.36 54.59 1l4i s GLN 34 Cb -0.13 -2.18 -0.02 0.00 1.10 0.00 0.00 33.01 31.78 1l4i s GLN 34 CO -0.11 0.58 0.05 -1.12 -0.55 0.00 0.00 175.29 174.14 1l4i s SER 35 N -0.64 0.27 0.29 6.67 0.01 -0.29 -0.86 113.70 119.15 1l4i s SER 35 Ca 0.10 -0.66 -0.20 0.00 1.31 0.00 0.00 55.95 56.50 1l4i s SER 35 Cb -0.10 0.21 0.03 0.00 0.21 0.00 0.00 66.02 66.36 1l4i s SER 35 CO -0.00 -0.51 0.75 -1.66 0.41 0.00 0.00 173.24 172.22 1l4i s TRP 36 N -2.86 -0.13 -0.08 2.43 -2.14 -0.39 -4.74 118.94 111.04 1l4i s TRP 36 Ca -0.03 -0.36 0.02 0.00 2.66 0.00 0.00 56.10 58.39 1l4i s TRP 36 Cb 0.00 0.73 -0.02 0.00 -3.10 0.00 0.00 33.47 31.08 1l4i s TRP 36 CO -0.06 -1.28 -0.14 0.42 -2.66 0.00 0.00 176.95 173.23 1l4i s ILE 37 N -3.58 3.02 0.17 0.66 -1.09 -1.26 0.10 121.20 119.21 1l4i s ILE 37 Ca 0.12 -0.71 0.11 0.00 -2.23 0.00 0.00 60.65 57.94 1l4i s ILE 37 Cb -0.06 -2.21 -0.04 0.00 -1.58 0.00 0.00 42.46 38.57 1l4i s ILE 37 CO 0.08 0.56 -0.23 -1.61 -1.23 0.00 0.00 174.94 172.51 1l4i s GLU 38 N -0.29 1.57 0.85 2.79 2.02 -0.14 -1.36 118.70 124.13 1l4i s GLU 38 Ca 0.02 -1.43 -0.13 0.00 0.02 0.00 0.00 54.97 53.45 1l4i s GLU 38 Cb -0.13 -1.91 0.19 0.00 0.10 0.00 0.00 34.13 32.38 1l4i s GLU 38 CO 0.03 0.42 1.16 0.27 0.02 0.00 0.00 175.26 177.16 1l4i n ASN 39 N 0.43 0.20 0.08 -0.19 0.23 0.29 -0.63 115.26 115.67 1l4i n ASN 39 Ca -0.14 -1.49 0.10 0.00 -0.53 0.00 0.00 54.58 52.53 1l4i n ASN 39 Cb 0.55 -0.88 0.43 0.00 -2.08 0.00 0.00 39.78 37.80 1l4i n ASN 39 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1l4i n ALA 40 N -3.68 1.67 1.61 -2.53 0.00 -1.18 -2.29 120.51 114.10 1l4i n ALA 40 Ca -0.19 0.04 0.15 0.00 0.00 0.00 0.00 53.44 53.43 1l4i n ALA 40 Cb 0.52 -1.33 0.65 0.00 0.00 0.00 0.00 19.45 19.28 1l4i n ALA 40 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1l4i n GLU 41 N -1.97 1.24 -0.36 0.00 4.71 -1.26 -4.90 120.64 118.09 1l4i n GLU 41 Ca 0.03 -0.52 0.00 0.00 -0.01 0.00 0.00 57.16 56.65 1l4i n GLU 41 Cb 0.21 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.15 1l4i n GLU 41 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1l4i n GLY 42 N 1.16 0.72 3.92 0.62 0.00 -0.97 -5.07 105.19 105.57 1l4i n GLY 42 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1l4i n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l4i s LYS 43 N -0.64 3.50 0.35 1.61 -0.14 -1.26 -4.84 119.74 118.32 1l4i s LYS 43 Ca 0.00 -0.39 -0.29 0.00 -1.36 0.00 0.00 55.97 53.94 1l4i s LYS 43 Cb 0.00 -2.92 -0.11 0.00 -1.68 0.00 0.00 37.83 33.12 1l4i s LYS 43 CO 0.00 0.49 1.52 0.15 -0.76 0.00 0.00 175.35 176.75 1l4i s LYS 44 N -3.00 4.11 0.01 1.68 1.02 -1.26 -0.54 119.74 121.76 1l4i s LYS 44 Ca 0.37 2.58 0.02 0.00 0.02 0.00 0.00 55.97 58.96 1l4i s LYS 44 Cb -0.12 -2.98 -0.01 0.00 -0.52 0.00 0.00 37.83 34.20 1l4i s LYS 44 CO 0.28 -0.56 -0.07 0.34 -0.92 0.00 0.00 175.35 174.42 1l4i s ASP 45 N 0.03 0.75 0.00 2.83 2.15 -0.47 -4.76 116.67 117.21 1l4i s ASP 45 Ca 0.56 -0.26 0.24 0.00 0.43 0.00 0.00 52.55 53.51 1l4i s ASP 45 Cb -0.47 -0.04 0.36 0.00 -0.30 0.00 0.00 42.92 42.48 1l4i s ASP 45 CO 0.59 -0.02 1.36 0.00 -0.17 0.00 0.00 175.17 176.93 1l4i n ALA 46 N 2.42 2.45 0.28 3.66 0.00 -1.26 -4.40 120.51 123.65 1l4i n ALA 46 Ca -0.16 -0.80 0.12 0.00 0.00 0.00 0.00 53.44 52.60 1l4i n ALA 46 Cb 0.57 -0.87 0.59 0.00 0.00 0.00 0.00 19.45 19.74 1l4i n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l4i h ARG 47 N 4.38 0.00 -4.93 0.00 3.08 -1.94 -3.41 114.38 111.56 1l4i h ARG 47 Ca 0.00 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.54 1l4i h ARG 47 Cb 0.95 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 30.68 1l4i h ARG 47 CO 0.00 0.00 -0.82 -0.06 -1.07 0.00 0.00 179.97 178.02 1l4i s PHE 48 N -3.49 1.44 -0.03 3.04 0.40 -1.26 -1.22 117.98 116.86 1l4i s PHE 48 Ca 0.00 -0.43 -0.01 0.00 -0.60 0.00 0.00 56.93 55.90 1l4i s PHE 48 Cb 0.08 -1.00 -0.04 0.00 0.51 0.00 0.00 43.02 42.57 1l4i s PHE 48 CO 0.31 -0.17 0.05 0.08 0.70 0.00 0.00 175.22 176.19 1l4i s VAL 49 N 0.22 4.55 -0.07 -0.44 1.01 -0.14 -4.84 120.40 120.69 1l4i s VAL 49 Ca -0.06 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.56 1l4i s VAL 49 Cb -0.12 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1l4i s VAL 49 CO 0.02 0.42 -0.18 -0.51 0.00 0.00 0.00 175.10 174.85 1l4i s ILE 50 N -1.10 1.55 -0.01 2.22 2.07 -1.26 -0.35 121.20 124.33 1l4i s ILE 50 Ca 0.20 -0.73 -0.04 0.00 -1.41 0.00 0.00 60.65 58.67 1l4i s ILE 50 Cb -0.12 -1.36 -0.00 0.00 0.13 0.00 0.00 42.46 41.11 1l4i s ILE 50 CO 0.10 0.45 0.07 0.28 -1.91 0.00 0.00 174.94 173.93 1l4i s THR 51 N 0.41 0.06 0.34 4.00 -1.32 -0.25 -3.81 115.64 115.07 1l4i s THR 51 Ca -0.14 -0.46 -0.26 0.00 -1.21 0.00 0.00 61.69 59.62 1l4i s THR 51 Cb -0.16 -0.26 -0.09 0.00 -1.51 0.00 0.00 72.50 70.48 1l4i s THR 51 CO 0.05 -0.25 1.03 -2.16 -2.21 0.00 0.00 174.62 171.08 1l4i s PRO 52 N -0.80 4.42 0.52 7.08 0.04 -1.26 -0.98 135.00 144.01 1l4i s PRO 52 Ca -0.09 1.54 0.30 0.00 0.04 0.00 0.00 61.00 62.80 1l4i s PRO 52 Cb -0.05 -2.81 1.18 0.00 0.04 0.00 0.00 34.50 32.86 1l4i s PRO 52 CO 0.00 0.09 1.92 -1.00 0.04 0.00 0.00 177.00 178.05 1l4i h PRO 53 N 3.09 0.00 -2.59 0.56 0.13 -1.85 -3.42 132.00 127.92 1l4i h PRO 53 Ca -0.47 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.55 1l4i h PRO 53 Cb 1.21 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.07 1l4i h PRO 53 CO 0.64 0.06 -0.31 -1.17 -0.23 0.00 0.00 178.00 176.99 1l4i s LEU 54 N -6.35 -0.28 0.10 1.56 2.96 -1.25 -1.13 118.68 114.27 1l4i s LEU 54 Ca 0.01 0.94 -0.10 0.00 -0.22 0.00 0.00 54.13 54.76 1l4i s LEU 54 Cb 0.09 1.38 0.01 0.00 0.50 0.00 0.00 46.19 48.16 1l4i s LEU 54 CO 0.58 -0.21 0.23 0.72 -1.32 0.00 0.00 176.35 176.35 1l4i s PHE 55 N 1.77 0.09 0.03 5.38 -0.12 -0.31 -4.97 117.98 119.84 1l4i s PHE 55 Ca -0.07 -0.49 -0.05 0.00 -0.05 0.00 0.00 56.93 56.26 1l4i s PHE 55 Cb -0.09 0.00 -0.05 0.00 -0.63 0.00 0.00 43.02 42.25 1l4i s PHE 55 CO -0.13 -0.58 0.26 -1.54 -0.05 0.00 0.00 175.22 173.19 1l4i s SER 56 N -2.85 6.46 -0.28 1.98 1.04 -1.26 -0.63 113.70 118.15 1l4i s SER 56 Ca 0.05 0.50 0.01 0.00 0.48 0.00 0.00 55.95 56.99 1l4i s SER 56 Cb 0.04 -2.06 0.08 0.00 0.10 0.00 0.00 66.02 64.18 1l4i s SER 56 CO -0.11 0.22 0.01 -0.32 0.98 0.00 0.00 173.24 174.02 1l4i s MET 57 N -1.99 1.36 -0.41 4.02 1.75 0.43 -4.97 119.30 119.49 1l4i s MET 57 Ca 0.30 -1.25 -0.08 0.00 -1.25 0.00 0.00 55.69 53.41 1l4i s MET 57 Cb -0.13 -2.61 0.08 0.00 2.84 0.00 0.00 34.83 35.01 1l4i s MET 57 CO 0.19 -0.78 0.24 -0.65 -0.65 0.00 0.00 175.02 173.36 1l4i s GLN 58 N 1.32 2.53 0.85 4.11 -0.21 -1.26 -0.73 119.66 126.26 1l4i s GLN 58 Ca 0.02 -1.49 0.00 0.00 0.02 0.00 0.00 55.36 53.92 1l4i s GLN 58 Cb -0.18 -3.72 0.00 0.00 1.00 0.00 0.00 33.01 30.10 1l4i s GLN 58 CO -0.11 -0.94 0.00 0.41 -2.12 0.00 0.00 175.29 172.52 1l4i n GLY 59 N 4.86 -1.91 3.63 3.09 0.00 -0.02 -4.82 105.19 110.02 1l4i n GLY 59 Ca -0.09 -1.59 -0.44 0.00 0.00 0.00 0.00 46.02 43.89 1l4i n GLY 59 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l4i n LYS 60 N 0.00 2.35 -3.49 1.61 5.02 -1.23 -4.64 118.16 117.77 1l4i n LYS 60 Ca 0.00 0.79 -0.11 0.00 -2.02 0.00 0.00 58.31 56.97 1l4i n LYS 60 Cb 0.00 -3.00 -0.03 0.00 -0.02 0.00 0.00 35.03 31.98 1l4i n LYS 60 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1l4i s LYS 61 N 5.17 0.97 -0.11 1.97 -0.14 -0.51 -4.97 119.74 122.12 1l4i s LYS 61 Ca 0.95 -0.21 0.03 0.00 -1.36 0.00 0.00 55.97 55.39 1l4i s LYS 61 Cb -0.47 0.45 0.00 0.00 -1.68 0.00 0.00 37.83 36.14 1l4i s LYS 61 CO 0.42 -0.39 -0.23 -2.00 -0.76 0.00 0.00 175.35 172.39 1l4i s GLU 62 N -2.75 2.96 0.21 1.68 2.12 -1.26 -1.23 118.70 120.44 1l4i s GLU 62 Ca 0.00 -0.84 0.08 0.00 0.36 0.00 0.00 54.97 54.57 1l4i s GLU 62 Cb -0.01 -2.30 -0.05 0.00 0.26 0.00 0.00 34.13 32.04 1l4i s GLU 62 CO -0.06 0.10 -0.15 -0.80 -0.54 0.00 0.00 175.26 173.82 1l4i s ASN 63 N 0.53 2.65 -0.07 -1.70 0.01 0.08 -5.01 114.94 111.44 1l4i s ASN 63 Ca -0.14 -1.02 0.05 0.00 -0.71 0.00 0.00 52.86 51.04 1l4i s ASN 63 Cb -0.17 -0.15 -0.01 0.00 0.41 0.00 0.00 41.25 41.33 1l4i s ASN 63 CO 0.05 -0.16 -0.24 -0.89 -1.51 0.00 0.00 177.10 174.35 1l4i s THR 64 N -2.94 2.01 -0.10 1.60 2.01 -1.26 -1.31 115.64 115.65 1l4i s THR 64 Ca 0.23 -1.03 -0.12 0.00 0.31 0.00 0.00 61.69 61.08 1l4i s THR 64 Cb -0.01 -1.71 -0.05 0.00 0.01 0.00 0.00 72.50 70.74 1l4i s THR 64 CO 0.08 0.56 0.29 -0.76 -0.69 0.00 0.00 174.62 174.09 1l4i s LEU 65 N -0.02 4.35 -0.14 4.42 1.43 0.55 -4.68 118.68 124.60 1l4i s LEU 65 Ca -0.08 0.64 -0.06 0.00 -1.03 0.00 0.00 54.13 53.60 1l4i s LEU 65 Cb -0.15 -2.35 -0.04 0.00 0.03 0.00 0.00 46.19 43.68 1l4i s LEU 65 CO 0.05 0.25 0.08 -0.13 0.23 0.00 0.00 176.35 176.83 1l4i s ARG 66 N -0.41 3.60 -0.20 1.70 0.52 -0.15 -1.00 118.95 122.99 1l4i s ARG 66 Ca 0.18 -0.27 -0.02 0.00 -0.52 0.00 0.00 55.73 55.09 1l4i s ARG 66 Cb -0.14 -3.13 -0.00 0.00 0.52 0.00 0.00 34.95 32.20 1l4i s ARG 66 CO 0.07 0.54 -0.09 0.42 0.02 0.00 0.00 175.30 176.26 1l4i s ILE 67 N -0.38 2.98 -0.08 1.52 1.01 0.19 -1.09 121.20 125.34 1l4i s ILE 67 Ca 0.10 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 60.15 1l4i s ILE 67 Cb -0.12 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 40.01 1l4i s ILE 67 CO 0.02 0.46 -0.18 -0.63 0.00 0.00 0.00 174.94 174.61 1l4i s ILE 68 N 1.37 2.69 -0.17 2.92 1.09 0.53 -1.27 121.20 128.36 1l4i s ILE 68 Ca 0.05 -0.83 -0.29 0.00 -1.10 0.00 0.00 60.65 58.48 1l4i s ILE 68 Cb -0.14 -2.06 -0.02 0.00 -1.06 0.00 0.00 42.46 39.18 1l4i s ILE 68 CO -0.06 0.56 1.35 -0.62 -0.10 0.00 0.00 174.94 176.07 1l4i s ASP 69 N -0.16 6.84 -0.10 3.58 2.15 -1.26 -0.97 116.67 126.75 1l4i s ASP 69 Ca -0.02 1.72 0.15 0.00 0.43 0.00 0.00 52.55 54.83 1l4i s ASP 69 Cb -0.14 -2.54 0.23 0.00 -0.30 0.00 0.00 42.92 40.17 1l4i s ASP 69 CO 0.04 -0.85 1.12 0.00 -0.17 0.00 0.00 175.17 175.30 1l4i n ALA 70 N 6.91 2.20 -0.11 3.66 0.00 -0.36 -4.85 120.51 127.96 1l4i n ALA 70 Ca 0.15 -2.27 0.12 0.00 0.00 0.00 0.00 53.44 51.44 1l4i n ALA 70 Cb 0.45 -0.41 0.48 0.00 0.00 0.00 0.00 19.45 19.97 1l4i n ALA 70 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1l4i h THR 71 N 1.55 0.88 -5.96 0.00 1.35 -1.49 -3.44 112.91 105.81 1l4i h THR 71 Ca 0.00 -0.15 -0.35 0.00 -0.55 0.00 0.00 66.41 65.35 1l4i h THR 71 Cb 1.09 0.39 0.11 0.00 -1.73 0.00 0.00 68.15 68.01 1l4i h THR 71 CO 0.00 0.08 -0.86 -0.46 -0.25 0.00 0.00 175.52 174.04 1l4i n ASN 72 N -4.47 -5.89 -0.26 5.36 2.04 -1.26 -3.21 115.26 107.57 1l4i n ASN 72 Ca 0.11 -0.86 -0.03 0.00 -0.44 0.00 0.00 54.58 53.36 1l4i n ASN 72 Cb 0.39 -3.98 -0.01 0.00 -2.53 0.00 0.00 39.78 33.66 1l4i n ASN 72 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1l4i n GLY 73 N -1.56 0.26 2.05 4.83 0.00 -1.26 -4.88 105.19 104.63 1l4i n GLY 73 