#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n0e s LEU 27 N 0.00 4.47 0.11 -0.89 1.43 -0.80 -4.91 118.68 118.09 1n0e s LEU 27 Ca 0.00 -0.43 0.06 0.00 -1.03 0.00 0.00 54.13 52.73 1n0e s LEU 27 Cb 0.00 -2.73 -0.04 0.00 0.03 0.00 0.00 46.19 43.45 1n0e s LEU 27 CO 0.00 -0.94 -0.14 -0.76 0.23 0.00 0.00 176.35 174.74 1n0e s LEU 28 N 3.13 2.38 0.00 1.79 1.43 -1.26 0.16 118.68 126.31 1n0e s LEU 28 Ca 0.24 -0.77 0.00 0.00 -1.03 0.00 0.00 54.13 52.57 1n0e s LEU 28 Cb -0.15 -0.56 0.00 0.00 0.03 0.00 0.00 46.19 45.51 1n0e s LEU 28 CO 0.18 -0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.25 1n0e n GLY 29 N 0.67 1.53 3.17 -3.19 0.00 -1.26 -4.49 105.19 101.62 1n0e n GLY 29 Ca -0.17 -2.09 -0.28 0.00 0.00 0.00 0.00 46.02 43.48 1n0e n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n0e s THR 30 N -1.78 1.67 -0.04 2.61 2.01 -1.26 0.85 115.64 119.71 1n0e s THR 30 Ca 0.00 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.18 1n0e s THR 30 Cb 0.00 -1.44 0.02 0.00 0.01 0.00 0.00 72.50 71.09 1n0e s THR 30 CO 0.00 0.47 -0.06 -0.36 -0.69 0.00 0.00 174.62 173.99 1n0e s PHE 31 N 0.10 0.80 -0.30 4.92 0.08 0.21 -4.96 117.98 118.83 1n0e s PHE 31 Ca -0.07 -0.22 -0.10 0.00 0.12 0.00 0.00 56.93 56.66 1n0e s PHE 31 Cb -0.14 -0.65 -0.02 0.00 -0.57 0.00 0.00 43.02 41.64 1n0e s PHE 31 CO 0.04 -0.16 0.16 -0.80 -0.10 0.00 0.00 175.22 174.35 1n0e s ASN 32 N 0.67 5.61 0.36 1.36 0.01 -1.26 0.26 114.94 121.95 1n0e s ASN 32 Ca -0.09 -0.40 0.05 0.00 -0.71 0.00 0.00 52.86 51.71 1n0e s ASN 32 Cb -0.13 -2.02 -0.03 0.00 0.41 0.00 0.00 41.25 39.48 1n0e s ASN 32 CO 0.01 -0.16 0.19 0.27 -1.51 0.00 0.00 177.10 175.90 1n0e s ILE 33 N 1.65 0.30 0.05 0.60 -4.36 0.10 -4.99 121.20 114.55 1n0e s ILE 33 Ca 0.05 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.51 1n0e s ILE 33 Cb -0.17 -2.43 -0.03 0.00 1.25 0.00 0.00 42.46 41.08 1n0e s ILE 33 CO 0.07 0.00 -0.14 -0.89 0.24 0.00 0.00 174.94 174.22 1n0e s THR 34 N -3.39 3.09 -0.15 8.37 2.01 -1.26 0.10 115.64 124.40 1n0e s THR 34 Ca 0.33 -1.11 -0.27 0.00 0.31 0.00 0.00 61.69 60.94 1n0e s THR 34 Cb 0.03 -2.34 -0.01 0.00 0.01 0.00 0.00 72.50 70.19 1n0e s THR 34 CO 0.20 0.30 0.93 -0.22 -0.69 0.00 0.00 174.62 175.14 1n0e s LEU 35 N -1.59 4.19 1.02 4.42 2.96 -1.26 -4.69 118.68 123.74 1n0e s LEU 35 Ca 0.16 1.34 -0.14 0.00 -0.22 0.00 0.00 54.13 55.27 1n0e s LEU 35 Cb -0.11 -3.40 0.09 0.00 0.50 0.00 0.00 46.19 43.27 1n0e s LEU 35 CO 0.07 -0.46 0.38 -0.67 -1.32 0.00 0.00 176.35 174.36 1n0e n ASP 36 N 5.32 -1.95 0.23 3.68 2.03 0.26 -4.81 116.55 121.31 1n0e n ASP 36 Ca 0.07 0.14 0.13 0.00 0.52 0.00 0.00 54.79 55.65 1n0e n ASP 36 Cb 0.48 -1.15 0.37 0.00 -0.72 0.00 0.00 41.12 40.11 1n0e n ASP 36 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1n0e h ALA 37 N -1.86 0.97 -0.57 -1.67 0.00 -1.95 -2.35 119.26 111.83 1n0e h ALA 37 Ca -0.48 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1n0e h ALA 37 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1n0e h ALA 37 CO 0.37 0.10 0.00 1.63 0.00 0.00 0.00 179.25 181.35 1n0e n LYS 38 N -3.15 4.26 -3.21 0.00 5.02 -1.26 -4.94 118.16 114.88 1n0e n LYS 38 Ca 0.02 -3.02 -0.16 0.00 -2.02 0.00 0.00 58.31 53.14 1n0e n LYS 38 Cb 0.46 -2.07 0.05 0.00 -0.02 0.00 0.00 35.03 33.45 1n0e n LYS 38 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1n0e n ASN 39 N 0.68 -4.81 -4.48 4.39 5.03 -0.89 -4.85 115.26 110.34 1n0e n ASN 39 Ca 0.26 -0.36 -0.24 0.00 0.87 0.00 0.00 54.58 55.12 1n0e n ASN 39 Cb 1.05 -3.48 -0.10 0.00 -1.02 0.00 0.00 39.78 36.23 1n0e n ASN 39 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1n0e s ARG 40 N -5.84 1.72 -0.03 3.52 0.52 -1.26 -1.51 118.95 116.08 1n0e s ARG 40 Ca 0.38 -1.75 0.03 0.00 -0.52 0.00 0.00 55.73 53.86 1n0e s ARG 40 Cb -0.17 -1.79 0.00 0.00 0.52 0.00 0.00 34.95 33.51 1n0e s ARG 40 CO 0.48 0.33 -0.10 0.96 0.02 0.00 0.00 175.30 176.98 1n0e s ILE 41 N -2.50 0.88 -0.24 1.52 -4.36 -0.76 0.90 121.20 116.64 1n0e s ILE 41 Ca 0.30 -0.41 -0.23 0.00 -0.26 0.00 0.00 60.65 60.05 1n0e s ILE 41 Cb -0.05 -0.78 -0.01 0.00 1.25 0.00 0.00 42.46 42.87 1n0e s ILE 41 CO 0.15 0.27 0.74 -0.44 0.24 0.00 0.00 174.94 175.91 1n0e s SER 42 N 0.17 6.74 0.14 4.36 0.01 -1.26 -1.38 113.70 122.49 1n0e s SER 42 Ca -0.03 0.91 -0.31 0.00 1.31 0.00 0.00 55.95 57.83 1n0e s SER 42 Cb -0.09 -2.40 -0.10 0.00 0.21 0.00 0.00 66.02 63.64 1n0e s SER 42 CO 0.01 -0.44 1.66 -0.76 0.41 0.00 0.00 173.24 174.12 1n0e s LEU 43 N 2.60 4.37 0.10 2.44 1.43 -0.00 -4.89 118.68 124.73 1n0e s LEU 43 Ca 0.32 2.65 -0.15 0.00 -1.03 0.00 0.00 54.13 55.92 1n0e s LEU 43 Cb -0.15 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.48 1n0e s LEU 43 CO 0.08 -0.90 0.84 -2.65 0.23 0.00 0.00 176.35 173.95 1n0e n PRO 