#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s3s n ASN 24 N 0.00 6.09 -4.32 2.55 0.23 -1.26 -4.93 115.26 113.62 1s3s n ASN 24 Ca 0.00 -3.75 -0.34 0.00 -0.53 0.00 0.00 54.58 49.96 1s3s n ASN 24 Cb 0.00 -0.83 -0.14 0.00 -2.08 0.00 0.00 39.78 36.73 1s3s n ASN 24 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1s3s s ARG 25 N -3.65 3.36 0.03 -3.83 0.52 -1.26 -1.63 118.95 112.51 1s3s s ARG 25 Ca 0.60 -0.66 -0.02 0.00 -0.52 0.00 0.00 55.73 55.13 1s3s s ARG 25 Cb 0.48 -2.84 -0.02 0.00 0.52 0.00 0.00 34.95 33.09 1s3s s ARG 25 CO 0.02 -0.04 -0.00 -0.48 0.02 0.00 0.00 175.30 174.82 1s3s s LEU 26 N 1.02 2.22 -0.21 2.53 2.34 -0.93 -4.95 118.68 120.71 1s3s s LEU 26 Ca -0.00 -0.67 -0.20 0.00 0.06 0.00 0.00 54.13 53.32 1s3s s LEU 26 Cb -0.15 0.25 -0.03 0.00 -0.56 0.00 0.00 46.19 45.71 1s3s s LEU 26 CO -0.01 -0.45 0.58 -0.63 -1.06 0.00 0.00 176.35 174.78 1s3s s ILE 27 N -2.52 5.05 -0.23 1.48 1.01 -0.53 -1.02 121.20 124.44 1s3s s ILE 27 Ca -0.06 1.07 -0.29 0.00 0.00 0.00 0.00 60.65 61.37 1s3s s ILE 27 Cb -0.02 -3.90 -0.03 0.00 0.01 0.00 0.00 42.46 38.53 1s3s s ILE 27 CO -0.05 0.12 1.69 0.54 0.00 0.00 0.00 174.94 177.25 1s3s s VAL 28 N 1.91 3.60 0.08 2.92 0.11 -0.88 -1.30 120.40 126.83 1s3s s VAL 28 Ca 0.26 0.66 0.01 0.00 -2.93 0.00 0.00 61.98 59.98 1s3s s VAL 28 Cb -0.16 -3.64 0.01 0.00 -1.53 0.00 0.00 36.38 31.06 1s3s s VAL 28 CO 0.10 -0.30 0.08 -0.67 -3.33 0.00 0.00 175.10 170.97 1s3s n ASP 29 N 8.91 0.89 -4.87 3.54 2.03 -0.21 0.31 116.55 127.16 1s3s n ASP 29 Ca 0.20 -1.24 -0.31 0.00 0.52 0.00 0.00 54.79 53.96 1s3s n ASP 29 Cb 0.45 -0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.83 1s3s n ASP 29 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1s3s s GLU 30 N -2.33 3.66 0.10 -0.67 2.02 -1.26 -3.73 118.70 116.49 1s3s s GLU 30 Ca 0.06 0.77 0.01 0.00 0.02 0.00 0.00 54.97 55.84 1s3s s GLU 30 Cb -0.00 -2.10 -0.04 0.00 0.10 0.00 0.00 34.13 32.09 1s3s s GLU 30 CO 0.04 -0.51 0.24 0.00 0.02 0.00 0.00 175.26 175.04 1s3s s ALA 31 N -3.08 3.96 -0.21 5.21 0.00 -1.12 -3.91 121.76 122.62 1s3s s ALA 31 Ca 0.56 -0.94 0.08 0.00 0.00 0.00 0.00 51.96 51.65 1s3s s ALA 31 Cb -0.11 -1.78 -0.18 0.00 0.00 0.00 0.00 23.12 21.05 1s3s s ALA 31 CO 0.50 0.69 -0.09 -0.89 0.00 0.00 0.00 175.76 175.96 1s3s n ILE 32 N -0.10 1.29 -3.10 0.00 2.08 -1.26 -4.87 119.36 113.39 1s3s n ILE 32 Ca -0.06 -0.61 -0.39 0.00 0.56 0.00 0.00 62.75 62.24 1s3s n ILE 32 Cb 0.52 -0.99 -0.05 0.00 -0.75 0.00 0.00 39.64 38.37 1s3s n ILE 32 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1s3s s ASN 33 N -5.82 7.08 -0.48 4.38 3.84 -1.26 -4.97 114.94 117.71 1s3s s ASN 33 Ca -0.22 1.29 -0.01 0.00 0.21 0.00 0.00 52.86 54.13 1s3s s ASN 33 Cb 0.07 -2.41 0.32 0.00 -0.55 0.00 0.00 41.25 38.68 1s3s s ASN 33 CO 0.62 0.06 2.02 -0.62 -2.79 0.00 0.00 177.10 176.39 1s3s n GLU 34 N 2.76 2.20 -4.25 0.43 -0.58 -1.26 -4.73 120.64 115.21 1s3s n GLU 34 Ca -0.05 -2.35 -0.35 0.00 -0.42 0.00 0.00 57.16 53.99 1s3s n GLU 34 Cb 0.51 -1.92 -0.09 0.00 -0.57 0.00 0.00 31.44 29.36 1s3s n GLU 34 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1s3s s ASP 35 N -0.73 5.39 0.00 1.62 -1.08 -1.26 -5.00 116.67 115.61 1s3s s ASP 35 Ca 0.46 0.14 0.00 0.00 -0.52 0.00 0.00 52.55 52.63 1s3s s ASP 35 Cb 0.36 -1.68 0.00 0.00 -1.46 0.00 0.00 42.92 40.15 1s3s s ASP 35 CO -0.01 0.32 0.83 0.59 0.52 0.00 0.00 175.17 177.42 1s3s n ASN 36 N 2.57 0.12 0.00 -0.34 3.02 -1.26 -2.69 115.26 116.68 1s3s n ASN 36 Ca -0.18 -1.78 0.00 0.00 -0.03 0.00 0.00 54.58 52.59 1s3s n ASN 36 Cb 0.53 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 1s3s n ASN 36 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1s3s n SER 37 N -0.43 0.34 -4.74 6.41 7.64 -1.26 -4.47 113.62 117.11 1s3s n SER 37 Ca 0.00 -1.12 -0.36 0.00 1.01 0.00 0.00 58.87 58.40 1s3s n SER 37 Cb 0.03 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.15 1s3s n SER 37 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1s3s