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1l4i n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l4i n GLN 74 N 0.22 2.12 -4.88 1.61 10.64 -1.20 -4.92 117.38 120.98 1l4i n GLN 74 Ca -0.03 -2.50 -0.27 0.00 -1.83 0.00 0.00 57.00 52.37 1l4i n GLN 74 Cb 0.38 -1.98 -0.15 0.00 -0.86 0.00 0.00 30.24 27.63 1l4i n GLN 74 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 1l4i s MET 75 N -2.80 1.63 0.25 2.61 1.00 -1.26 -5.10 119.30 115.64 1l4i s MET 75 Ca 0.48 -0.90 -0.29 0.00 0.00 0.00 0.00 55.69 54.98 1l4i s MET 75 Cb 0.39 -1.68 -0.15 0.00 0.00 0.00 0.00 34.83 33.40 1l4i s MET 75 CO 0.06 0.45 0.99 -2.30 0.00 0.00 0.00 175.02 174.22 1l4i n PRO 76 N 2.14 1.17 -0.01 2.03 -0.01 -1.26 -4.86 135.00 134.20 1l4i n PRO 76 Ca -0.16 0.41 0.09 0.00 -0.01 0.00 0.00 63.50 63.82 1l4i n PRO 76 Cb 0.53 -1.77 0.08 0.00 -0.01 0.00 0.00 33.50 32.32 1l4i n PRO 76 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 175.50 175.88 1l4i n GLU 77 N 0.99 1.44 -0.19 -0.52 1.02 -1.26 -4.42 120.64 117.70 1l4i n GLU 77 Ca 0.12 -1.56 0.05 0.00 -0.02 0.00 0.00 57.16 55.75 1l4i n GLU 77 Cb 0.30 -1.33 0.15 0.00 -0.02 0.00 0.00 31.44 30.53 1l4i n GLU 77 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1l4i n ASP 78 N 0.96 2.92 -3.73 1.62 5.75 -1.26 -4.82 116.55 117.99 1l4i n ASP 78 Ca 0.10 -2.30 -0.05 0.00 -0.01 0.00 0.00 54.79 52.53 1l4i n ASP 78 Cb 0.43 -0.27 -0.02 0.00 -1.03 0.00 0.00 41.12 40.24 1l4i n ASP 78 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1l4i s ARG 79 N -1.54 1.28 0.69 0.11 1.70 -1.26 -4.72 118.95 115.21 1l4i s ARG 79 Ca 0.23 -0.68 -0.11 0.00 -0.47 0.00 0.00 55.73 54.71 1l4i s ARG 79 Cb 0.16 0.46 0.01 0.00 -0.57 0.00 0.00 34.95 35.00 1l4i s ARG 79 CO 0.10 -0.58 1.06 -1.21 -1.08 0.00 0.00 175.30 173.59 1l4i s GLU 80 N -3.42 2.97 0.13 3.89 2.02 0.55 -4.56 118.70 120.28 1l4i s GLU 80 Ca 0.11 0.91 0.11 0.00 0.02 0.00 0.00 54.97 56.11 1l4i s GLU 80 Cb -0.02 -2.00 -0.04 0.00 0.10 0.00 0.00 34.13 32.17 1l4i s GLU 80 CO 0.01 -1.06 -0.26 -1.12 0.02 0.00 0.00 175.26 172.84 1l4i s SER 81 N -3.85 3.36 -0.19 -0.19 0.01 -0.84 -4.94 113.70 107.06 1l4i s SER 81 Ca 0.58 -0.74 -0.04 0.00 1.31 0.00 0.00 55.95 57.06 1l4i s SER 81 Cb -0.14 -0.24 -0.02 0.00 0.21 0.00 0.00 66.02 65.83 1l4i s SER 81 CO 0.55 0.18 -0.02 -0.22 0.41 0.00 0.00 173.24 174.13 1l4i s LEU 82 N -2.07 3.16 0.39 2.44 2.96 -1.26 -0.63 118.68 123.67 1l4i s LEU 82 Ca 0.14 -0.23 0.04 0.00 -0.22 0.00 0.00 54.13 53.87 1l4i s LEU 82 Cb -0.10 -1.79 -0.05 0.00 0.50 0.00 0.00 46.19 44.75 1l4i s LEU 82 CO 0.06 0.08 0.05 -0.36 -1.32 0.00 0.00 176.35 174.86 1l4i s PHE 83 N 0.91 2.06 -0.04 5.38 0.40 0.18 -3.10 117.98 123.76 1l4i s PHE 83 Ca 0.00 -0.94 0.02 0.00 -0.60 0.00 0.00 56.93 55.41 1l4i s PHE 83 Cb -0.14 -1.43 0.01 0.00 0.51 0.00 0.00 43.02 41.96 1l4i s PHE 83 CO 0.01 0.10 -0.10 -1.58 0.70 0.00 0.00 175.22 174.35 1l4i s TRP 84 N -3.08 1.11 -0.24 0.36 0.52 0.20 -1.26 118.94 116.55 1l4i s TRP 84 Ca 0.29 -0.34 -0.11 0.00 0.02 0.00 0.00 56.10 55.97 1l4i s TRP 84 Cb 0.07 -0.83 -0.05 0.00 -1.15 0.00 0.00 33.47 31.51 1l4i s TRP 84 CO 0.14 -0.18 0.17 0.08 0.02 0.00 0.00 176.95 177.18 1l4i s VAL 85 N 0.47 5.35 -0.15 4.03 1.01 0.36 -0.97 120.40 130.50 1l4i s VAL 85 Ca -0.08 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.04 1l4i s VAL 85 Cb -0.12 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 1l4i s VAL 85 CO 0.02 0.33 -0.02 0.20 0.00 0.00 0.00 175.10 175.63 1l4i s ASN 86 N 1.15 4.96 -0.03 3.32 -0.87 0.11 -0.69 114.94 122.89 1l4i s ASN 86 Ca 0.08 -0.07 0.03 0.00 -1.57 0.00 0.00 52.86 51.33 1l4i s ASN 86 Cb -0.14 -1.75 0.00 0.00 -0.02 0.00 0.00 41.25 39.34 1l4i s ASN 86 CO 0.05 0.20 -0.11 -0.69 -2.57 0.00 0.00 177.10 173.98 1l4i s VAL 87 N 0.19 0.96 -0.04 1.60 1.01 -0.71 -1.26 120.40 122.15 1l4i s VAL 87 Ca -0.01 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1l4i s VAL 87 Cb -0.13 -0.85 0.02 0.00 0.00 0.00 0.00 36.38 35.41 1l4i s VAL 87 CO 0.02 0.29 -0.05 -0.75 0.00 0.00 0.00 175.10 174.62 1l4i s LYS 88 N 0.21 0.84 -0.16 2.72 2.20 -0.04 -1.50 119.74 124.00 1l4i s LYS 88 Ca -0.04 -0.14 -0.04 0.00 -0.36 0.00 0.00 55.97 55.39 1l4i s LYS 88 Cb -0.10 -0.82 -0.03 0.00 -1.51 0.00 0.00 37.83 35.37 1l4i s LYS 88 CO 0.01 -0.04 -0.03 0.00 -0.36 0.00 0.00 175.35 174.92 1l4i s ALA 89 N 0.75 3.00 -0.29 3.13 0.00 0.21 -1.10 121.76 127.45 1l4i s ALA 89 Ca -0.10 -0.84 -0.02 0.00 0.00 0.00 0.00 51.96 50.99 1l4i s ALA 89 Cb -0.13 -1.58 0.04 0.00 0.00 0.00 0.00 23.12 21.45 1l4i s ALA 89 CO 0.00 0.17 -0.00 0.42 0.00 0.00 0.00 175.76 176.35 1l4i s ILE 90 N 0.44 3.09 0.40 0.00 1.01 0.81 -0.57 121.20 126.37 1l4i s ILE 90 Ca -0.04 -1.21 -0.26 0.00 0.00 0.00 0.00 60.65 59.14 1l4i s ILE 90 Cb -0.14 -2.70 -0.09 0.00 0.01 0.00 0.00 42.46 39.54 1l4i s ILE 90 CO 0.03 -0.01 1.32 -2.16 0.00 0.00 0.00 174.94 174.12 1l4i s PRO 91 N 1.30 3.99 -0.07 2.79 0.04 -1.26 -0.72 135.00 141.06 1l4i s PRO 91 Ca -0.03 2.20 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 1l4i s PRO 91 Cb -0.19 -2.79 -0.03 0.00 0.04 0.00 0.00 34.50 31.53 1l4i s PRO 91 CO -0.01 -0.49 1.30 0.00 0.04 0.00 0.00 177.00 177.84 1l4i s ALA 92 N -1.24 3.57 0.00 8.56 0.00 -0.29 -4.88 121.76 127.48 1l4i s ALA 92 Ca 0.56 0.67 0.00 0.00 0.00 0.00 0.00 51.96 53.19 1l4i s ALA 92 Cb -0.39 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.15 1l4i s ALA 92 CO 0.50 -0.96 