44 N 4.67 -0.21 0.00 1.29 -0.02 -1.26 -4.63 135.00 134.84 1n0e n PRO 44 Ca 0.15 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 1n0e n PRO 44 Cb 0.38 -1.22 0.00 0.00 -0.02 0.00 0.00 33.50 32.65 1n0e n PRO 44 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n0e n ALA 45 N -3.62 0.00 0.18 3.55 0.00 -1.26 -4.83 120.51 114.53 1n0e n ALA 45 Ca 0.02 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.63 1n0e n ALA 45 Cb 0.16 0.00 0.80 0.00 0.00 0.00 0.00 19.45 20.41 1n0e n ALA 45 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1n0e h LYS 46 N 0.00 0.00 0.14 0.00 1.57 -2.02 -1.99 116.57 114.27 1n0e h LYS 46 Ca 0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.52 1n0e h LYS 46 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 1n0e h LYS 46 CO 0.00 0.00 -1.24 -0.07 -0.57 0.00 0.00 179.45 177.57 1n0e h LEU 47 N 0.00 0.47 -1.12 2.94 4.07 -1.90 -3.35 115.31 116.42 1n0e h LEU 47 Ca 0.10 -0.90 0.27 0.00 0.08 0.00 0.00 57.88 57.43 1n0e h LEU 47 Cb 0.53 -0.15 -0.12 0.00 1.08 0.00 0.00 40.66 42.00 1n0e h LEU 47 CO -0.00 1.56 0.62 0.03 -1.08 0.00 0.00 178.44 179.58 1n0e h ARG 48 N -0.25 0.47 -0.46 1.13 3.08 -1.62 0.12 114.38 116.84 1n0e h ARG 48 Ca -0.25 -0.03 0.09 0.00 0.07 0.00 0.00 59.98 59.87 1n0e h ARG 48 Cb 1.79 -0.11 -0.09 0.00 0.08 0.00 0.00 29.97 31.64 1n0e h ARG 48 CO 0.12 0.31 -0.18 0.00 -1.07 0.00 0.00 179.97 179.15 1n0e h ALA 49 N 1.71 0.19 -0.94 0.04 0.00 -1.66 -2.08 119.26 116.51 1n0e h ALA 49 Ca 0.65 0.17 0.07 0.00 0.00 0.00 0.00 54.91 55.79 1n0e h ALA 49 Cb 1.40 0.47 -0.07 0.00 0.00 0.00 0.00 17.79 19.59 1n0e h ALA 49 CO -0.43 -0.52 0.60 0.35 0.00 0.00 0.00 179.25 179.25 1n0e h PHE 50 N -0.08 1.11 -3.25 0.00 3.57 -0.94 -3.43 116.94 113.92 1n0e h PHE 50 Ca 0.22 0.03 -0.54 0.00 3.53 0.00 0.00 57.97 61.21 1n0e h PHE 50 Cb 0.42 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 1n0e h PHE 50 CO -0.45 0.56 -0.18 -0.06 -2.23 0.00 0.00 178.31 175.95 1n0e s PHE 51 N -6.04 3.46 0.00 0.41 0.08 -0.78 -5.01 117.98 110.10 1n0e s PHE 51 Ca -0.12 0.68 0.00 0.00 0.12 0.00 0.00 56.93 57.61 1n0e s PHE 51 Cb 0.20 -2.12 0.00 0.00 -0.57 0.00 0.00 43.02 40.53 1n0e s PHE 51 CO 0.80 0.27 0.00 -1.91 -0.10 0.00 0.00 175.22 174.28 1n0e n GLU 52 N -0.44 0.00 -0.10 0.44 4.07 -1.26 -4.90 120.64 118.45 1n0e n GLU 52 Ca -0.01 0.00 0.08 0.00 -0.06 0.00 0.00 57.16 57.16 1n0e n GLU 52 Cb 0.53 0.00 0.12 0.00 -0.06 0.00 0.00 31.44 32.03 1n0e n GLU 52 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1n0e n GLY 53 N 5.00 1.13 3.05 8.31 0.00 -1.26 -4.82 105.19 116.60 1n0e n GLY 53 Ca 0.00 -0.47 -0.12 0.00 0.00 0.00 0.00 46.02 45.43 1n0e n GLY 53 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n0e s SER 54 N -1.17 -0.03 0.09 1.61 0.15 -1.26 0.42 113.70 113.51 1n0e s SER 54 Ca 0.24 -0.00 -0.01 0.00 0.70 0.00 0.00 55.95 56.88 1n0e s SER 54 Cb 0.14 0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.64 1n0e s SER 54 CO 0.20 -0.20 -0.00 0.27 1.20 0.00 0.00 173.24 174.71 1n0e s ILE 55 N -0.67 0.26 -0.06 6.45 -5.25 0.26 -4.39 121.20 117.79 1n0e s ILE 55 Ca -0.08 -1.87 0.02 0.00 -0.99 0.00 0.00 60.65 57.73 1n0e s ILE 55 Cb -0.05 -1.75 -0.03 0.00 2.95 0.00 0.00 42.46 43.58 1n0e s ILE 55 CO 0.01 -0.77 -0.09 -0.69 -1.79 0.00 0.00 174.94 171.60 1n0e s VAL 56 N -3.92 3.52 -0.07 8.37 1.01 -0.44 0.06 120.40 128.93 1n0e s VAL 56 Ca 0.14 -0.55 -0.11 0.00 0.00 0.00 0.00 61.98 61.47 1n0e s VAL 56 Cb 0.07 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 1n0e s VAL 56 CO -0.05 0.59 -0.21 0.00 0.00 0.00 0.00 175.10 175.44 1n0e n ILE 57 N 2.28 1.36 -1.33 2.22 3.06 0.10 -1.90 119.36 125.15 1n0e n ILE 57 Ca -0.18 0.25 0.00 0.00 -2.50 0.00 0.00 62.75 60.32 1n0e n ILE 57 Cb 0.53 -2.03 0.00 0.00 0.54 0.00 0.00 39.64 38.67 1n0e n ILE 57 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 1n0e n ASN 58 N -4.04 -4.51 -4.77 9.51 0.23 -1.22 -2.95 115.26 107.51 1n0e n ASN 58 Ca -0.08 0.91 -0.39 0.00 -0.53 0.00 0.00 54.58 54.49 1n0e n ASN 58 Cb 0.31 -3.43 -0.05 0.00 -2.08 0.00 0.00 39.78 34.53 1n0e n ASN 58 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1n0e s ARG 59 N -4.37 4.62 0.00 -3.83 1.70 -1.22 -1.46 118.95 114.39 1n0e s ARG 59 Ca 0.00 1.54 0.00 0.00 -0.47 0.00 0.00 55.73 56.80 1n0e s ARG 59 Cb 0.00 -3.01 0.00 0.00 -0.57 0.00 0.00 34.95 31.37 1n0e s ARG 59 CO 0.00 0.27 0.00 0.41 -1.08 0.00 0.00 175.30 174.90 1n0e n GLY 60 N 0.99 2.22 3.88 3.88 0.00 -1.26 -4.70 105.19 110.20 1n0e n GLY 60 Ca 0.00 -2.10 -0.32 0.00 0.00 0.00 0.00 46.02 43.60 1n0e n GLY 60 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n0e s PHE 61 N 1.19 3.44 -1.38 1.61 0.08 -1.26 -4.08 117.98 117.58 1n0e s PHE 61 Ca 0.00 0.85 0.00 0.00 0.12 0.00 0.00 56.93 57.90 1n0e