s VAL 38 N -0.12 4.76 -0.04 0.44 1.01 -1.09 0.13 120.40 125.48 1s3s s VAL 38 Ca 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 61.92 1s3s s VAL 38 Cb 0.00 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.35 1s3s s VAL 38 CO 0.00 0.60 -0.07 0.68 0.00 0.00 0.00 175.10 176.31 1s3s s VAL 39 N -0.81 0.69 -0.08 2.92 -7.23 0.37 -4.48 120.40 111.78 1s3s s VAL 39 Ca 0.13 -0.26 0.01 0.00 -1.81 0.00 0.00 61.98 60.05 1s3s s VAL 39 Cb -0.12 -0.66 -0.03 0.00 0.56 0.00 0.00 36.38 36.14 1s3s s VAL 39 CO 0.03 0.24 -0.10 -0.55 -0.31 0.00 0.00 175.10 174.41 1s3s s SER 40 N 0.56 4.36 0.45 4.85 0.15 -0.54 -0.95 113.70 122.58 1s3s s SER 40 Ca -0.09 -0.15 0.03 0.00 0.70 0.00 0.00 55.95 56.45 1s3s s SER 40 Cb -0.12 -1.23 -0.02 0.00 -1.71 0.00 0.00 66.02 62.94 1s3s s SER 40 CO 0.01 0.30 0.07 -0.76 1.20 0.00 0.00 173.24 174.05 1s3s s LEU 41 N -0.42 2.17 0.10 3.45 1.43 -1.00 0.07 118.68 124.48 1s3s s LEU 41 Ca 0.06 -1.64 -0.18 0.00 -1.03 0.00 0.00 54.13 51.33 1s3s s LEU 41 Cb -0.12 -0.43 -0.07 0.00 0.03 0.00 0.00 46.19 45.60 1s3s s LEU 41 CO 0.02 -0.87 0.57 -0.94 0.23 0.00 0.00 176.35 175.37 1s3s s SER 42 N -3.73 7.00 0.24 2.29 1.04 -1.26 -1.24 113.70 118.04 1s3s s SER 42 Ca 0.17 1.22 -0.16 0.00 0.48 0.00 0.00 55.95 57.65 1s3s s SER 42 Cb 0.03 -2.34 0.27 0.00 0.10 0.00 0.00 66.02 64.07 1s3s s SER 42 CO 0.10 0.21 1.56 -0.61 0.98 0.00 0.00 173.24 175.48 1s3s h GLN 43 N 4.19 -0.01 -0.04 4.02 5.75 -1.88 -0.10 115.11 127.04 1s3s h GLN 43 Ca -0.49 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.01 1s3s h GLN 43 Cb 1.21 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.76 1s3s h GLN 43 CO 0.64 -0.01 0.01 -1.35 -2.65 0.00 0.00 178.83 175.48 1s3s h PRO 44 N -0.01 0.05 -0.12 -2.39 0.11 -1.94 -2.23 132.00 125.48 1s3s h PRO 44 Ca 0.36 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 66.49 1s3s h PRO 44 Cb 0.61 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.71 1s3s h PRO 44 CO -0.96 0.20 0.10 -0.22 -0.21 0.00 0.00 178.00 176.91 1s3s h LYS 45 N -0.10 0.00 0.06 1.05 3.11 -1.55 0.56 116.57 119.70 1s3s h LYS 45 Ca 0.01 0.00 -0.26 0.00 -2.81 0.00 0.00 60.65 57.59 1s3s h LYS 45 Cb 0.16 0.00 0.02 0.00 -1.00 0.00 0.00 32.23 31.42 1s3s h LYS 45 CO -0.00 0.00 -1.05 0.52 -2.81 0.00 0.00 179.45 176.11 1s3s h MET 46 N 0.00 0.60 -0.49 1.90 2.86 -0.83 -3.26 114.93 115.70 1s3s h MET 46 Ca 0.06 -0.73 -0.10 0.00 -2.06 0.00 0.00 59.70 56.87 1s3s h MET 46 Cb 0.26 0.23 -0.02 0.00 0.06 0.00 0.00 31.60 32.13 1s3s h MET 46 CO -0.00 1.31 -0.10 -0.44 1.06 0.00 0.00 176.91 178.74 1s3s h ASP 47 N 0.21 0.89 0.48 1.22 5.19 -0.58 0.25 116.42 124.08 1s3s h ASP 47 Ca -0.15 -0.28 -0.01 0.00 -0.62 0.00 0.00 57.03 55.97 1s3s h ASP 47 Cb 1.73 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 40.98 1s3s h ASP 47 CO 0.20 1.01 -0.47 -0.08 -3.12 0.00 0.00 179.24 176.78 1s3s h GLU 48 N 0.80 -0.91 0.00 3.56 4.81 -1.03 0.46 114.58 122.28 1s3s h GLU 48 Ca 0.13 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1s3s h GLU 48 Cb 0.62 0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.21 1s3s h GLU 48 CO 0.04 -0.61 0.00 1.28 -0.73 0.00 0.00 179.01 178.99 1s3s n LEU 49 N -5.29 0.66 -2.53 1.64 4.77 -1.23 -4.96 117.00 110.06 1s3s n LEU 49 Ca -0.11 0.63 -0.05 0.00 -0.03 0.00 0.00 56.01 56.45 1s3s n LEU 49 Cb 0.43 -0.51 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 1s3s n LEU 49 CO 0.25 -0.45 -0.64 0.00 -1.33 0.00 0.00 177.39 175.22 1s3s n GLN 50 N -2.19 -4.64 -3.86 3.23 1.13 0.62 -5.08 117.38 106.58 1s3s n GLN 50 Ca 0.03 3.47 -0.10 0.00 -1.94 0.00 0.00 57.00 58.47 1s3s n GLN 50 Cb 0.27 -4.95 -0.08 0.00 0.11 0.00 0.00 30.24 25.59 1s3s n GLN 50 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1s3s s LEU 51 N -0.64 1.44 0.31 1.08 1.43 0.23 -4.96 118.68 117.58 1s3s s LEU 51 Ca -0.25 -0.47 0.07 0.00 -1.03 0.00 0.00 54.13 52.45 1s3s s LEU 51 Cb 0.02 0.94 -0.03 0.00 0.03 0.00 