0.00 -1.33 0.00 0.00 0.00 175.76 173.97 1l4i n MET 93 N 5.78 0.00 0.00 0.00 2.81 -1.26 -4.87 117.12 119.58 1l4i n MET 93 Ca 0.13 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 1l4i n MET 93 Cb 0.45 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.96 1l4i n MET 93 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1l4i n GLN 104 N 0.00 0.00 -0.75 0.03 -0.00 -1.26 -5.30 117.38 110.10 1l4i n GLN 104 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.00 56.98 1l4i n GLN 104 Cb 0.00 -1.15 0.23 0.00 -0.00 0.00 0.00 30.24 29.32 1l4i n GLN 104 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1l4i n PHE 105 N -0.57 1.41 -2.04 2.61 3.01 -1.26 -5.04 117.46 115.58 1l4i n PHE 105 Ca 0.00 -1.33 -0.32 0.00 1.01 0.00 0.00 57.45 56.81 1l4i n PHE 105 Cb 0.00 -0.50 0.01 0.00 -0.01 0.00 0.00 39.48 38.97 1l4i n PHE 105 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1l4i s ALA 106 N -3.08 2.81 -0.21 4.37 0.00 -1.26 -4.62 121.76 119.77 1l4i s ALA 106 Ca 0.46 0.29 -0.02 0.00 0.00 0.00 0.00 51.96 52.70 1l4i s ALA 106 Cb 0.40 -3.20 0.01 0.00 0.00 0.00 0.00 23.12 20.33 1l4i s ALA 106 CO 0.06 -0.75 -0.11 0.42 0.00 0.00 0.00 175.76 175.37 1l4i s ILE 107 N -2.60 2.76 -0.08 0.00 1.01 0.26 -4.93 121.20 117.62 1l4i s ILE 107 Ca 0.62 -0.74 0.03 0.00 0.00 0.00 0.00 60.65 60.56 1l4i s ILE 107 Cb -0.14 -2.24 0.01 0.00 0.01 0.00 0.00 42.46 40.10 1l4i s ILE 107 CO 0.39 0.45 -0.17 -0.69 0.00 0.00 0.00 174.94 174.92 1l4i s VAL 108 N 1.38 1.51 0.09 2.92 1.01 -1.26 0.64 120.40 126.70 1l4i s VAL 108 Ca 0.05 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.35 1l4i s VAL 108 Cb -0.14 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1l4i s VAL 108 CO -0.08 0.44 -0.08 -0.44 0.00 0.00 0.00 175.10 174.94 1l4i s SER 109 N 0.51 1.25 -0.06 3.32 0.01 -0.56 -5.02 113.70 113.14 1l4i s SER 109 Ca -0.16 -0.84 0.02 0.00 1.31 0.00 0.00 55.95 56.28 1l4i s SER 109 Cb -0.17 0.04 0.01 0.00 0.21 0.00 0.00 66.02 66.12 1l4i s SER 109 CO 0.06 -0.33 -0.12 -0.13 0.41 0.00 0.00 173.24 173.13 1l4i s ARG 110 N -2.98 1.62 0.08 12.44 0.52 -1.26 -1.74 118.95 127.62 1l4i s ARG 110 Ca 0.05 -0.40 0.05 0.00 -0.52 0.00 0.00 55.73 54.92 1l4i s ARG 110 Cb -0.01 -1.36 -0.03 0.00 0.52 0.00 0.00 34.95 34.07 1l4i s ARG 110 CO -0.02 0.04 -0.14 0.96 0.02 0.00 0.00 175.30 176.16 1l4i s ILE 111 N 0.62 1.15 0.27 1.52 -4.36 0.14 -4.93 121.20 115.61 1l4i s ILE 111 Ca -0.13 -1.36 -0.29 0.00 -0.26 0.00 0.00 60.65 58.60 1l4i s ILE 111 Cb -0.15 -1.14 -0.10 0.00 1.25 0.00 0.00 42.46 42.33 1l4i s ILE 111 CO 0.03 -0.25 1.27 -0.54 0.24 0.00 0.00 174.94 175.69 1l4i s LYS 112 N -1.86 4.42 -0.26 0.37 1.02 -1.25 -0.49 119.74 121.69 1l4i s LYS 112 Ca -0.01 2.07 0.03 0.00 0.02 0.00 0.00 55.97 58.08 1l4i s LYS 112 Cb -0.09 -3.14 0.06 0.00 -0.52 0.00 0.00 37.83 34.13 1l4i s LYS 112 CO 0.02 -0.14 -0.10 -1.17 -0.92 0.00 0.00 175.35 173.05 1l4i s LEU 113 N -1.04 3.39 -0.36 3.17 2.96 -0.38 -1.09 118.68 125.32 1l4i s LEU 113 Ca 0.51 -1.39 -0.12 0.00 -0.22 0.00 0.00 54.13 52.90 1l4i s LEU 113 Cb -0.37 -1.52 0.00 0.00 0.50 0.00 0.00 46.19 44.81 1l4i s LEU 113 CO 0.45 -0.20 0.23 -0.76 -1.32 0.00 0.00 176.35 174.75 1l4i s LEU 114 N 1.12 4.64 -0.17 -0.68 1.43 -0.40 -0.65 118.68 123.97 1l4i s LEU 114 Ca -0.08 -0.69 -0.21 0.00 -1.03 0.00 0.00 54.13 52.12 1l4i s LEU 114 Cb -0.20 -2.09 -0.03 0.00 0.03 0.00 0.00 46.19 43.90 1l4i s LEU 114 CO -0.05 -0.31 0.63 -0.47 0.23 0.00 0.00 176.35 176.38 1l4i s TYR 115 N 1.65 3.41 -0.28 0.29 5.04 0.20 0.02 117.35 127.70 1l4i s TYR 115 Ca 0.05 0.98 0.03 0.00 -2.44 0.00 0.00 57.07 55.68 1l4i s TYR 115 Cb -0.18 -2.79 0.07 0.00 0.35 0.00 0.00 41.96 39.41 1l4i s TYR 115 CO 0.09 -0.11 -0.07 0.50 -1.34 0.00 0.00 175.55 174.62 1l4i s ARG 116 N 1.66 2.15 0.58 4.97 3.52 0.11 -1.98 118.95 129.95 1l4i s ARG 116 Ca 0.30 -1.43 -0.20 0.00 -0.13 0.00 0.00 55.73 54.27 1l4i s ARG 116 Cb -0.16 -2.98 -0.04 0.00 -1.56 0.00 0.00 34.95 30.21 1l4i s ARG 116 CO 0.11 -0.64 1.29 -2.14 -0.81 0.00 0.00 175.30 173.11 1l4i s PRO 117 N 1.09 2.99 0.52 5.12 0.02 -1.26 -0.96 135.00 142.52 1l4i s PRO 117 Ca -0.05 2.05 -0.21 0.00 0.02 0.00 0.00 61.00 62.81 1l4i s PRO 117 Cb -0.20 -2.08 -0.06 0.00 0.02 0.00 0.00 34.50 32.18 1l4i s PRO 117 CO -0.05 -1.25 1.16 -0.65 -0.33 0.00 0.00 177.00 175.88 1l4i s GLN 118 N -3.12 3.46 -0.00 5.54 -0.21 -1.26 -4.26 119.66 119.81 1l4i s GLN 118 Ca 0.75 1.72 0.00 0.00 0.02 0.00 0.00 55.36 57.85 1l4i s GLN 118 Cb -0.36 -2.16 0.00 0.00 1.00 0.00 0.00 33.01 31.49 1l4i s GLN 118 CO 0.41 -0.78 0.00 0.41 -2.12 0.00 0.00 175.29 173.21 1l4i n GLY 119 N 0.32 0.38 3.76 3.09 0.00 -1.26 -5.02 105.19 106.46 1l4i n GLY 119 Ca 0.10 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 1l4i n GLY 119 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l4i s LEU 120 N -0.00 4.47 0.13 0.99 1.43 -1.26 -4.95 118.68 119.49 1l4i s LEU 120 Ca 0.00 2.47 -0.07 0.00 -1.03 0.00 0.00 54.13 55.50 1l4i s LEU 120 Cb 0.00 -3.63 -0.07 0.00 0.03 0.00 0.00 46.19 42.51 1l4i s LEU 120 CO 0.00 -0.39 1.34 0.58 0.23 0.00 0.00 176.35 178.11 1l4i h VAL 121 N 3.22 1.33 -3.34 -1.59 2.07 -1.98 -3.42 116.25 112.54 1l4i h VAL 121 Ca -0.47 -2.14 -0.57 0.00 0.82 0.00 0.00 66.70 64.34 1l4i h VAL 121 Cb 1.22 2.14 -0.07 0.00 -1.52 0.00 0.00 31.29 33.05 1l4i h VAL 121 CO 0.68 0.66 -0.07 -0.63 0.02 0.00 0.00 177.57 178.23 1l4i s ILE 