s PHE 61 Cb 0.00 -2.24 0.00 0.00 -0.57 0.00 0.00 43.02 40.21 1n0e s PHE 61 CO 0.00 0.29 0.00 0.39 -0.10 0.00 0.00 175.22 175.80 1n0e n GLU 62 N -0.07 -1.28 -3.19 0.44 4.71 -1.26 -3.70 120.64 116.29 1n0e n GLU 62 Ca -0.00 0.78 -0.15 0.00 -0.01 0.00 0.00 57.16 57.78 1n0e n GLU 62 Cb 0.52 -5.17 0.07 0.00 -1.01 0.00 0.00 31.44 25.85 1n0e n GLU 62 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1n0e n ASN 63 N -1.07 -6.20 0.00 1.62 3.02 -1.26 -5.01 115.26 106.37 1n0e n ASN 63 Ca -0.19 -0.68 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 1n0e n ASN 63 Cb 0.64 -5.03 0.00 0.00 -0.61 0.00 0.00 39.78 34.78 1n0e n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0e n LEU 65 N -0.66 -5.39 -4.67 0.00 4.32 -1.26 -1.93 117.00 107.41 1n0e n LEU 65 Ca 0.00 2.66 -0.27 0.00 -0.02 0.00 0.00 56.01 58.38 1n0e n LEU 65 Cb 0.00 -2.65 -0.08 0.00 -1.62 0.00 0.00 43.42 39.07 1n0e n LEU 65 CO 0.00 -1.20 -0.33 -1.61 -1.22 0.00 0.00 177.39 173.04 1n0e s GLU 66 N -1.44 2.46 -0.03 3.23 2.02 -0.53 -1.30 118.70 123.10 1n0e s GLU 66 Ca 0.00 -1.04 0.02 0.00 0.02 0.00 0.00 54.97 53.96 1n0e s GLU 66 Cb 0.00 -2.41 0.01 0.00 0.10 0.00 0.00 34.13 31.83 1n0e s GLU 66 CO 0.00 0.47 -0.05 0.08 0.02 0.00 0.00 175.26 175.78 1n0e s VAL 67 N -1.64 0.53 0.18 2.63 1.01 0.20 -4.14 120.40 119.17 1n0e s VAL 67 Ca 0.27 -0.19 -0.05 0.00 0.00 0.00 0.00 61.98 62.01 1n0e s VAL 67 Cb -0.10 -0.51 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 1n0e s VAL 67 CO 0.19 0.19 0.21 -0.13 0.00 0.00 0.00 175.10 175.56 1n0e s ARG 68 N 0.46 1.16 0.36 2.72 0.52 -0.80 -1.03 118.95 122.33 1n0e s ARG 68 Ca -0.06 -1.38 -0.23 0.00 -0.52 0.00 0.00 55.73 53.54 1n0e s ARG 68 Cb -0.10 0.32 -0.10 0.00 0.52 0.00 0.00 34.95 35.60 1n0e s ARG 68 CO 0.00 -0.40 0.91 0.15 0.02 0.00 0.00 175.30 175.98 1n0e s LYS 69 N -4.05 4.36 0.43 3.54 1.02 -1.26 -1.33 119.74 122.45 1n0e s LYS 69 Ca 0.26 1.15 0.20 0.00 0.02 0.00 0.00 55.97 57.59 1n0e s LYS 69 Cb 0.05 -2.53 1.15 0.00 -0.52 0.00 0.00 37.83 35.98 1n0e s LYS 69 CO 0.05 0.16 1.83 -1.35 -0.92 0.00 0.00 175.35 175.12 1n0e h PRO 70 N 2.62 0.34 -0.39 -1.68 0.11 -1.91 0.44 132.00 131.53 1n0e h PRO 70 Ca -0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1n0e h PRO 70 Cb 1.19 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1n0e h PRO 70 CO 0.63 0.22 0.08 1.96 -0.21 0.00 0.00 178.00 180.69 1n0e h GLN 71 N 0.35 0.63 -0.21 1.05 7.50 -1.96 -0.98 115.11 121.49 1n0e h GLN 71 Ca 0.50 -0.16 -0.09 0.00 0.50 0.00 0.00 58.65 59.41 1n0e h GLN 71 Cb 1.35 -0.08 -0.01 0.00 0.05 0.00 0.00 27.48 28.79 1n0e h GLN 71 CO -0.18 0.67 -0.25 -0.44 -1.50 0.00 0.00 178.83 177.12 1n0e h ASP 72 N 0.48 0.39 -0.66 1.46 3.32 -1.37 -1.99 116.42 118.05 1n0e h ASP 72 Ca 0.12 -0.13 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 1n0e h ASP 72 Cb 0.33 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 1n0e h ASP 72 CO 0.00 0.65 0.22 0.15 -1.72 0.00 0.00 179.24 178.54 1n0e h PHE 73 N 0.35 1.08 -0.21 4.55 3.57 -0.62 0.77 116.94 126.44 1n0e h PHE 73 Ca 0.05 -0.10 0.05 0.00 3.53 0.00 0.00 57.97 61.51 1n0e h PHE 73 Cb 0.64 -0.32 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 1n0e h PHE 73 CO 0.02 0.85 -0.11 0.37 -2.23 0.00 0.00 178.31 177.21 1n0e h GLN 74 N 1.01 -0.09 -0.37 1.11 5.75 -0.46 -0.22 115.11 121.84 1n0e h GLN 74 Ca 0.22 0.01 -0.10 0.00 -0.15 0.00 0.00 58.65 58.63 1n0e h GLN 74 Cb 0.27 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 1n0e h GLN 74 CO -0.01 -0.06 -0.19 0.87 -2.65 0.00 0.00 178.83 176.79 1n0e h LYS 75 N -0.09 0.70 -0.55 1.69 1.57 -0.97 -2.35 116.57 116.56 1n0e h LYS 75 Ca 0.11 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1n0e h LYS 75 Cb 0.26 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1n0e h LYS 75 CO -0.27 0.84 0.34 -0.92 -0.57 0.00 0.00 179.45 178.88 1n0e h TYR 76 N 0.62 0.71 -0.36 -1.35 3.20 -0.21 -2.78 116.97 116.81 1n0e h TYR 76 Ca 0.09 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 1n0e h TYR 76 Cb 0.66 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 1n0e h TYR 76 CO 0.03 0.48 0.13 0.35 -1.64 0.00 0.00 178.16 177.51 1n0e h PHE 77 N 0.74 0.56 -0.07 -3.82 3.57 -0.86 -2.06 116.94 115.00 1n0e h PHE 77 Ca 0.20 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.67 1n0e h PHE 77 Cb -0.04 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 38.53 1n0e h PHE 77 CO -0.03 0.53 0.19 0.93 -2.23 0.00 0.00 178.31 177.71 1n0e h GLU 78 N 0.44 0.00 -0.04 1.11 5.08 -1.22 0.55 114.58 120.49 1n0e h GLU 78 Ca 0.12 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.37 1n0e h GLU 78 Cb 0.