0.00 46.19 47.15 1s3s s LEU 51 CO 0.66 -0.60 0.31 -0.36 0.23 0.00 0.00 176.35 176.60 1s3s s PHE 52 N -2.95 3.02 0.30 0.29 0.40 -1.26 -4.62 117.98 113.15 1s3s s PHE 52 Ca -0.02 -0.23 0.05 0.00 -0.60 0.00 0.00 56.93 56.12 1s3s s PHE 52 Cb 0.01 -1.75 0.70 0.00 0.51 0.00 0.00 43.02 42.49 1s3s s PHE 52 CO -0.06 0.22 1.77 0.00 0.70 0.00 0.00 175.22 177.85 1s3s h ARG 53 N 1.22 0.71 0.00 0.44 -0.00 -1.96 -2.51 114.38 112.27 1s3s h ARG 53 Ca -0.46 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 58.98 1s3s h ARG 53 Cb 1.25 -0.16 0.00 0.00 0.00 0.00 0.00 29.97 31.06 1s3s h ARG 53 CO 0.58 0.47 -0.88 0.41 0.00 0.00 0.00 179.97 180.54 1s3s n GLY 54 N -1.33 -1.06 3.40 0.04 0.00 -1.26 -4.20 105.19 100.78 1s3s n GLY 54 Ca 0.22 -0.54 -0.45 0.00 0.00 0.00 0.00 46.02 45.25 1s3s n GLY 54 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1s3s n ASP 55 N -1.50 -1.32 -4.28 1.61 8.00 -0.95 -4.62 116.55 113.49 1s3s n ASP 55 Ca 0.04 1.02 -0.38 0.00 0.71 0.00 0.00 54.79 56.18 1s3s n ASP 55 Cb 0.33 -1.00 -0.12 0.00 -0.02 0.00 0.00 41.12 40.32 1s3s n ASP 55 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1s3s s THR 56 N -1.25 3.91 0.23 -3.53 -1.32 -1.26 -1.17 115.64 111.25 1s3s s THR 56 Ca 0.62 -1.19 0.05 0.00 -1.21 0.00 0.00 61.69 59.96 1s3s s THR 56 Cb -0.78 -3.26 -0.03 0.00 -1.51 0.00 0.00 72.50 66.91 1s3s s THR 56 CO 0.58 -0.26 0.30 0.68 -2.21 0.00 0.00 174.62 173.71 1s3s s VAL 57 N 1.41 5.03 -0.11 5.08 -7.23 -0.46 -2.74 120.40 121.38 1s3s s VAL 57 Ca -0.00 -1.05 -0.03 0.00 -1.81 0.00 0.00 61.98 59.08 1s3s s VAL 57 Cb -0.20 -3.70 -0.03 0.00 0.56 0.00 0.00 36.38 33.00 1s3s s VAL 57 CO 0.03 -0.29 0.02 -0.22 -0.31 0.00 0.00 175.10 174.33 1s3s s LEU 58 N -3.79 3.67 0.17 1.32 2.96 0.15 -2.33 118.68 120.83 1s3s s LEU 58 Ca 0.34 0.14 0.10 0.00 -0.22 0.00 0.00 54.13 54.49 1s3s s LEU 58 Cb -0.09 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 1s3s s LEU 58 CO 0.28 0.33 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.65 1s3s s LEU 59 N -0.58 2.41 -0.01 -0.68 1.43 -0.08 -0.96 118.68 120.21 1s3s s LEU 59 Ca 0.10 -0.84 0.01 0.00 -1.03 0.00 0.00 54.13 52.37 1s3s s LEU 59 Cb -0.12 -1.07 0.00 0.00 0.03 0.00 0.00 46.19 45.03 1s3s s LEU 59 CO 0.02 0.09 -0.03 -0.54 0.23 0.00 0.00 176.35 176.12 1s3s s LYS 60 N -2.56 0.26 0.00 1.70 1.02 -0.79 -1.93 119.74 117.44 1s3s s LYS 60 Ca 0.18 -0.08 0.00 0.00 0.02 0.00 0.00 55.97 56.08 1s3s s LYS 60 Cb -0.08 -0.28 0.00 0.00 -0.52 0.00 0.00 37.83 36.95 1s3s s LYS 60 CO 0.08 0.03 0.00 0.41 -0.92 0.00 0.00 175.35 174.96 1s3s n GLY 61 N 3.18 5.41 3.92 -3.33 0.00 -1.06 -1.90 105.19 111.41 1s3s n GLY 61 Ca -0.15 -0.85 -0.28 0.00 0.00 0.00 0.00 46.02 44.74 1s3s n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s3s s LYS 62 N 4.67 1.62 -1.51 1.61 1.02 -1.14 -4.22 119.74 121.79 1s3s s LYS 62 Ca 0.00 -0.23 -0.15 0.00 0.02 0.00 0.00 55.97 55.62 1s3s s LYS 62 Cb 0.00 -2.01 0.12 0.00 -0.52 0.00 0.00 37.83 35.43 1s3s s LYS 62 CO 0.00 -1.73 0.69 1.63 -0.92 0.00 0.00 175.35 175.03 1s3s n LYS 63 N -3.31 -3.44 -4.01 1.68 5.02 -1.26 -2.56 118.16 110.27 1s3s n LYS 63 Ca 0.11 0.42 -0.42 0.00 -2.02 0.00 0.00 58.31 56.40 1s3s n LYS 63 Cb 0.60 -5.15 0.02 0.00 -0.02 0.00 0.00 35.03 30.47 1s3s n LYS 63 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1s3s n ARG 64 N -4.15 -0.55 -4.33 1.97 1.85 -1.26 -4.97 116.66 105.22 1s3s n ARG 64 Ca 0.05 0.24 -0.21 0.00 -1.00 0.00 0.00 57.85 56.93 1s3s n ARG 64 Cb 0.51 -2.42 -0.11 0.00 -1.05 0.00 0.00 32.46 29.39 1s3s n ARG 64 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1s3s s ARG 65 N -6.84 1.28 0.22 2.89 0.52 -1.06 -5.04 118.95 110.92 1s3s s ARG 65 Ca 0.37 -1.45 0.04 0.00 -0.52 0.00 0.00 55.73 54.17 1s3s s ARG 65 Cb -0.21 -1.26 -0.05 0.00 0.52 0.00 0.00 34.95 33.95 1s3s s ARG 65 CO 0.96 0.24 -0.03 -1.21 0.02 0.00 0.00 175.30 175.28 1s3s s GLU 66 N -3.02 1.29 -0.28 3.54 2.02 -1.26 -2.55 118.70 118.44 1s3s s GLU 