122 N -3.58 5.15 0.52 4.57 1.01 -1.26 -5.06 121.20 122.55 1l4i s ILE 122 Ca -0.08 1.10 -0.18 0.00 0.00 0.00 0.00 60.65 61.49 1l4i s ILE 122 Cb 0.09 -3.88 -0.07 0.00 0.01 0.00 0.00 42.46 38.61 1l4i s ILE 122 CO 0.88 0.31 1.02 -2.16 0.00 0.00 0.00 174.94 174.98 1l4i s PRO 123 N 0.66 3.75 0.26 2.79 0.04 -1.26 -4.94 135.00 136.30 1l4i s PRO 123 Ca 0.29 1.14 -0.01 0.00 0.04 0.00 0.00 61.00 62.46 1l4i s PRO 123 Cb -0.16 -2.10 0.54 0.00 0.04 0.00 0.00 34.50 32.82 1l4i s PRO 123 CO 0.13 -0.45 1.74 -1.35 0.04 0.00 0.00 177.00 177.10 1l4i h PRO 124 N 1.01 0.50 0.00 0.56 0.11 -1.97 -0.98 132.00 131.23 1l4i h PRO 124 Ca -0.48 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1l4i h PRO 124 Cb 1.20 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1l4i h PRO 124 CO 0.60 0.33 -0.07 0.93 -0.21 0.00 0.00 178.00 179.58 1l4i h GLU 125 N 0.52 0.00 0.00 1.05 3.07 -2.05 -2.80 114.58 114.37 1l4i h GLU 125 Ca 0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 1l4i h GLU 125 Cb 0.72 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.63 1l4i h GLU 125 CO -0.41 0.07 -0.51 1.04 -1.40 0.00 0.00 179.01 177.81 1l4i n GLN 126 N -3.22 0.00 -0.06 2.33 6.02 -0.38 -4.47 117.38 117.60 1l4i n GLN 126 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.92 1l4i n GLN 126 Cb 0.32 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.07 1l4i n GLN 126 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1l4i h ALA 127 N 3.00 0.19 -0.95 -1.58 0.00 -1.41 -3.12 119.26 115.39 1l4i h ALA 127 Ca 0.00 0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.09 1l4i h ALA 127 Cb 0.50 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.39 1l4i h ALA 127 CO 0.00 -0.45 0.61 -1.35 0.00 0.00 0.00 179.25 178.06 1l4i h PRO 128 N 0.03 0.96 0.00 0.00 0.11 -1.78 -1.06 132.00 130.26 1l4i h PRO 128 Ca 0.12 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1l4i h PRO 128 Cb 0.18 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.07 1l4i h PRO 128 CO -0.24 0.64 0.00 0.41 -0.21 0.00 0.00 178.00 178.59 1l4i n GLY 129 N -1.38 -1.03 0.68 -0.55 0.00 -1.18 -3.05 105.19 98.68 1l4i n GLY 129 Ca 0.16 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.19 1l4i n GLY 129 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l4i n LYS 130 N -1.25 1.92 -1.72 1.61 5.02 -0.40 -4.65 118.16 118.68 1l4i n LYS 130 Ca 0.12 -1.36 -0.43 0.00 -2.02 0.00 0.00 58.31 54.63 1l4i n LYS 130 Cb 0.18 -1.46 -0.02 0.00 -0.02 0.00 0.00 35.03 33.71 1l4i n LYS 130 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1l4i n LEU 131 N 0.62 4.01 -4.27 -0.35 4.77 -1.17 -4.62 117.00 116.00 1l4i n LEU 131 Ca 0.17 1.14 -0.32 0.00 -0.03 0.00 0.00 56.01 56.97 1l4i n LEU 131 Cb 0.43 -1.55 -0.16 0.00 -2.33 0.00 0.00 43.42 39.81 1l4i n LEU 131 CO 0.15 -0.00 -0.52 -1.61 -1.33 0.00 0.00 177.39 174.07 1l4i s GLU 132 N -0.31 3.15 -0.10 3.23 2.02 -0.02 -2.57 118.70 124.11 1l4i s GLU 132 Ca 0.66 -0.82 -0.01 0.00 0.02 0.00 0.00 54.97 54.83 1l4i s GLU 132 Cb -0.54 -2.41 -0.03 0.00 0.10 0.00 0.00 34.13 31.26 1l4i s GLU 132 CO 0.47 0.19 -0.07 -0.06 0.02 0.00 0.00 175.26 175.81 1l4i s PHE 133 N 0.35 2.94 -0.06 1.61 0.40 0.42 0.11 117.98 123.75 1l4i s PHE 133 Ca -0.16 -0.18 0.02 0.00 -0.60 0.00 0.00 56.93 56.00 1l4i s PHE 133 Cb -0.17 -1.81 0.02 0.00 0.51 0.00 0.00 43.02 41.57 1l4i s PHE 133 CO 0.08 0.13 -0.09 0.99 0.70 0.00 0.00 175.22 177.03 1l4i s THR 134 N -0.26 0.88 -0.42 0.64 2.01 -0.63 -0.29 115.64 117.58 1l4i s THR 134 Ca 0.04 -0.32 -0.25 0.00 0.31 0.00 0.00 61.69 61.46 1l4i s THR 134 Cb -0.13 -0.84 0.02 0.00 0.01 0.00 0.00 72.50 71.56 1l4i s THR 134 CO 0.03 0.30 0.91 0.00 -0.69 0.00 0.00 174.62 175.16 1l4i s ARG 135 N 0.83 3.66 0.00 4.92 3.03 -1.26 -0.81 118.95 129.32 1l4i s ARG 135 Ca -0.12 0.32 0.00 0.00 2.03 0.00 0.00 55.73 57.96 1l4i s ARG 135 Cb -0.15 -3.87 0.00 0.00 -1.03 0.00 0.00 34.95 29.90 1l4i s ARG 135 CO 0.02 -1.08 0.00 -0.85 -1.13 0.00 0.00 175.30 172.25 1l4i n GLU 136 N 6.93 0.00 -3.34 3.89 0.28 -1.26 -4.98 120.64 122.17 1l4i n GLU 136 Ca 0.06 0.00 -0.37 0.00 -0.16 0.00 0.00 57.16 56.69 1l4i n GLU 136 Cb 0.48 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.29 1l4i n GLU 136 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1l4i s LEU 140 N 0.00 4.41 -0.18 -1.84 1.43 -1.05 -5.15 118.68 116.30 1l4i s LEU 140 Ca 0.00 1.14 -0.10 0.00 -1.03 0.00 0.00 54.13 54.14 1l4i s LEU 140 Cb 0.00 -3.09 -0.05 0.00 0.03 0.00 0.00 46.19 43.08 1l4i s LEU 140 CO 0.00 0.18 0.14 -0.89 0.23 0.00 0.00 176.35 176.01 1l4i s THR 141 N -1.31 5.42 -0.22 5.49 2.01 0.01 -0.77 115.64 126.26 1l4i s THR 141 Ca 0.34 0.21 -0.09 0.00 0.31 0.00 0.00 61.69 62.46 1l4i s THR 141 Cb -0.17 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 1l4i s THR 141 CO 0.19 0.47 0.11 -0.76 -0.69 0.00 0.00 174.62 173.94 1l4i s LEU 142 N 0.13 3.93 -0.11 4.42 1.43 -0.39 -1.60 118.68 126.50 1l4i s LEU 142 Ca 0.10 0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.28 1l4i s LEU 142 Cb -0.11 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 1l4i s LEU 142 CO -0.01 0.09 -0.20 0.12 0.23 0.00 0.00 176.35 176.59 1l4i s PHE 143 N 0.88 2.65 -0.67 0.29 5.36 0.12 -1.68 117.98 124.92 1l4i s PHE 143 Ca 0.06 -0.84 -0.04 0.00 -0.96 0.00 0.00 56.93 55.15 1l4i s PHE 143 Cb -0.13 -1.75 0.17 0.00 -0.34 0.00 0.00 43.02 40.97 1l4i s PHE 143 CO 0.03 -0.30 0.50 