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1n0e h GLU 78 CO -0.01 0.00 -0.46 1.96 -1.00 0.00 0.00 179.01 179.50 1n0e h GLN 79 N 0.00 0.10 -0.10 2.33 4.20 -1.10 -3.01 115.11 117.52 1n0e h GLN 79 Ca 0.04 -0.05 -0.21 0.00 0.06 0.00 0.00 58.65 58.49 1n0e h GLN 79 Cb 0.42 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1n0e h GLN 79 CO -0.00 0.54 -0.78 0.74 -0.67 0.00 0.00 178.83 178.66 1n0e h PHE 80 N 0.08 0.82 0.00 2.96 0.04 0.06 -3.17 116.94 117.74 1n0e h PHE 80 Ca 0.00 -0.37 0.00 0.00 2.80 0.00 0.00 57.97 60.40 1n0e h PHE 80 Cb 0.85 -0.12 0.00 0.00 2.20 0.00 0.00 35.95 38.88 1n0e h PHE 80 CO 0.01 1.17 0.04 0.09 -0.60 0.00 0.00 178.31 179.02 1n0e n ASN 81 N -3.88 0.17 0.06 2.17 4.13 -1.06 0.10 115.26 116.95 1n0e n ASN 81 Ca -0.06 0.55 0.13 0.00 1.68 0.00 0.00 54.58 56.88 1n0e n ASN 81 Cb 0.74 -0.57 0.42 0.00 -1.54 0.00 0.00 39.78 38.83 1n0e n ASN 81 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1n0e n SER 82 N -1.71 0.52 -4.79 6.41 3.41 -1.20 -4.80 113.62 111.46 1n0e n SER 82 Ca -0.00 0.41 -0.38 0.00 -0.26 0.00 0.00 58.87 58.63 1n0e n SER 82 Cb 0.05 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.48 1n0e n SER 82 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1n0e s PHE 83 N -3.07 3.80 0.00 7.33 0.08 0.28 -5.01 117.98 121.39 1n0e s PHE 83 Ca 0.11 1.52 0.00 0.00 0.12 0.00 0.00 56.93 58.68 1n0e s PHE 83 Cb 0.15 -2.70 0.00 0.00 -0.57 0.00 0.00 43.02 39.90 1n0e s PHE 83 CO 0.61 0.44 0.00 -2.30 -0.10 0.00 0.00 175.22 173.87 1n0e n PRO 84 N 1.25 0.00 0.00 0.24 -0.02 -1.26 -4.81 135.00 130.40 1n0e n PRO 84 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1n0e n PRO 84 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 1n0e n PRO 84 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n0e n SER 85 N -1.02 0.00 -0.01 2.55 2.88 -1.26 -4.68 113.62 112.07 1n0e n SER 85 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1n0e n SER 85 Cb 0.00 0.00 0.34 0.00 -0.75 0.00 0.00 64.21 63.80 1n0e n SER 85 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1n0e n THR 86 N -0.31 0.00 -3.36 2.46 -2.24 -1.26 -4.69 114.28 104.89 1n0e n THR 86 Ca 0.00 -0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.40 1n0e n THR 86 Cb 0.00 0.10 -0.06 0.00 -2.10 0.00 0.00 70.33 68.27 1n0e n THR 86 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1n0e s GLN 87 N -2.96 4.30 0.25 -0.78 -1.52 -1.26 -4.98 119.66 112.71 1n0e s GLN 87 Ca 0.13 0.40 -0.04 0.00 -1.95 0.00 0.00 55.36 53.90 1n0e s GLN 87 Cb 0.18 -3.42 0.46 0.00 -0.22 0.00 0.00 33.01 30.01 1n0e s GLN 87 CO 0.65 0.20 1.73 -0.22 -0.25 0.00 0.00 175.29 177.41 1n0e h LYS 88 N 6.58 0.45 -0.98 2.91 3.64 -2.00 -1.16 116.57 126.00 1n0e h LYS 88 Ca -0.42 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 58.95 1n0e h LYS 88 Cb 1.18 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.85 1n0e h LYS 88 CO 0.75 0.30 0.65 -0.44 -2.27 0.00 0.00 179.45 178.43 1n0e h ASP 89 N 0.46 1.11 -0.03 4.20 3.32 -1.97 -1.04 116.42 122.46 1n0e h ASP 89 Ca 0.42 -0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.46 1n0e h ASP 89 Cb 0.63 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 1n0e h ASP 89 CO -0.40 0.79 -0.05 0.74 -1.72 0.00 0.00 179.24 178.60 1n0e h THR 90 N 1.30 0.85 -0.83 0.35 2.02 -1.59 0.10 112.91 115.10 1n0e h THR 90 Ca 0.37 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.58 1n0e h THR 90 Cb -0.11 0.85 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 1n0e h THR 90 CO -0.09 0.00 0.55 0.03 0.37 0.00 0.00 175.52 176.38 1n0e h ARG 91 N -0.08 1.01 -0.18 6.66 3.08 -1.10 0.11 114.38 123.88 1n0e h ARG 91 Ca 0.03 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1n0e h ARG 91 Cb 0.12 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1n0e h ARG 91 CO -0.08 0.67 -0.07 1.15 -1.07 0.00 0.00 179.97 180.57 1n0e h THR 92 N 1.04 1.30 0.04 2.04 2.02 -0.76 -0.81 112.91 117.77 1n0e h THR 92 Ca 0.33 -1.08 0.02 0.00 0.77 0.00 0.00 66.41 66.45 1n0e h THR 92 Cb 0.03 1.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 1n0e h THR 92 CO -0.10 0.32 -0.18 0.25 0.37 0.00 0.00 175.52 176.19 1n0e h LEU 93 N 0.06 -0.52 -1.38 2.58 5.85 -0.33 0.17 115.31 121.75 1n0e h LEU 93 Ca 0.04 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.86 1n0e h LEU 93 Cb 0.53 0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 1n0e h LEU 93 CO 0.02 -0.25 0.44 0.11 -0.34 0.00 0.00 178.44 178.42 1n0e h LYS 94 N -0.32 0.80 -0.01 1.25 1.57 -0.75 -1.64 116.57 117.46 1n0e h LYS 94 Ca 0.04 -0.05 -0.21 0.00 -1.87 0.00 0.00 60.65 58.57 1n0e h LYS 94 Cb 0.37 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 1n0e h LYS 94 CO -0.14 0.53 -0.88 0.00 -0.57 0.00 0.00 179.45 178.39 1n0e h ARG 95 N 0.82 0.33 0.00 3.15 3.08 -0.38 -2.17 114.38 119.21 1n0e h ARG 95 Ca 0.26 -0.34 -0.10 0.00 0.07 0.00 0.00 59.98 59.88 1n0e h ARG 95 Cb 0.04 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1n0e h ARG 95 CO -0.07 1.02 -0.47 -0.07 -1.07 0.00 0.00 179.97 179.31 1n0e h LEU 96 N 0.19 0.00 0.00 3.04 3.38 -0.22 -3.00 115.31 118.70 1n0e h LEU 96 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1n0e h LEU 96 Cb 1.