66 Ca 0.17 -1.63 -0.19 0.00 0.02 0.00 0.00 54.97 53.35 1s3s s GLU 66 Cb -0.04 -0.64 0.08 0.00 0.10 0.00 0.00 34.13 33.62 1s3s s GLU 66 CO 0.07 -0.05 0.72 0.00 0.02 0.00 0.00 175.26 176.01 1s3s s ALA 67 N -3.38 -1.87 -0.19 5.21 0.00 -0.81 -4.79 121.76 115.92 1s3s s ALA 67 Ca 0.26 2.31 -0.08 0.00 0.00 0.00 0.00 51.96 54.44 1s3s s ALA 67 Cb 0.05 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.75 1s3s s ALA 67 CO 0.07 -0.37 0.09 0.14 0.00 0.00 0.00 175.76 175.69 1s3s s VAL 68 N 1.27 4.98 0.28 0.00 -7.23 -1.26 -0.90 120.40 117.55 1s3s s VAL 68 Ca -0.07 0.04 -0.07 0.00 -1.81 0.00 0.00 61.98 60.07 1s3s s VAL 68 Cb -0.05 -3.26 -0.01 0.00 0.56 0.00 0.00 36.38 33.63 1s3s s VAL 68 CO -0.14 0.45 0.43 0.00 -0.31 0.00 0.00 175.10 175.53 1s3s s ILE 70 N -3.59 5.17 -0.13 0.00 -1.09 0.34 -1.35 121.20 120.55 1s3s s ILE 70 Ca 0.28 0.69 -0.05 0.00 -2.23 0.00 0.00 60.65 59.34 1s3s s ILE 70 Cb 0.00 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 37.20 1s3s s ILE 70 CO 0.14 0.54 0.04 0.54 -1.23 0.00 0.00 174.94 174.97 1s3s s VAL 71 N -0.73 4.61 0.41 2.92 0.11 -0.32 -0.48 120.40 126.92 1s3s s VAL 71 Ca 0.21 -0.12 0.04 0.00 -2.93 0.00 0.00 61.98 59.18 1s3s s VAL 71 Cb -0.15 -3.01 -0.03 0.00 -1.53 0.00 0.00 36.38 31.66 1s3s s VAL 71 CO 0.10 0.55 0.11 -0.22 -3.33 0.00 0.00 175.10 172.31 1s3s s LEU 72 N -0.35 2.03 -0.14 2.54 2.96 -0.12 -4.18 118.68 121.42 1s3s s LEU 72 Ca 0.08 -1.64 -0.01 0.00 -0.22 0.00 0.00 54.13 52.34 1s3s s LEU 72 Cb -0.12 -0.18 -0.01 0.00 0.50 0.00 0.00 46.19 46.37 1s3s s LEU 72 CO 0.02 -0.89 -0.12 -0.94 -1.32 0.00 0.00 176.35 173.10 1s3s s SER 73 N -3.61 4.07 0.03 3.68 1.04 -1.26 -2.38 113.70 115.26 1s3s s SER 73 Ca 0.24 -0.32 0.07 0.00 0.48 0.00 0.00 55.95 56.42 1s3s s SER 73 Cb 0.03 -1.63 -0.02 0.00 0.10 0.00 0.00 66.02 64.50 1s3s s SER 73 CO 0.14 0.15 -0.21 -0.62 0.98 0.00 0.00 173.24 173.68 1s3s s ASP 74 N 0.43 2.48 -0.40 7.02 -1.08 -0.37 -4.94 116.67 119.82 1s3s s ASP 74 Ca -0.09 -0.49 0.05 0.00 -0.52 0.00 0.00 52.55 51.50 1s3s s ASP 74 Cb -0.16 -0.22 0.58 0.00 -1.46 0.00 0.00 42.92 41.66 1s3s s ASP 74 CO 0.05 0.18 1.73 -0.67 0.52 0.00 0.00 175.17 176.98 1s3s n ASP 75 N 2.00 3.61 0.00 -0.34 -0.08 -1.26 -3.53 116.55 116.95 1s3s n ASP 75 Ca -0.17 -3.71 0.00 0.00 -1.51 0.00 0.00 54.79 49.41 1s3s n ASP 75 Cb 0.53 -0.76 0.00 0.00 2.34 0.00 0.00 41.12 43.24 1s3s n ASP 75 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1s3s n THR 76 N -1.11 0.09 -3.43 5.18 -2.24 -1.26 -5.05 114.28 106.46 1s3s n THR 76 Ca 0.49 -0.10 -0.38 0.00 -2.27 0.00 0.00 64.05 61.79 1s3s n THR 76 Cb 1.31 1.11 -0.08 0.00 -2.10 0.00 0.00 70.33 70.58 1s3s n THR 76 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s3s s SER 78 N 1.08 6.85 0.10 0.00 1.04 -1.26 -4.34 113.70 117.18 1s3s s SER 78 Ca 0.17 2.19 -0.20 0.00 0.48 0.00 0.00 55.95 58.59 1s3s s SER 78 Cb -0.15 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.36 1s3s s SER 78 CO 0.08 -0.68 1.02 0.47 0.98 0.00 0.00 173.24 175.11 1s3s n ASP 79 N 4.72 -0.69 0.10 7.02 10.43 -1.26 0.51 116.55 137.38 1s3s n ASP 79 Ca 0.12 1.17 0.09 0.00 2.57 0.00 0.00 54.79 58.75 1s3s n ASP 79 Cb 0.43 -0.16 0.41 0.00 1.84 0.00 0.00 41.12 43.65 1s3s n ASP 79 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1s3s n GLU 80 N -4.77 0.12 -3.94 -1.24 1.02 -1.26 -4.68 120.64 105.88 1s3s n GLU 80 Ca 0.01 0.46 -0.21 0.00 -0.02 0.00 0.00 57.16 57.40 1s3s n GLU 80 Cb 0.17 -1.77 -0.03 0.00 -0.02 0.00 0.00 31.44 29.79 1s3s n GLU 80 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1s3s s LYS 81 N -3.27 3.03 -0.09 3.49 1.02 0.18 -1.45 119.74 122.65 1s3s s LYS 81 Ca 0.02 -1.03 0.01 0.00 0.02 0.00 0.00 55.97 54.99 1s3s s LYS 81 Cb 0.07 -2.66 0.02 0.00 -0.52 0.00 0.00 37.83 34.75 1s3s s LYS 81 CO 0.26 0.30 -0.09 -1.50 -0.92 0.00 0.00 175.35 173.41 1s3s s ILE 82 N -2.14 1.00 0.33 2.17 2.07 -0.42 -4.56 121.20 119.65 1s3s s ILE 82 Ca 0.36 -0.32 -0.25 0.00 -1.41 0.00 0.00 60.65 59.02 1s3s s ILE 82 Cb -0.08 -0.99 -0.10 0.00 0.13 0.00 0.00 42.46 41.42 1s3s s ILE 82 CO 0.27 0.35 0.94 -0.13 -1.91 0.00 0.00 174.94 174.46 1s3s s ARG 83 N 1.31 4.54 -0.18 3.50 0.52 0.11 -1.04 118.95 127.71 1s3s s ARG 83 Ca -0.03 1.29 -0.32 0.00 -0.52 0.00 0.00 55.73 56.15 1s3s s ARG 83 Cb -0.14 -2.74 0.14 0.00 0.52 0.00 0.00 34.95 32.73 1s3s s ARG 83 CO -0.04 0.25 1.15 0.00 0.02 0.00 0.00 175.30 176.69 1s3s s MET 84 N -2.16 0.38 0.63 3.54 0.23 -1.24 -1.47 119.30 119.21 1s3s s MET 84 Ca 0.51 -0.07 -0.09 0.00 -1.03 0.00 0.00 55.69 55.01 1s3s s MET 84 Cb -0.18 0.18 -0.00 0.00 -1.53 0.00 0.00 34.83 33.30 1s3s s MET 84 CO 0.23 -0.15 0.99 -0.80 -2.03 0.00 0.00 175.02 173.25 1s3s s ASN 85 N -1.82 5.72 0.03 -1.18 0.01 -1.26 -2.78 114.94 113.66 1s3s s ASN 85 Ca 0.07 1.03 0.06 0.00 -0.71 0.00 0.00 52.86 53.30 1s3s s ASN 85 Cb -0.01 -1.99 0.26 0.00 0.41 0.00 0.00 41.25 39.92 1s3s s ASN 85 CO -0.05 -1.08 1.18 -1.14 -1.51 0.00 0.00 177.10 174.50 1s3s n ARG 86 N -2.74 0.02 -0.01 -0.60 0.63 -1.26 -2.40 116.66 110.28 1s3s n ARG 86 Ca 0.05 0.45 -0.04 0.00 -0.92 0.00 0.00 57.85 57.40 1s3s n ARG 86 Cb 0.56 -1.55 -0.03 0.00 0.45 0.00 0.00 32.46 31.90 1s3s n ARG 86 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1s3s h VAL 87 N 0.00 0.28 -0.45 5.15 2.07 -1.92 -1.63 116.25 119.75 1s3s h VAL 87 Ca 0.00 -1.13 0.02 0.00 0.82 0.00 0.00 66.70 66.41 1s3s h VAL 87 Cb 0.07 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1s3s h VAL 87 CO 0.00 0.09 0.27 -0.37 0.02 0.00 0.00 177.57 177.58 1s3s h VAL 88 N -1.01 1.06 -0.63 2.57 -1.51 -1.76 0.14 116.25 115.11 1s3s h VAL 88 Ca -0.01 -0.19 0.12 0.00 -1.23 0.00 0.00 66.70 65.39 1s3s h VAL 88 Cb 0.22 0.46 -0.09 0.00 -2.13 0.00 0.00 31.29 29.75 1s3s h VAL 88 CO 0.01 0.10 0.16 -0.09 -1.23 0.00 0.00 177.57 176.52 1s3s h ARG 89 N 0.55 0.28 -0.06 5.19 2.43 -1.59 0.12 114.38 121.30 1s3s h ARG 89 Ca 0.18 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1s3s h ARG 89 Cb -0.00 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.48 1s3s h ARG 89 CO -0.07 0.19 0.03 -0.91 -1.51 0.00 0.00 179.97 177.69 1s3s h ASN 90 N 0.29 0.08 -0.01 -3.80 -0.26 -0.25 -1.30 115.58 110.33 1s3s h ASN 90 Ca 0.33 -0.15 0.00 0.00 -0.56 0.00 0.00 56.30 55.93 1s3s h ASN 90 Cb 0.50 -0.02 -0.00 0.00 -1.06 0.00 0.00 38.32 37.74 1s3s h ASN 90 CO -0.41 0.21 0.03 0.78 -1.06 0.00 0.00 177.43 176.98 1s3s h ASN 91 N -0.05 0.00 0.04 5.81 2.35 -0.07 0.27 115.58 123.94 1s3s h ASN 91 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1s3s h ASN 91 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1s3s h ASN 91 CO -0.00 0.00 -0.09 0.18 -1.65 0.00 0.00 177.43 175.87 1s3s n LEU 92 N -3.46 1.62 -3.70 1.61 4.77 0.32 -4.58 117.00 113.59 1s3s n LEU 92 Ca -0.03 -0.53 -0.23 0.00 -0.03 0.00 0.00 56.01 55.20 1s3s n LEU 92 Cb 0.10 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.21 1s3s n LEU 92 CO 0.23 0.28 0.04 0.54 -1.33 0.00 0.00 177.39 177.15 1s3s n ARG 93 N 0.13 -5.66 -4.35 3.23 5.12 0.96 -2.90 116.66 113.19 1s3s n ARG 93 Ca 0.16 0.67 -0.18 0.00 -1.93 0.00 0.00 57.85 56.57 1s3s n ARG 93 Cb 0.39 -5.44 -0.10 0.00 -1.16 0.00 0.00 32.46 26.16 1s3s n ARG 93 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1s3s s VAL 94 N -3.50 0.57 0.18 1.55 -7.23 -0.69 -4.24 120.40 107.04 1s3s s VAL 94 Ca 0.22 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.44 1s3s s VAL 94 Cb -0.11 -2.61 -0.05 0.00 0.56 0.00 0.00 36.38 34.18 1s3s s VAL 94 CO 0.79 0.00 -0.08 -0.13 -0.31 0.00 0.00 175.10 175.37 1s3s s ARG 95 N -3.94 1.16 0.18 4.82 1.81 -1.26 -4.54 118.95 117.17 1s3s s ARG 95 Ca 0.36 -1.53 -0.33 0.00 -1.72 0.00 0.00 55.73 52.51 1s3s s ARG 95 Cb 0.07 -0.68 -0.13 0.00 -0.45 0.00 0.00 34.95 33.76 1s3s s ARG 95 CO 0.15 0.04 1.63 1.28 -0.68 0.00 0.00 175.30 177.72 1s3s n LEU 96 N -0.28 3.40 0.00 2.53 4.32 -1.26 -1.73 117.00 123.98 1s3s n LEU 96 Ca -0.09 1.08 0.00 0.00 -0.02 