1.21 -1.46 0.00 0.00 175.22 175.20 1l4i s ASN 144 N 0.26 5.42 -0.02 6.13 2.47 -0.30 -0.84 114.94 128.07 1l4i s ASN 144 Ca -0.14 -2.94 0.00 0.00 0.42 0.00 0.00 52.86 50.20 1l4i s ASN 144 Cb -0.17 -1.89 0.03 0.00 -1.45 0.00 0.00 41.25 37.78 1l4i s ASN 144 CO 0.07 -0.36 1.22 -0.81 -3.72 0.00 0.00 177.10 173.50 1l4i n PRO 145 N 3.39 1.07 -4.50 0.43 -0.04 -1.26 -0.47 135.00 133.62 1l4i n PRO 145 Ca 0.10 -0.15 -0.24 0.00 -0.04 0.00 0.00 63.50 63.17 1l4i n PRO 145 Cb 0.38 -1.06 -0.10 0.00 -0.04 0.00 0.00 33.50 32.68 1l4i n PRO 145 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1l4i s THR 146 N -0.18 1.94 -1.59 0.52 -4.23 -1.26 -4.90 115.64 105.95 1l4i s THR 146 Ca 0.03 -2.16 0.05 0.00 -1.18 0.00 0.00 61.69 58.43 1l4i s THR 146 Cb 0.02 -2.59 0.18 0.00 1.34 0.00 0.00 72.50 71.46 1l4i s THR 146 CO 0.00 -0.23 1.03 -0.81 -0.54 0.00 0.00 174.62 174.07 1l4i n PRO 147 N -0.71 1.63 -4.14 3.99 -0.04 -1.26 -2.18 135.00 132.28 1l4i n PRO 147 Ca -0.05 -0.72 -0.27 0.00 -0.04 0.00 0.00 63.50 62.43 1l4i n PRO 147 Cb 0.64 -1.34 -0.07 0.00 -0.04 0.00 0.00 33.50 32.69 1l4i n PRO 147 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1l4i s TYR 148 N -1.64 3.00 -0.19 0.54 1.51 -1.26 -0.33 117.35 118.97 1l4i s TYR 148 Ca 0.13 -0.07 -0.24 0.00 -1.01 0.00 0.00 57.07 55.88 1l4i s TYR 148 Cb 0.08 -1.45 -0.01 0.00 -0.11 0.00 0.00 41.96 40.46 1l4i s TYR 148 CO 0.07 0.52 0.79 0.71 -1.11 0.00 0.00 175.55 176.52 1l4i s TYR 149 N -1.71 3.38 -0.12 2.71 1.51 -1.26 -3.37 117.35 118.50 1l4i s TYR 149 Ca 0.29 1.16 0.01 0.00 -1.01 0.00 0.00 57.07 57.51 1l4i s TYR 149 Cb -0.10 -2.98 -0.01 0.00 -0.11 0.00 0.00 41.96 38.76 1l4i s TYR 149 CO 0.21 -0.26 -0.15 -0.51 -1.11 0.00 0.00 175.55 173.73 1l4i s LEU 150 N 2.26 2.64 -0.34 -1.29 1.43 -0.45 -4.96 118.68 117.97 1l4i s LEU 150 Ca 0.35 -0.35 -0.15 0.00 -1.03 0.00 0.00 54.13 52.95 1l4i s LEU 150 Cb -0.16 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.47 1l4i s LEU 150 CO 0.11 0.18 0.37 -0.89 0.23 0.00 0.00 176.35 176.34 1l4i s THR 151 N 0.28 5.16 -0.23 5.49 2.01 -1.26 -1.20 115.64 125.89 1l4i s THR 151 Ca -0.11 0.05 -0.10 0.00 0.31 0.00 0.00 61.69 61.84 1l4i s THR 151 Cb -0.16 -3.83 -0.05 0.00 0.01 0.00 0.00 72.50 68.47 1l4i s THR 151 CO 0.06 -0.11 0.14 -0.69 -0.69 0.00 0.00 174.62 173.33 1l4i s VAL 152 N 2.03 5.24 0.24 3.82 1.01 0.07 -2.06 120.40 130.76 1l4i s VAL 152 Ca 0.12 0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.24 1l4i s VAL 152 Cb -0.17 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1l4i s VAL 152 CO 0.12 0.36 0.10 0.42 0.00 0.00 0.00 175.10 176.10 1l4i s THR 153 N 0.97 0.42 -1.91 3.92 -4.23 -0.61 -1.61 115.64 112.59 1l4i s THR 153 Ca 0.07 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1l4i s THR 153 Cb -0.13 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.12 1l4i s THR 153 CO 0.04 -0.02 0.00 -0.67 -0.54 0.00 0.00 174.62 173.43 1l4i n ASP 154 N -0.41 -5.35 -4.69 3.99 2.03 -1.26 -1.49 116.55 109.37 1l4i n ASP 154 Ca 0.00 0.29 -0.42 0.00 0.52 0.00 0.00 54.79 55.18 1l4i n ASP 154 Cb 0.66 -4.63 -0.03 0.00 -0.72 0.00 0.00 41.12 36.40 1l4i n ASP 154 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1l4i s LEU 155 N -5.18 4.37 -0.01 -2.67 2.96 -1.26 -4.24 118.68 112.65 1l4i s LEU 155 Ca 0.00 2.55 0.01 0.00 -0.22 0.00 0.00 54.13 56.47 1l4i s LEU 155 Cb 0.00 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.13 1l4i s LEU 155 CO 0.00 -0.91 -0.05 -0.54 -1.32 0.00 0.00 176.35 173.53 1l4i s LYS 156 N 2.57 0.46 -0.26 1.98 1.02 0.30 -0.86 119.74 124.95 1l4i s LYS 156 Ca 0.75 -0.16 0.01 0.00 0.02 0.00 0.00 55.97 56.59 1l4i s LYS 156 Cb -0.41 -0.46 0.07 0.00 -0.52 0.00 0.00 37.83 36.51 1l4i s LYS 156 CO 0.33 0.08 -0.00 0.00 -0.92 0.00 0.00 175.35 174.83 1l4i s ALA 157 N 0.07 1.94 0.00 5.17 0.00 -0.76 -1.31 121.76 126.86 1l4i s ALA 157 Ca -0.00 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.43 1l4i s ALA 157 Cb -0.04 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.56 1l4i s ALA 157 CO -0.00 -1.35 0.00 0.41 0.00 0.00 0.00 175.76 174.82 1l4i n GLY 158 N 4.67 1.91 0.21 0.00 0.00 -0.63 -2.36 105.19 109.00 1l4i n GLY 158 Ca -0.08 -0.42 0.08 0.00 0.00 0.00 0.00 46.02 45.60 1l4i n GLY 158 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1l4i n ASN 159 N 7.36 1.29 -4.69 1.61 4.05 -1.26 -4.83 115.26 118.79 1l4i n ASN 159 Ca 0.00 -1.14 -0.42 0.00 0.45 0.00 0.00 54.58 53.46 1l4i n ASN 159 Cb 0.00 0.72 -0.03 0.00 1.23 0.00 0.00 39.78 41.70 1l4i n ASN 159 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 177.26 172.62 1l4i s LYS 160 N -2.29 4.40 -0.16 1.20 0.00 -0.99 -5.03 119.74 116.86 1l4i s LYS 160 Ca 0.11 1.52 -0.24 0.00 0.00 0.00 0.00 55.97 57.36 1l4i s LYS 160 Cb 0.13 -3.54 -0.02 0.00 0.00 0.00 0.00 37.83 34.40 1l4i s LYS 160 CO 0.56 -0.36 0.75 -1.12 0.00 0.00 0.00 175.35 175.18 1l4i s SER 161 N 1.25 6.87 0.40 0.03 0.01 -1.26 -1.83 113.70 119.16 1l4i s SER 161 Ca 0.52 1.07 0.08 0.00 1.31 0.00 0.00 55.95 58.92 1l4i s SER 161 Cb -0.21 -2.42 -0.01 0.00 0.21 0.00 0.00 66.02 63.59 1l4i s SER 161 CO 0.20 -0.32 0.42 -0.76 0.41 0.00 0.00 173.24 173.19 1l4i s LEU 162 N 1.90 3.55 0.49 2.44 1.43 -0.04 -5.01 118.68 123.43 1l4i s LEU 162 Ca 0.35 -0.57 -0.19 0.00 -1.03 0.00 0.00 54.13 52.69 1l4i s LEU 162 Cb -0.16 -2.30 -0.09 0.00 0.03 0.00 0.00 46.19 43.67 1l4i s LEU 162 CO 0.12 -0.61 