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.25 1n0e h LEU 96 CO 0.15 0.47 -0.05 0.40 0.09 0.00 0.00 178.44 179.50 1n0e h ILE 97 N 0.00 0.00 0.00 1.22 2.04 -1.29 -3.38 117.51 116.09 1n0e h ILE 97 Ca -0.00 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1n0e h ILE 97 Cb 1.00 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1n0e h ILE 97 CO 0.06 0.00 -0.06 -0.26 0.00 0.00 0.00 178.15 177.90 1n0e h PHE 98 N -0.14 0.00 0.00 1.37 0.04 -1.57 -1.42 116.94 115.21 1n0e h PHE 98 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1n0e h PHE 98 Cb 0.05 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.20 1n0e h PHE 98 CO -0.02 0.06 0.00 0.00 -0.60 0.00 0.00 178.31 177.75 1n0e h ALA 99 N 1.94 1.00 -0.10 2.45 0.00 -1.70 -2.78 119.26 120.07 1n0e h ALA 99 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1n0e h ALA 99 Cb 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1n0e h ALA 99 CO 0.01 0.00 -0.12 0.09 0.00 0.00 0.00 179.25 179.23 1n0e n ASN 100 N -2.54 2.53 -4.83 0.00 3.02 -0.56 -4.99 115.26 107.89 1n0e n ASN 100 Ca 0.02 -3.36 -0.31 0.00 -0.03 0.00 0.00 54.58 50.91 1n0e n ASN 100 Cb 0.29 -0.51 -0.06 0.00 -0.61 0.00 0.00 39.78 38.90 1n0e n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0e s ALA 101 N -3.00 3.73 0.01 5.41 0.00 -1.05 -3.40 121.76 123.45 1n0e s ALA 101 Ca 0.37 -0.95 -0.16 0.00 0.00 0.00 0.00 51.96 51.22 1n0e s ALA 101 Cb 0.33 -1.58 0.03 0.00 0.00 0.00 0.00 23.12 21.90 1n0e s ALA 101 CO 0.01 0.78 0.36 -0.80 0.00 0.00 0.00 175.76 176.11 1n0e s ASN 102 N -2.44 -0.23 0.11 0.00 -0.87 -1.26 -4.78 114.94 105.47 1n0e s ASN 102 Ca 0.31 0.06 -0.21 0.00 -1.57 0.00 0.00 52.86 51.45 1n0e s ASN 102 Cb -0.12 0.36 -0.07 0.00 -0.02 0.00 0.00 41.25 41.39 1n0e s ASN 102 CO 0.24 -0.54 0.64 -0.36 -2.57 0.00 0.00 177.10 174.52 1n0e s PHE 103 N -1.79 3.82 -0.03 2.20 0.08 -1.26 -0.72 117.98 120.29 1n0e s PHE 103 Ca -0.10 1.38 -0.01 0.00 0.12 0.00 0.00 56.93 58.33 1n0e s PHE 103 Cb -0.03 -2.58 0.03 0.00 -0.57 0.00 0.00 43.02 39.87 1n0e s PHE 103 CO 0.02 0.55 0.06 0.08 -0.10 0.00 0.00 175.22 175.83 1n0e s VAL 104 N -1.16 -0.05 0.06 -0.44 1.01 0.11 -4.95 120.40 114.98 1n0e s VAL 104 Ca 0.32 0.18 -0.25 0.00 0.00 0.00 0.00 61.98 62.22 1n0e s VAL 104 Cb -0.20 -0.12 -0.06 0.00 0.00 0.00 0.00 36.38 36.00 1n0e s VAL 104 CO 0.21 0.07 0.78 -1.81 0.00 0.00 0.00 175.10 174.35 1n0e s ASP 105 N 0.94 7.25 -0.40 3.32 1.01 -1.26 -0.58 116.67 126.96 1n0e s ASP 105 Ca -0.08 1.49 -0.25 0.00 0.71 0.00 0.00 52.55 54.42 1n0e s ASP 105 Cb -0.11 -2.48 0.02 0.00 1.01 0.00 0.00 42.92 41.36 1n0e s ASP 105 CO -0.03 0.03 0.91 -0.69 0.21 0.00 0.00 175.17 175.60 1n0e s VAL 106 N -0.18 4.56 1.25 -1.27 1.01 0.17 -4.61 120.40 121.34 1n0e s VAL 106 Ca 0.39 1.01 -0.18 0.00 0.00 0.00 0.00 61.98 63.19 1n0e s VAL 106 Cb -0.21 -4.35 0.31 0.00 0.00 0.00 0.00 36.38 32.12 1n0e s VAL 106 CO 0.24 -0.62 1.02 1.51 0.00 0.00 0.00 175.10 177.24 1n0e s ASP 107 N 2.00 0.38 0.36 3.32 3.84 -0.52 -4.78 116.67 121.27 1n0e s ASP 107 Ca 0.37 0.99 0.12 0.00 -0.00 0.00 0.00 52.55 54.03 1n0e s ASP 107 Cb -0.11 -1.47 0.91 0.00 -1.38 0.00 0.00 42.92 40.86 1n0e s ASP 107 CO 0.21 -4.50 1.82 0.71 -0.00 0.00 0.00 175.17 173.42 1n0e h THR 108 N -2.83 0.71 -0.09 2.11 1.35 -1.95 -0.46 112.91 111.75 1n0e h THR 108 Ca -0.50 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 1n0e h THR 108 Cb 1.33 0.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 1n0e h THR 108 CO 0.39 0.11 0.00 0.00 -0.25 0.00 0.00 175.52 175.77 1n0e n ALA 109 N -2.43 2.55 -1.02 6.62 0.00 -1.26 -4.88 120.51 120.08 1n0e n ALA 109 Ca 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 53.44 53.36 1n0e n ALA 109 Cb 0.62 -1.16 -0.00 0.00 0.00 0.00 0.00 19.45 18.91 1n0e n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n0e n GLY 110 N 0.88 0.46 3.89 0.00 0.00 -0.18 -4.82 105.19 105.41 1n0e n GLY 110 Ca 0.12 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 1n0e n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n0e s ARG 111 N -1.55 3.73 -0.08 1.61 0.52 -1.26 -0.82 118.95 121.09 1n0e s ARG 111 Ca 0.00 0.14 0.01 0.00 -0.52 0.00 0.00 55.73 55.37 1n0e s ARG 111 Cb 0.00 -2.68 0.02 0.00 0.52 0.00 0.00 34.95 32.81 1n0e s ARG 111 CO 0.00 0.32 -0.10 0.08 0.02 0.00 0.00 175.30 175.62 1n0e s VAL 112 N -1.85 1.05 -0.38 3.52 1.01 -0.48 -1.44 120.40 121.83 1n0e s VAL 112 Ca 0.45 -0.39 -0.21 0.00 0.00 0.00 0.00 61.98 61.84 1n0e s VAL 112 