0.00 0.00 56.01 56.98 1s3s n LEU 96 Cb 0.61 -1.48 0.00 0.00 -1.62 0.00 0.00 43.42 40.94 1s3s n LEU 96 CO 0.34 -0.13 0.00 0.61 -1.22 0.00 0.00 177.39 176.99 1s3s n GLY 97 N 3.59 2.35 3.70 -0.72 0.00 0.15 -4.98 105.19 109.27 1s3s n GLY 97 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1s3s n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s3s s ASP 98 N -1.50 1.36 -0.00 1.61 -0.00 -0.70 -4.69 116.67 112.74 1s3s s ASP 98 Ca 0.00 0.42 0.03 0.00 -0.00 0.00 0.00 52.55 53.00 1s3s s ASP 98 Cb 0.00 -0.52 -0.03 0.00 -0.00 0.00 0.00 42.92 42.37 1s3s s ASP 98 CO 0.00 -3.83 -0.09 0.68 -0.00 0.00 0.00 175.17 171.93 1s3s s VAL 99 N -3.32 3.50 0.12 -1.27 -7.23 -1.26 -2.07 120.40 108.87 1s3s s VAL 99 Ca 0.73 -0.79 0.02 0.00 -1.81 0.00 0.00 61.98 60.13 1s3s s VAL 99 Cb -0.06 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.34 1s3s s VAL 99 CO 0.55 0.42 -0.05 0.27 -0.31 0.00 0.00 175.10 175.98 1s3s s ILE 100 N -0.95 0.71 -0.31 -0.62 -4.36 -0.19 -4.85 121.20 110.64 1s3s s ILE 100 Ca 0.16 -1.95 -0.04 0.00 -0.26 0.00 0.00 60.65 58.56 1s3s s ILE 100 Cb -0.11 -1.79 0.04 0.00 1.25 0.00 0.00 42.46 41.85 1s3s s ILE 100 CO 0.06 -0.78 0.04 -0.44 0.24 0.00 0.00 174.94 174.06 1s3s s SER 101 N -3.08 5.02 -0.10 4.36 0.01 -0.80 -2.19 113.70 116.93 1s3s s SER 101 Ca 0.15 -1.14 -0.07 0.00 1.31 0.00 0.00 55.95 56.20 1s3s s SER 101 Cb 0.05 -1.78 -0.04 0.00 0.21 0.00 0.00 66.02 64.46 1s3s s SER 101 CO -0.03 -0.27 0.16 0.27 0.41 0.00 0.00 173.24 173.78 1s3s s ILE 102 N 1.34 5.48 -0.11 1.44 -4.36 -0.64 -1.88 121.20 122.46 1s3s s ILE 102 Ca -0.03 0.20 -0.05 0.00 -0.26 0.00 0.00 60.65 60.51 1s3s s ILE 102 Cb -0.19 -3.43 0.05 0.00 1.25 0.00 0.00 42.46 40.14 1s3s s ILE 102 CO 0.00 0.59 0.26 -1.10 0.24 0.00 0.00 174.94 174.93 1s3s s GLN 103 N -1.13 0.21 0.23 0.37 -0.21 -0.14 -4.72 119.66 114.27 1s3s s GLN 103 Ca 0.17 0.58 -0.32 0.00 0.02 0.00 0.00 55.36 55.81 1s3s s GLN 103 Cb -0.12 -0.10 -0.14 0.00 1.00 0.00 0.00 33.01 33.65 1s3s s GLN 103 CO 0.06 -0.18 1.37 -2.30 -2.12 0.00 0.00 175.29 172.12 1s3s n PRO 104 N 4.41 1.90 -3.52 2.91 -0.02 -1.26 -0.67 135.00 138.73 1s3s n PRO 104 Ca -0.22 0.68 -0.27 0.00 -2.02 0.00 0.00 63.50 61.66 1s3s n PRO 104 Cb 0.53 -2.31 -0.10 0.00 -0.02 0.00 0.00 33.50 31.60 1s3s n PRO 104 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s3s n PRO 106 N 2.05 0.34 -0.03 0.00 -0.02 -1.26 -3.95 135.00 132.12 1s3s n PRO 106 Ca 0.25 0.06 0.01 0.00 -2.02 0.00 0.00 63.50 61.80 1s3s n PRO 106 Cb 0.44 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.44 1s3s n PRO 106 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1s3s n ASP 107 N -1.29 0.61 -4.72 2.55 8.00 -1.26 -4.89 116.55 115.54 1s3s n ASP 107 Ca 0.11 -2.02 -0.40 0.00 0.71 0.00 0.00 54.79 53.19 1s3s n ASP 107 Cb 0.19 -0.21 -0.04 0.00 -0.02 0.00 0.00 41.12 41.04 1s3s n ASP 107 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1s3s s VAL 108 N -1.62 4.89 0.07 2.53 1.01 -1.25 -5.06 120.40 120.96 1s3s s VAL 108 Ca 0.03 1.69 0.10 0.00 0.00 0.00 0.00 61.98 63.79 1s3s s VAL 108 Cb 0.02 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 1s3s s VAL 108 CO 0.01 0.26 -0.26 -1.59 0.00 0.00 0.00 175.10 173.53 1s3s s LYS 109 N 0.59 1.72 0.19 2.72 0.00 -1.26 -4.94 119.74 118.75 1s3s s LYS 109 Ca 0.42 -1.16 -0.32 0.00 0.00 0.00 0.00 55.97 54.91 1s3s s LYS 109 Cb -0.20 -1.98 -0.16 0.00 0.00 0.00 0.00 37.83 35.50 1s3s s LYS 109 CO 0.23 0.50 1.09 0.66 0.00 0.00 0.00 175.35 177.82 1s3s n TYR 110 N 1.52 1.14 -2.00 1.78 4.02 -1.26 -3.09 117.16 119.27 1s3s n TYR 110 Ca -0.17 0.72 -0.40 0.00 -0.01 0.00 0.00 57.90 58.03 1s3s n TYR 110 Cb 0.52 -2.24 -0.01 0.00 -0.02 0.00 0.00 39.34 37.59 1s3s n TYR 110 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1s3s s GLY 111 N -0.17 2.96 0.00 2.72 0.00 0.67 -4.78 107.32 108.73 1s3s s GLY 111 Ca 0.71 1.35 0.00 0.00 0.00 0.00 0.00 44.72 46.78 1s3s s GLY 111 CO 0.54 1.99 0.00 0.28 0.00 0.00 