0.99 -1.61 0.23 0.00 0.00 176.35 175.48 1l4i s GLU 163 N -4.17 3.94 0.58 1.70 2.02 -1.26 -4.50 118.70 117.01 1l4i s GLU 163 Ca 0.48 1.15 -0.20 0.00 0.02 0.00 0.00 54.97 56.43 1l4i s GLU 163 Cb -0.06 -2.13 -0.04 0.00 0.10 0.00 0.00 34.13 32.00 1l4i s GLU 163 CO 0.29 -0.29 1.17 0.09 0.02 0.00 0.00 175.26 176.55 1l4i n ASN 164 N -1.13 1.73 -3.92 -0.19 3.02 -1.26 -4.85 115.26 108.66 1l4i n ASN 164 Ca 0.08 0.88 -0.09 0.00 -0.03 0.00 0.00 54.58 55.42 1l4i n ASN 164 Cb 0.53 -1.49 -0.07 0.00 -0.61 0.00 0.00 39.78 38.14 1l4i n ASN 164 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1l4i s THR 165 N -1.39 0.12 -0.21 3.41 -1.32 -0.63 -5.02 115.64 110.60 1l4i s THR 165 Ca 0.75 -1.33 0.00 0.00 -1.21 0.00 0.00 61.69 59.91 1l4i s THR 165 Cb -0.42 -1.56 0.02 0.00 -1.51 0.00 0.00 72.50 69.03 1l4i s THR 165 CO 0.47 -0.54 -0.15 -0.32 -2.21 0.00 0.00 174.62 171.87 1l4i s MET 166 N -3.91 2.94 -0.26 7.08 1.75 -1.26 -0.75 119.30 124.88 1l4i s MET 166 Ca 0.10 -0.88 -0.10 0.00 -1.25 0.00 0.00 55.69 53.56 1l4i s MET 166 Cb 0.05 -2.73 -0.05 0.00 2.84 0.00 0.00 34.83 34.94 1l4i s MET 166 CO -0.06 -0.28 0.15 0.08 -0.65 0.00 0.00 175.02 174.26 1l4i s VAL 167 N 1.30 5.11 0.83 10.11 1.01 -0.34 -4.91 120.40 133.51 1l4i s VAL 167 Ca 0.03 0.10 -0.11 0.00 0.00 0.00 0.00 61.98 61.99 1l4i s VAL 167 Cb -0.15 -3.40 0.09 0.00 0.00 0.00 0.00 36.38 32.92 1l4i s VAL 167 CO -0.09 0.31 1.09 -2.16 0.00 0.00 0.00 175.10 174.24 1l4i s PRO 168 N 1.44 1.80 0.20 2.72 0.04 -1.26 -1.34 135.00 138.59 1l4i s PRO 168 Ca 0.07 0.95 -0.33 0.00 0.04 0.00 0.00 61.00 61.73 1l4i s PRO 168 Cb -0.15 -1.86 -0.13 0.00 0.04 0.00 0.00 34.50 32.40 1l4i s PRO 168 CO 0.07 -1.90 1.59 -2.30 0.04 0.00 0.00 177.00 174.50 1l4i n PRO 169 N -3.67 2.35 -2.21 0.56 -0.02 -1.22 -1.81 135.00 128.99 1l4i n PRO 169 Ca 0.08 0.84 -0.20 0.00 -2.02 0.00 0.00 63.50 62.21 1l4i n PRO 169 Cb 0.54 -2.62 -0.03 0.00 -0.02 0.00 0.00 33.50 31.38 1l4i n PRO 169 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1l4i n GLN 170 N 3.22 -1.69 -4.58 -0.52 1.13 0.38 -4.94 117.38 110.37 1l4i n GLN 170 Ca 0.15 1.00 -0.30 0.00 -1.94 0.00 0.00 57.00 55.91 1l4i n GLN 170 Cb 0.31 -5.59 -0.08 0.00 0.11 0.00 0.00 30.24 25.00 1l4i n GLN 170 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1l4i s GLY 171 N -2.19 2.72 0.05 1.08 0.00 -0.75 -4.89 107.32 103.34 1l4i s GLY 171 Ca 0.00 -1.32 0.04 0.00 0.00 0.00 0.00 44.72 43.43 1l4i s GLY 171 CO 0.00 -2.11 -0.11 0.54 0.00 0.00 0.00 173.10 171.42 1l4i s LYS 172 N -3.85 0.68 0.03 2.90 1.02 -1.26 -1.15 119.74 118.11 1l4i s LYS 172 Ca 0.22 -0.79 -0.06 0.00 0.02 0.00 0.00 55.97 55.36 1l4i s LYS 172 Cb 0.05 -0.58 -0.01 0.00 -0.52 0.00 0.00 37.83 36.77 1l4i s LYS 172 CO 0.12 0.13 0.11 0.54 -0.92 0.00 0.00 175.35 175.33 1l4i s VAL 173 N -1.19 0.11 -0.07 3.17 0.11 -0.68 -4.95 120.40 116.90 1l4i s VAL 173 Ca -0.05 -0.93 0.01 0.00 -2.93 0.00 0.00 61.98 58.09 1l4i s VAL 173 Cb -0.09 -0.70 -0.03 0.00 -1.53 0.00 0.00 36.38 34.02 1l4i s VAL 173 CO 0.01 -0.51 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.30 1l4i s THR 174 N -2.13 3.62 -0.18 5.04 2.01 -1.26 -1.27 115.64 121.48 1l4i s THR 174 Ca -0.09 -0.51 0.00 0.00 0.31 0.00 0.00 61.69 61.40 1l4i s THR 174 Cb -0.04 -2.47 0.01 0.00 0.01 0.00 0.00 72.50 70.01 1l4i s THR 174 CO -0.02 0.60 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.65 1l4i s VAL 175 N -0.79 2.35 0.32 3.82 1.01 0.05 -4.99 120.40 122.16 1l4i s VAL 175 Ca 0.12 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 60.97 1l4i s VAL 175 Cb -0.11 -2.00 -0.10 0.00 0.00 0.00 0.00 36.38 34.17 1l4i s VAL 175 CO 0.01 0.52 1.19 0.21 0.00 0.00 0.00 175.10 177.03 1l4i s ASN 176 N 1.22 6.97 0.03 3.32 2.47 -1.26 -2.53 114.94 125.16 1l4i s ASN 176 Ca 0.03 2.45 0.04 0.00 0.42 0.00 0.00 52.86 55.79 1l4i s ASN 176 Cb -0.14 -2.63 -0.02 0.00 -1.45 0.00 0.00 41.25 37.01 1l4i s ASN 176 CO -0.09 -0.37 -0.11 -0.63 -3.72 0.00 0.00 177.10 172.18 1l4i s ILE 177 N -1.19 0.86 -0.34 -5.21 1.01 -1.26 -4.77 121.20 110.31 1l4i s ILE 177 Ca 0.48 -0.91 -0.03 0.00 0.00 0.00 0.00 60.65 60.18 1l4i s ILE 177 Cb -0.35 -0.81 -0.08 0.00 0.01 0.00 0.00 42.46 41.23 1l4i s ILE 177 CO 0.46 -0.08 1.88 -0.81 0.00 0.00 0.00 174.94 176.38 1l4i n PRO 178 N 1.93 1.24 0.00 2.79 -0.04 -1.26 -4.49 135.00 135.17 1l4i n PRO 178 Ca -0.18 -0.83 0.00 0.00 -0.04 0.00 0.00 63.50 62.45 1l4i n PRO 178 Cb 0.55 -2.02 0.00 0.00 -0.04 0.00 0.00 33.50 31.99 1l4i n PRO 178 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1l4i n GLY 179 N 3.27 1.59 0.00 0.55 0.00 -1.26 -5.24 105.19 104.10 1l4i n GLY 179 Ca 0.27 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1l4i n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l4i n GLY 180 N 0.00 4.14 1.91 -0.02 0.00 -1.26 -4.99 105.19 104.97 1l4i n GLY 180 Ca 0.00 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 1l4i n GLY 180 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1l4i n ASP 185 N 0.00 -0.07 -4.43 1.61 8.00 -1.26 -5.07 116.55 115.32 1l4i n ASP 185 Ca 0.00 0.63 -0.39 0.00 0.71 0.00 0.00 54.79 55.74 1l4i n ASP 185 Cb 0.00 -0.51 -0.11 0.00 -0.02 0.00 0.00 41.12 40.48 1l4i n ASP 185 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1l4i s ILE 186 N -0.06 4.68 0.20 0.53 1.01 -1.26 -1.61 121.20 124.70 1l4i s ILE 186 Ca 0.48 -0.51 0.06 0.00 0.00 0.00 0.00 60.65 60.68 1l4i s ILE 