Cb -0.11 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.27 1n0e s VAL 112 CO 0.24 0.35 0.65 -0.22 0.00 0.00 0.00 175.10 176.12 1n0e s LEU 113 N 1.02 4.30 -0.07 3.92 0.20 -1.26 -1.82 118.68 124.98 1n0e s LEU 113 Ca -0.08 0.03 -0.29 0.00 0.69 0.00 0.00 54.13 54.48 1n0e s LEU 113 Cb -0.15 -2.79 -0.02 0.00 -0.43 0.00 0.00 46.19 42.80 1n0e s LEU 113 CO -0.00 -0.66 0.97 -0.63 -0.29 0.00 0.00 176.35 175.73 1n0e s ILE 114 N 2.79 4.84 0.53 6.68 1.01 -0.57 -4.98 121.20 131.50 1n0e s ILE 114 Ca 0.25 1.99 -0.21 0.00 0.00 0.00 0.00 60.65 62.67 1n0e s ILE 114 Cb -0.14 -4.29 -0.06 0.00 0.01 0.00 0.00 42.46 37.98 1n0e s ILE 114 CO 0.16 0.08 1.14 -2.65 0.00 0.00 0.00 174.94 173.67 1n0e n PRO 115 N 4.51 1.35 -0.13 2.79 -0.02 -1.26 -4.74 135.00 137.49 1n0e n PRO 115 Ca 0.07 0.50 -0.08 0.00 -2.02 0.00 0.00 63.50 61.97 1n0e n PRO 115 Cb 0.50 -2.31 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 1n0e n PRO 115 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1n0e h ASN 116 N 1.14 -1.16 -0.56 2.55 2.35 -1.98 0.36 115.58 118.28 1n0e h ASN 116 Ca -0.48 0.20 0.09 0.00 -0.55 0.00 0.00 56.30 55.56 1n0e h ASN 116 Cb 1.33 0.54 -0.07 0.00 0.05 0.00 0.00 38.32 40.17 1n0e h ASN 116 CO 0.55 -0.33 0.17 -0.55 -1.65 0.00 0.00 177.43 175.62 1n0e h ASN 117 N -0.26 0.13 -0.16 5.81 -0.00 -2.00 -1.79 115.58 117.31 1n0e h ASN 117 Ca 0.17 0.08 -0.13 0.00 -0.00 0.00 0.00 56.30 56.43 1n0e h ASN 117 Cb 0.55 0.09 -0.01 0.00 -0.00 0.00 0.00 38.32 38.94 1n0e h ASN 117 CO -0.56 0.09 -0.33 -0.07 -0.00 0.00 0.00 177.43 176.56 1n0e h LEU 118 N 0.33 0.69 -0.70 6.14 4.07 -1.66 -0.99 115.31 123.20 1n0e h LEU 118 Ca 0.28 -0.28 0.06 0.00 0.08 0.00 0.00 57.88 58.02 1n0e h LEU 118 Cb 0.36 -0.19 -0.06 0.00 1.08 0.00 0.00 40.66 41.85 1n0e h LEU 118 CO -0.31 0.97 0.39 0.40 -1.08 0.00 0.00 178.44 178.81 1n0e h ILE 119 N 0.56 0.97 -0.20 1.22 1.08 -0.23 -1.46 117.51 119.45 1n0e h ILE 119 Ca 0.06 -0.25 -0.09 0.00 -0.39 0.00 0.00 64.86 64.20 1n0e h ILE 119 Cb 0.83 0.18 -0.00 0.00 -3.07 0.00 0.00 36.82 34.76 1n0e h ILE 119 CO 0.07 0.13 -0.21 0.78 -0.69 0.00 0.00 178.15 178.24 1n0e h ASN 120 N 0.72 0.54 -0.64 1.72 2.35 -1.09 0.66 115.58 119.84 1n0e h ASN 120 Ca 0.32 -0.48 0.02 0.00 -0.55 0.00 0.00 56.30 55.60 1n0e h ASN 120 Cb 0.20 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 1n0e h ASN 120 CO -0.19 0.90 0.43 0.44 -1.65 0.00 0.00 177.43 177.36 1n0e h ASP 121 N 0.18 0.71 -0.53 5.81 3.32 -0.80 -1.75 116.42 123.36 1n0e h ASP 121 Ca 0.03 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1n0e h ASP 121 Cb 0.75 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1n0e h ASP 121 CO 0.05 0.50 0.00 0.00 -1.72 0.00 0.00 179.24 178.07 1n0e n ALA 122 N -2.44 2.42 -3.60 3.45 0.00 -0.58 -4.79 120.51 114.96 1n0e n ALA 122 Ca 0.07 -1.02 -0.27 0.00 0.00 0.00 0.00 53.44 52.22 1n0e n ALA 122 Cb 0.07 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1n0e n ALA 122 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1n0e n LYS 123 N 1.28 -3.87 -2.24 0.00 4.76 -0.66 -4.33 118.16 113.11 1n0e n LYS 123 Ca 0.20 0.50 -0.42 0.00 -2.87 0.00 0.00 58.31 55.73 1n0e n LYS 123 Cb 0.53 -5.26 -0.03 0.00 -1.84 0.00 0.00 35.03 28.42 1n0e n LYS 123 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1n0e s LEU 124 N -6.79 4.38 0.00 -0.35 1.02 0.15 -4.82 118.68 112.27 1n0e s LEU 124 Ca 0.51 2.28 0.00 0.00 0.02 0.00 0.00 54.13 56.94 1n0e s LEU 124 Cb -0.27 -3.59 0.00 0.00 0.02 0.00 0.00 46.19 42.35 1n0e s LEU 124 CO 0.63 -0.58 0.00 -0.67 0.02 0.00 0.00 176.35 175.75 1n0e n ASP 125 N 3.59 0.00 -3.71 2.29 2.03 -1.26 -4.81 116.55 114.67 1n0e n ASP 125 Ca 0.09 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.29 1n0e n ASP 125 Cb 0.43 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.73 1n0e n ASP 125 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1n0e s LYS 126 N -0.07 0.47 0.00 -0.67 2.20 -1.26 -4.66 119.74 115.75 1n0e s LYS 126 Ca 0.00 0.69 0.00 0.00 -0.36 0.00 0.00 55.97 56.30 1n0e s LYS 126 Cb 0.00 0.14 0.00 0.00 -1.51 0.00 0.00 37.83 36.46 1n0e s LYS 126 CO 0.00 -0.10 0.00 0.39 -0.36 0.00 0.00 175.35 175.28 1n0e n GLU 127 N 3.43 0.00 -4.22 4.03 1.02 -1.26 -4.81 120.64 118.83 1n0e n GLU 127 Ca -0.17 0.31 -0.25 0.00 -0.02 0.00 0.00 57.16 57.03 1n0e n GLU 127 Cb 0.56 -0.63 -0.07 0.00 -0.02 0.00 0.00 31.44 31.29 1n0e n GLU 127 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1n0e s ILE 128 N 0.00 3.75 -0.14 -3.67 -1.09 0.29 -1.62 121.20 118.72 1n0e s ILE 128 Ca 0.00 -1.57 -0.00 0.00 -2.23 0.00 0.00 60.65 56.85 1n0e s ILE 128 Cb 0.00 -2.94 0.03 0.00 -1.58 0.00 0.00 42.46 37.97 1n0e s ILE 128 CO 0.00 -0.22 -0.08 -0.69 -1.23 0.00 0.00 174.94 172.71 1n0e s VAL 129 N -1.97 1.17 -0.21 2.92 