0.00 173.10 175.91 1s3s n LYS 112 N 0.48 0.00 -4.28 2.90 4.76 -1.26 -3.57 118.16 117.19 1s3s n LYS 112 Ca 0.01 0.24 -0.24 0.00 -2.87 0.00 0.00 58.31 55.45 1s3s n LYS 112 Cb 0.42 -0.70 -0.08 0.00 -1.84 0.00 0.00 35.03 32.83 1s3s n LYS 112 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1s3s s ARG 113 N -0.82 2.18 -0.11 1.97 1.04 -1.26 -0.47 118.95 121.48 1s3s s ARG 113 Ca 0.00 -1.61 -0.06 0.00 -1.04 0.00 0.00 55.73 53.02 1s3s s ARG 113 Cb 0.00 -2.04 0.04 0.00 -2.04 0.00 0.00 34.95 30.91 1s3s s ARG 113 CO 0.00 0.21 0.25 0.42 -0.04 0.00 0.00 175.30 176.14 1s3s s ILE 114 N -2.44 -0.04 -0.26 4.99 1.01 0.24 -1.48 121.20 123.22 1s3s s ILE 114 Ca 0.34 0.13 -0.01 0.00 0.00 0.00 0.00 60.65 61.11 1s3s s ILE 114 Cb -0.03 -0.38 0.08 0.00 0.01 0.00 0.00 42.46 42.14 1s3s s ILE 114 CO 0.20 0.05 0.05 -2.28 0.00 0.00 0.00 174.94 172.97 1s3s s HIS 115 N 1.15 1.60 0.25 3.97 2.46 0.23 0.20 115.29 125.16 1s3s s HIS 115 Ca -0.08 -1.46 0.11 0.00 0.47 0.00 0.00 55.06 54.10 1s3s s HIS 115 Cb -0.09 -1.48 -0.05 0.00 -0.13 0.00 0.00 32.58 30.83 1s3s s HIS 115 CO -0.08 -0.77 -0.17 0.14 -2.47 0.00 0.00 174.74 171.38 1s3s s VAL 116 N 1.66 2.64 -0.00 0.89 -7.23 -1.18 -0.48 120.40 116.70 1s3s s VAL 116 Ca 0.04 -2.21 0.01 0.00 -1.81 0.00 0.00 61.98 58.01 1s3s s VAL 116 Cb -0.17 -2.36 -0.00 0.00 0.56 0.00 0.00 36.38 34.40 1s3s s VAL 116 CO -0.17 -0.32 -0.05 -0.76 -0.31 0.00 0.00 175.10 173.50 1s3s s LEU 117 N -3.31 1.99 0.40 1.32 1.43 -0.59 -4.32 118.68 115.60 1s3s s LEU 117 Ca 0.28 -0.08 -0.25 0.00 -1.03 0.00 0.00 54.13 53.05 1s3s s LEU 117 Cb -0.06 -0.24 -0.08 0.00 0.03 0.00 0.00 46.19 45.84 1s3s s LEU 117 CO 0.15 0.05 1.15 -2.16 0.23 0.00 0.00 176.35 175.77 1s3s s PRO 118 N -0.08 4.07 -0.63 1.29 0.04 -1.26 -1.15 135.00 137.28 1s3s s PRO 118 Ca 0.01 1.78 -0.27 0.00 0.04 0.00 0.00 61.00 62.56 1s3s s PRO 118 Cb -0.02 -2.65 0.03 0.00 0.04 0.00 0.00 34.50 31.90 1s3s s PRO 118 CO -0.00 -0.29 1.18 0.42 0.04 0.00 0.00 177.00 178.35 1s3s s ILE 119 N -1.45 3.98 0.00 0.56 -1.09 0.22 -0.29 121.20 123.13 1s3s s ILE 119 Ca 0.57 0.64 0.00 0.00 -2.23 0.00 0.00 60.65 59.63 1s3s s ILE 119 Cb -0.29 -4.76 0.00 0.00 -1.58 0.00 0.00 42.46 35.83 1s3s s ILE 119 CO 0.37 -1.48 0.00 -0.90 -1.23 0.00 0.00 174.94 171.70 1s3s n ASP 120 N 8.58 0.00 -0.13 3.58 5.75 0.29 0.05 116.55 134.67 1s3s n ASP 120 Ca 0.06 0.00 -0.11 0.00 -0.01 0.00 0.00 54.79 54.73 1s3s n ASP 120 Cb 0.49 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.56 1s3s n ASP 120 CO 0.00 0.00 0.00 -2.24 -0.11 0.00 0.00 177.20 174.85 1s3s h ASP 121 N 0.00 0.63 0.00 -1.12 3.04 -1.91 -2.93 116.42 114.14 1s3s h ASP 121 Ca 0.00 -0.31 0.00 0.00 -3.24 0.00 0.00 57.03 53.48 1s3s h ASP 121 Cb 0.00 -0.17 0.00 0.00 -1.04 0.00 0.00 39.33 38.12 1s3s h ASP 121 CO 0.00 0.79 0.00 0.35 -2.04 0.00 0.00 179.24 178.34 1s3s n THR 122 N -4.49 0.00 0.00 1.15 -2.24 0.11 -3.36 114.28 105.45 1s3s n THR 122 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1s3s n THR 122 Cb 0.28 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 1s3s n THR 122 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1s3s n VAL 123 N -0.23 0.00 -1.57 2.28 0.24 -1.17 -4.38 118.33 113.51 1s3s n VAL 123 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.87 1s3s n VAL 123 Cb 0.13 0.03 -0.00 0.00 -1.47 0.00 0.00 33.84 32.53 1s3s n VAL 123 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1s3s n GLU 124 N -1.21 1.18 0.00 7.34 1.02 -1.12 -2.30 120.64 125.56 1s3s n GLU 124 Ca 0.00 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.56 1s3s n GLU 124 Cb 0.11 -1.