186 Cb -0.68 -3.45 -0.05 0.00 0.01 0.00 0.00 42.46 38.30 1l4i s ILE 186 CO 0.31 -0.02 -0.09 0.42 0.00 0.00 0.00 174.94 175.56 1l4i s THR 187 N 1.61 1.38 -0.09 2.92 -4.23 -0.43 -0.91 115.64 115.90 1l4i s THR 187 Ca 0.04 -2.11 -0.33 0.00 -1.18 0.00 0.00 61.69 58.11 1l4i s THR 187 Cb -0.18 -2.10 0.13 0.00 1.34 0.00 0.00 72.50 71.70 1l4i s THR 187 CO 0.07 -0.55 1.32 -0.72 -0.54 0.00 0.00 174.62 174.20 1l4i s TYR 188 N -3.19 -0.04 0.38 3.99 -0.85 -0.83 -0.54 117.35 116.27 1l4i s TYR 188 Ca 0.23 -0.02 0.08 0.00 -0.52 0.00 0.00 57.07 56.84 1l4i s TYR 188 Cb 0.02 0.53 -0.07 0.00 0.38 0.00 0.00 41.96 42.82 1l4i s TYR 188 CO 0.06 -0.17 -0.04 0.15 -1.52 0.00 0.00 175.55 174.03 1l4i s LYS 189 N -2.28 1.90 0.34 -3.49 1.02 -0.55 -0.97 119.74 115.70 1l4i s LYS 189 Ca 0.13 -2.03 0.06 0.00 0.02 0.00 0.00 55.97 54.15 1l4i s LYS 189 Cb 0.04 -1.67 -0.07 0.00 -0.52 0.00 0.00 37.83 35.61 1l4i s LYS 189 CO -0.05 0.03 0.00 0.95 -0.92 0.00 0.00 175.35 175.37 1l4i s THR 190 N -2.66 1.63 -0.15 2.17 -4.23 -1.26 -1.57 115.64 109.56 1l4i s THR 190 Ca 0.34 -2.05 -0.12 0.00 -1.18 0.00 0.00 61.69 58.68 1l4i s THR 190 Cb 0.07 -2.75 -0.05 0.00 1.34 0.00 0.00 72.50 71.11 1l4i s THR 190 CO 0.17 -0.10 0.23 -0.63 -0.54 0.00 0.00 174.62 173.76 1l4i s ILE 191 N -3.00 5.35 0.11 2.99 -1.09 -0.87 -1.92 121.20 122.76 1l4i s ILE 191 Ca 0.34 0.41 0.00 0.00 -2.23 0.00 0.00 60.65 59.18 1l4i s ILE 191 Cb 0.07 -3.56 0.02 0.00 -1.58 0.00 0.00 42.46 37.42 1l4i s ILE 191 CO 0.15 0.45 0.15 -0.46 -1.23 0.00 0.00 174.94 174.01 1l4i n ASN 192 N 3.19 0.22 0.29 3.58 0.23 0.42 -4.63 115.26 118.56 1l4i n ASN 192 Ca -0.14 -1.18 0.15 0.00 -0.53 0.00 0.00 54.58 52.87 1l4i n ASN 192 Cb 0.52 -0.10 0.90 0.00 -2.08 0.00 0.00 39.78 39.03 1l4i n ASN 192 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1l4i h ASP 193 N -0.08 0.00 -0.32 0.53 3.45 -1.99 -1.32 116.42 116.69 1l4i h ASP 193 Ca -0.05 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.41 1l4i h ASP 193 Cb 0.19 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.96 1l4i h ASP 193 CO 0.06 0.01 0.00 -1.22 -1.57 0.00 0.00 179.24 176.51 1l4i n TYR 194 N -3.87 0.42 -0.66 4.55 4.02 -1.26 -4.78 117.16 115.57 1l4i n TYR 194 Ca -0.03 -0.21 0.00 0.00 -0.01 0.00 0.00 57.90 57.65 1l4i n TYR 194 Cb 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.41 1l4i n TYR 194 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1l4i n GLY 195 N 1.30 0.67 3.97 2.72 0.00 -0.50 -4.96 105.19 108.39 1l4i n GLY 195 Ca 0.17 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 1l4i n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l4i s ALA 196 N -2.00 3.97 0.24 4.61 0.00 -1.26 -4.78 121.76 122.54 1l4i s ALA 196 Ca 0.00 -1.23 -0.30 0.00 0.00 0.00 0.00 51.96 50.43 1l4i s ALA 196 Cb 0.00 -1.81 -0.09 0.00 0.00 0.00 0.00 23.12 21.22 1l4i s ALA 196 CO 0.00 0.07 0.98 -0.51 0.00 0.00 0.00 175.76 176.30 1l4i s LEU 197 N -4.14 4.62 0.00 0.00 1.43 -1.26 -0.44 118.68 118.89 1l4i s LEU 197 Ca 0.39 2.02 -0.06 0.00 -1.03 0.00 0.00 54.13 55.46 1l4i s LEU 197 Cb -0.09 -3.61 0.15 0.00 0.03 0.00 0.00 46.19 42.67 1l4i s LEU 197 CO 0.31 0.07 0.98 0.35 0.23 0.00 0.00 176.35 178.29 1l4i n THR 198 N 1.50 0.00 -1.55 5.49 -2.24 -0.81 -4.89 114.28 111.77 1l4i n THR 198 Ca -0.01 -1.16 -0.30 0.00 -2.27 0.00 0.00 64.05 60.30 1l4i n THR 198 Cb 0.47 -1.20 0.07 0.00 -2.10 0.00 0.00 70.33 67.57 1l4i n THR 198 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1l4i s GLU 199 N -5.05 2.43 0.33 -0.78 -1.05 -1.26 -4.73 118.70 108.58 1l4i s GLU 199 Ca 0.61 0.78 -0.29 0.00 -0.15 0.00 0.00 54.97 55.92 1l4i s GLU 199 Cb -0.03 -1.95 -0.10 0.00 -0.44 0.00 0.00 34.13 31.62 1l4i s GLU 199 CO 0.41 -1.41 1.28 -1.14 0.95 0.00 0.00 175.26 175.35 1l4i s GLN 200 N -5.11 4.36 0.02 -4.83 0.74 -1.26 -4.65 119.66 108.94 1l4i s GLN 200 Ca 0.60 2.16 0.05 0.00 0.05 0.00 0.00 55.36 58.22 1l4i s GLN 200 Cb -0.14 -3.06 -0.02 0.00 1.10 0.00 0.00 33.01 30.89 1l4i s GLN 200 CO 0.55 -0.16 -0.16 0.08 -0.55 0.00 0.00 175.29 175.05 1l4i s VAL 201 N -1.15 1.25 -0.20 1.34 1.01 -0.15 -4.98 120.40 117.52 1l4i s VAL 201 Ca 0.49 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 1l4i s VAL 201 Cb -0.39 -1.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 1l4i s VAL 201 CO 0.51 0.17 0.17 0.00 0.00 0.00 0.00 175.10 175.95 1l4i s ARG 202 N -0.84 4.19 0.67 2.72 3.03 -1.26 -1.96 118.95 125.49 1l4i s ARG 202 Ca 0.04 -0.16 -0.11 0.00 2.03 0.00 0.00 55.73 57.54 1l4i s ARG 202 Cb -0.07 -3.44 -0.01 0.00 -1.03 0.00 0.00 34.95 30.40 1l4i s ARG 202 CO 0.01 0.25 1.05 0.20 -1.13 0.00 0.00 175.30 175.67 1l4i s GLY 203 N 0.49 1.66 -0.50 3.88 0.00 -0.08 -4.99 107.32 107.78 1l4i s GLY 203 Ca 0.10 0.02 -0.29 0.00 0.00 0.00 0.00 44.72 44.55 1l4i s GLY 203 CO 0.00 0.31 1.21 0.14 0.00 0.00 0.00 173.10 174.76 1l4i s VAL 204 N -3.10 4.08 -0.22 1.40 1.01 -1.06 -4.94 120.40 117.58 1l4i s VAL 204 Ca 0.57 1.06 -0.11 0.00 0.00 0.00 0.00 61.98 63.50 1l4i s VAL 204 Cb -0.13 -4.58 -0.05 0.00 0.00 0.00 0.00 36.38 31.62 1l4i s VAL 204 CO 0.55 -1.09 0.19 -0.69 0.00 0.00 0.00 175.10 174.06 1l4i s VAL 205 N 4.83 5.35 -1.96 2.92 1.01 -1.26 -0.44 120.40 130.85 1l4i s VAL 205 Ca 0.49 0.28 0.16 0.00 0.00 0.00 0.00 61.98 62.90 1l4i s VAL 205 Cb -0.08 -3.53 0.12 0.00 0.00 0.00 0.00 36.38 32.89 1l4i s VAL 205 CO 0.30 0.36 1.00 0.29 0.00 0.00 0.00 175.10 177.04