1.01 0.28 -0.72 120.40 122.88 1n0e s VAL 129 Ca 0.29 -0.47 -0.09 0.00 0.00 0.00 0.00 61.98 61.71 1n0e s VAL 129 Cb -0.08 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1n0e s VAL 129 CO 0.20 0.31 0.11 -0.76 0.00 0.00 0.00 175.10 174.96 1n0e s LEU 130 N 1.63 3.92 -0.08 3.92 1.43 0.14 -0.44 118.68 129.19 1n0e s LEU 130 Ca 0.04 0.07 0.04 0.00 -1.03 0.00 0.00 54.13 53.25 1n0e s LEU 130 Cb -0.13 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.06 1n0e s LEU 130 CO -0.09 0.11 -0.22 0.27 0.23 0.00 0.00 176.35 176.65 1n0e s ILE 131 N 0.77 1.88 0.17 -0.59 -4.36 -0.79 0.67 121.20 118.96 1n0e s ILE 131 Ca 0.05 -0.93 -0.30 0.00 -0.26 0.00 0.00 60.65 59.22 1n0e s ILE 131 Cb -0.13 -1.62 -0.07 0.00 1.25 0.00 0.00 42.46 41.88 1n0e s ILE 131 CO 0.02 0.52 1.07 -0.83 0.24 0.00 0.00 174.94 175.96 1n0e s GLY 132 N 0.29 2.89 -0.22 6.27 0.00 0.25 -1.71 107.32 115.09 1n0e s GLY 132 Ca -0.15 0.76 0.12 0.00 0.00 0.00 0.00 44.72 45.46 1n0e s GLY 132 CO 0.07 1.59 1.19 -1.06 0.00 0.00 0.00 173.10 174.89 1n0e n GLN 133 N 2.36 2.22 0.00 2.90 1.13 0.71 -4.33 117.38 122.38 1n0e n GLN 133 Ca 0.02 -3.53 0.00 0.00 -1.94 0.00 0.00 57.00 51.56 1n0e n GLN 133 Cb 0.47 -1.71 0.00 0.00 0.11 0.00 0.00 30.24 29.11 1n0e n GLN 133 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1n0e n PHE 134 N -0.74 0.00 -0.08 1.08 7.35 0.42 -3.33 117.46 122.16 1n0e n PHE 134 Ca 0.26 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.83 1n0e n PHE 134 Cb 0.86 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 40.64 1n0e n PHE 134 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1n0e h ASP 135 N 0.00 0.43 -3.51 -2.13 3.32 -1.95 -2.14 116.42 110.44 1n0e h ASP 135 Ca 0.00 -0.35 -0.25 0.00 0.02 0.00 0.00 57.03 56.45 1n0e h ASP 135 Cb 0.00 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.37 1n0e h ASP 135 CO 0.00 0.68 -0.24 0.00 -1.72 0.00 0.00 179.24 177.97 1n0e n HIS 136 N -4.60 -0.27 -4.48 4.55 1.44 -1.21 -4.78 115.22 105.87 1n0e n HIS 136 Ca -0.04 -1.39 -0.21 0.00 -2.01 0.00 0.00 57.72 54.07 1n0e n HIS 136 Cb 0.28 0.11 -0.14 0.00 0.12 0.00 0.00 29.99 30.35 1n0e n HIS 136 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 1n0e s LEU 137 N 0.00 2.12 -0.01 2.39 0.20 -0.20 -0.21 118.68 122.97 1n0e s LEU 137 Ca 0.17 -0.39 0.06 0.00 0.69 0.00 0.00 54.13 54.66 1n0e s LEU 137 Cb 0.01 -0.67 -0.03 0.00 -0.43 0.00 0.00 46.19 45.07 1n0e s LEU 137 CO 0.12 0.09 -0.18 -1.61 -0.29 0.00 0.00 176.35 174.49 1n0e s GLU 138 N -0.85 2.27 -0.23 1.98 2.02 -0.69 0.62 118.70 123.83 1n0e s GLU 138 Ca 0.03 -0.84 -0.06 0.00 0.02 0.00 0.00 54.97 54.12 1n0e s GLU 138 Cb -0.07 -2.25 -0.03 0.00 0.10 0.00 0.00 34.13 31.88 1n0e s GLU 138 CO 0.01 0.58 0.03 0.42 0.02 0.00 0.00 175.26 176.32 1n0e s ILE 139 N -0.79 4.11 0.16 -1.63 1.01 -0.42 -1.88 121.20 121.76 1n0e s ILE 139 Ca 0.13 -0.25 0.09 0.00 0.00 0.00 0.00 60.65 60.62 1n0e s ILE 139 Cb -0.10 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 1n0e s ILE 139 CO 0.02 0.38 -0.20 0.26 0.00 0.00 0.00 174.94 175.40 1n0e s TRP 140 N 1.35 1.92 0.02 3.97 0.52 0.41 -4.11 118.94 123.02 1n0e s TRP 140 Ca 0.05 -0.43 -0.30 0.00 0.02 0.00 0.00 56.10 55.43 1n0e s TRP 140 Cb -0.15 -0.98 -0.04 0.00 -1.15 0.00 0.00 33.47 31.16 1n0e s TRP 140 CO 0.02 0.34 1.03 0.34 0.02 0.00 0.00 176.95 178.70 1n0e s ASP 141 N -2.50 7.31 0.22 2.95 2.15 -1.26 -0.56 116.67 124.98 1n0e s ASP 141 Ca 0.15 1.75 -0.11 0.00 0.43 0.00 0.00 52.55 54.77 1n0e s ASP 141 Cb -0.07 -2.57 0.31 0.00 -0.30 0.00 0.00 42.92 40.29 1n0e s ASP 141 CO 0.07 -0.30 1.64 0.50 -0.17 0.00 0.00 175.17 176.91 1n0e h LYS 142 N 6.74 0.07 0.69 4.34 3.64 -1.60 -1.60 116.57 128.84 1n0e h LYS 142 Ca -0.41 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 58.94 1n0e h LYS 142 Cb 1.22 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1n0e h LYS 142 CO 0.76 0.04 -0.46 -0.22 -2.27 0.00 0.00 179.45 177.30 1n0e h LYS 143 N 0.07 -1.06 -0.98 1.90 1.63 -1.91 -2.09 116.57 114.13 1n0e h LYS 143 Ca 0.34 0.07 0.18 0.00 -0.85 0.00 0.00 60.65 60.39 1n0e h LYS 143 Cb 0.56 0.24 -0.10 0.00 -0.60 0.00 0.00 32.23 32.32 1n0e h LYS 143 CO -0.61 -0.70 0.59 -0.07 -3.45 0.00 0.00 179.45 175.20 1n0e h LEU 144 N -1.10 0.77 0.18 5.20 4.07 -1.87 -0.50 115.31 122.06 1n0e h LEU 144 Ca -0.09 0.09 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1n0e h LEU 144 Cb 0.90 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.59 1n0e h LEU 144 CO 0.06 0.29 -0.09 0.22 -1.08 0.00 0.00 178.44 177.85 1n0e h TYR 145 N 0.77 -0.22 -0.65 1.13 3.20 -1.11 0.84 116.97 120.93 1n0e h TYR 145 Ca 0.55 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.49 1n0e h TYR 145 Cb 0.81 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 39.12 1n0e h TYR 145 CO -0.02 0.01 0.43 0.93 -1.64 0.00 0.00 178.16 177.88 1n0e h GLU 146 N -0.43 0.60 -0.41 1.82 5.08 -0.67 0.28 114.58 120.85 1n0e h GLU 146 Ca -0.02 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.15 1n0e h GLU 146 Cb 0.33 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1n0e h GLU 146 CO 0.04 0.39 -0.34 -0.44 -1.00 0.00 0.00 179.01 177.67 1n0e h ASP 147 N 0.61 0.99 -0.10 1.42 3.32 -0.83 0.44 116.42 122.28 1n0e h ASP 147 Ca 0.29 -0.43 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1n0e h ASP 147 Cb 0.33 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1n0e h ASP 147 CO -0.09 1.23 0.07 0.22 -1.72 0.00 0.00 179.24 178.94 1n0e h TYR 148 N 0.78 0.13 -0.70 4.55 3.20 0.16 -0.07 116.97 125.02 1n0e h TYR 148 Ca 0.08 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 1n0e h TYR 148 Cb 0.92 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.12 1n0e h TYR 148 CO 0.06 0.09 0.20 -0.07 -1.64 0.00 0.00 178.16 176.79 1n0e h LEU 149 N 0.13 1.04 -0.17 2.82 4.07 -0.40 -2.99 115.31 119.81 1n0e h LEU 149 Ca 0.04 -0.22 0.04 0.00 0.08 0.00 0.00 57.88 57.82 1n0e h LEU 149 Cb -0.01 -0.27 -0.04 0.00 1.08 0.00 0.00 40.66 41.42 1n0e h LEU 149 CO -0.01 0.98 -0.08 0.00 -1.08 0.00 0.00 178.44 178.25 1n0e h ALA 150 N 1.09 0.07 -3.00 1.53 0.00 0.41 -3.39 119.26 115.97 1n0e h ALA 150 Ca 0.22 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1n0e h ALA 150 Cb 0.33 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1n0e h ALA 150 CO -0.00 -0.52 0.00 0.09 0.00 0.00 0.00 179.25 178.82 1n0e n ASN 151 N -5.23 0.00 -1.42 0.00 3.02 -0.09 -4.98 115.26 106.57 1n0e n ASN 151 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.52 1n0e n ASN 151 Cb 0.15 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1n0e n ASN 151 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1n0e n SER 152 N 0.00 -6.48 -3.79 6.41 2.88 -1.21 -4.92 113.62 106.52 1n0e n SER 152 Ca 0.00 0.87 -0.30 0.00 -1.33 0.00 0.00 58.87 58.11 1n0e n SER 152 Cb 0.00 -3.40 0.25 0.00 -0.75 0.00 0.00 64.21 60.31 1n0e n SER 152 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1n0e s GLU 153 N -1.82 -1.59 0.88 -1.46 2.02 -1.26 -5.01 118.70 110.45 1n0e s GLU 153 Ca 0.00 0.04 -0.11 0.00 0.02 0.00 0.00 54.97 54.92 1n0e s GLU 153 Cb 0.00 -1.54 0.12 0.00 0.10 0.00 0.00 34.13 32.80 1n0e s GLU 153 CO 0.00 -3.97 1.09 -1.54 0.02 0.00 0.00 175.26 170.86 1n0e s SER 154 N -3.63 3.68 0.13 -0.19 1.04 -1.26 -4.85 113.70 108.63 1n0e s SER 154 Ca 0.70 1.46 -0.16 0.00 0.48 0.00 0.00 55.95 58.43 1n0e s SER 154 Cb -0.12 -2.15 -0.01 0.00 0.10 0.00 0.00 66.02 63.85 1n0e s SER 154 CO 0.57 -2.50 1.70 0.25 0.98 0.00 0.00 173.24 174.24 1n0e h LEU 155 N -1.45 0.52 -0.53 2.42 5.85 -1.99 -1.71 115.31 118.41 1n0e h LEU 155 Ca -0.49 -0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.01 1n0e h LEU 155 Cb 1.28 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.16 1n0e h LEU 155 CO 0.55 0.52 0.01 -0.33 -0.34 0.00 0.00 178.44 178.85 1n0e h GLU 156 N 0.49 0.92 0.50 1.25 3.07 -1.98 -1.45 114.58 117.37 1n0e h GLU 156 Ca 0.13 -0.29 -0.02 0.00 -0.50 0.00 0.00 59.36 58.68 1n0e h GLU 156 Cb 0.14 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1n0e h GLU 156 CO -0.01 0.94 -0.24 1.15 -1.40 0.00 0.00 179.01 179.44 1n0e h THR 157 N 0.79 0.50 -0.26 1.13 2.02 -1.90 -0.39 112.91 114.82 1n0e h THR 157 Ca 0.15 -0.10 0.02 0.00 0.77 0.00 0.00 66.41 67.25 1n0e h THR 157 Cb 0.52 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1n0e h THR 157 CO 0.03 0.02 0.13 0.58 0.37 0.00 0.00 175.52 176.64 1n0e h VAL 158 N -0.73 1.00 -0.90 3.16 2.07 -1.34 -2.72 116.25 116.78 1n0e h VAL 158 Ca -0.07 -0.09 0.04 0.00 0.82 0.00 0.00 66.70 67.40 1n0e h VAL 158 Cb 0.54 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 1n0e h VAL 158 CO 0.11 0.05 0.58 0.00 0.02 0.00 0.00 177.57 178.33 1n0e h ALA 159 N 1.13 1.21 -0.03 1.67 0.00 -1.20 -1.95 119.26 120.09 1n0e h ALA 159 Ca 0.10 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1n0e h ALA 159 Cb 0.03 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1n0e h ALA 159 CO -0.07 0.41 0.03 1.49 0.00 0.00 0.00 179.25 181.11 1n0e h GLU 160 N 1.10 0.00 -0.00 0.00 4.57 -0.74 -1.65 114.58 117.86 1n0e h GLU 160 Ca 0.37 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.55 1n0e h GLU 160 Cb 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.65 1n0e h GLU 160 CO -0.14 0.00 -0.13 0.54 -1.18 0.00 0.00 179.01 178.11 1n0e n ARG 161 N -4.11 0.06 0.00 1.92 1.74 -0.73 -5.12 116.66 110.42 1n0e n ARG 161 Ca -0.02 -0.01 0.04 0.00 -0.77 0.00 0.00 57.85 57.08 1n0e n ARG 161 Cb 0.12 -1.50 0.22 0.00 -1.02 0.00 0.00 32.46 30.29 1n0e n ARG 161 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78