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.71 1s3s n GLU 124 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s3s n GLY 125 N 1.33 2.95 3.27 0.62 0.00 -1.26 -5.03 105.19 107.07 1s3s n GLY 125 Ca 0.10 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1s3s n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s3s s ILE 126 N -2.49 2.16 0.23 -0.61 1.01 -0.97 -4.18 121.20 116.34 1s3s s ILE 126 Ca 0.00 -1.01 0.11 0.00 0.00 0.00 0.00 60.65 59.75 1s3s s ILE 126 Cb 0.00 -1.81 -0.05 0.00 0.01 0.00 0.00 42.46 40.62 1s3s s ILE 126 CO 0.00 0.56 -0.21 -0.89 0.00 0.00 0.00 174.94 174.40 1s3s s THR 127 N 0.03 2.30 -2.36 2.92 2.01 -1.19 -4.94 115.64 114.42 1s3s s THR 127 Ca -0.09 -2.19 0.00 0.00 0.31 0.00 0.00 61.69 59.72 1s3s s THR 127 Cb -0.15 -2.16 0.00 0.00 0.01 0.00 0.00 72.50 70.20 1s3s s THR 127 CO 0.06 -0.29 0.00 0.61 -0.69 0.00 0.00 174.62 174.31 1s3s n GLY 128 N -0.14 0.66 3.56 4.40 0.00 -1.26 -2.60 105.19 109.81 1s3s n GLY 128 Ca -0.09 -2.11 -0.43 0.00 0.00 0.00 0.00 46.02 43.39 1s3s n GLY 128 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1s3s s ASN 129 N -4.00 6.48 0.45 1.61 3.84 -1.26 -4.88 114.94 117.18 1s3s s ASN 129 Ca 0.00 0.05 0.26 0.00 0.21 0.00 0.00 52.86 53.38 1s3s s ASN 129 Cb 0.00 -2.45 0.62 0.00 -0.55 0.00 0.00 41.25 38.87 1s3s s ASN 129 CO 0.00 -1.08 1.71 -0.07 -2.79 0.00 0.00 177.10 174.87 1s3s h LEU 130 N 10.63 0.00 -0.00 3.21 3.38 -1.98 -3.26 115.31 127.29 1s3s h LEU 130 Ca -0.24 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 1s3s h LEU 130 Cb 1.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1s3s h LEU 130 CO 1.04 0.00 -0.00 0.15 0.09 0.00 0.00 178.44 179.71 1s3s h PHE 131 N 0.00 0.01 -0.50 1.13 3.57 -1.96 -0.19 116.94 119.00 1s3s h PHE 131 Ca 0.00 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 1s3s h PHE 131 Cb 0.86 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 1s3s h PHE 131 CO 0.00 0.52 0.04 0.93 -2.23 0.00 0.00 178.31 177.57 1s3s h GLU 132 N -0.51 0.86 0.02 1.11 4.39 -1.98 -0.69 114.58 117.78 1s3s h GLU 132 Ca 0.00 -0.25 -0.21 0.00 0.34 0.00 0.00 59.36 59.24 1s3s h GLU 132 Cb 0.52 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1s3s h GLU 132 CO 0.00 0.87 -0.96 -0.39 -1.16 0.00 0.00 179.01 177.37 1s3s h VAL 133 N 0.73 1.54 0.00 3.13 -1.51 -1.64 -3.38 116.25 115.12 1s3s h VAL 133 Ca 0.15 -2.85 0.00 0.00 -1.23 0.00 0.00 66.70 62.77 1s3s h VAL 133 Cb 0.45 2.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.23 1s3s h VAL 133 CO 0.02 0.83 0.00 -1.22 -1.23 0.00 0.00 177.57 175.96 1s3s n TYR 134 N -3.58 0.00 -0.30 5.19 4.01 -0.09 -4.65 117.16 117.74 1s3s n TYR 134 Ca -0.04 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.79 1s3s n TYR 134 Cb 0.86 0.00 0.20 0.00 -0.31 0.00 0.00 39.34 40.10 1s3s n TYR 134 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1s3s h LEU 135 N 0.00 -0.46 0.00 7.72 -0.00 -1.54 -1.45 115.31 119.59 1s3s h LEU 135 Ca 0.00 0.24 0.00 0.00 -0.00 0.00 0.00 57.88 58.12 1s3s h LEU 135 Cb 0.00 0.43 0.00 0.00 -0.00 0.00 0.00 40.66 41.09 1s3s h LEU 135 CO 0.00 -0.26 0.00 0.29 -0.00 0.00 0.00 178.44 178.47 1s3s n LYS 136 N -5.43 0.00 -0.34 1.13 4.76 -0.27 -1.05 118.16 116.96 1s3s n LYS 136 Ca 0.17 0.47 0.16 0.00 -2.87 0.00 0.00 58.31 56.24 1s3s n LYS 136 Cb 0.58 -1.39 0.37 0.00 -1.84 0.00 0.00 35.03 32.75 1s3s n LYS 136 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 1s3s h PRO 137 N 0.00 0.58 0.68 1.97 0.11 -1.71 0.47 132.00 134.11 1s3s h PRO 137 Ca 0.00 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.05 1s3s h PRO 137 Cb 0.00 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 1s3s h PRO 137 CO 0.00 0.39 -0.44 -0.92 -0.21 0.00 0.00 178.00 176.81 1s3s h TYR 138 N 0.60 -1.19 0.00 0.65 3.20 -1.19 -3.21 116.97 115.83 1s3s h TYR 138 Ca 0.63 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.46 1s3s h TYR 138 Cb 1.16 0.43 -0.00 0.00 1.54 0.00 0.00 36.73 39.85 1s3s h TYR 138 CO -0.01 -0.65 -0.14 0.74 -1.64 0.00 0.00 178.16 176.45 1s3s h PHE 139 N -1.06 0.00 0.00 -3.82 0.04 -0.64 -3.45 116.94 108.01 1s3s h PHE 139 Ca -0.09 0.00 -0.70 0.00 2.80 0.00 0.00 57.97 59.98 1s3s h PHE 139 Cb 0.86 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.97 1s3s h PHE 139 CO -0.10 0.14 1.27 -0.11 -0.60 0.00 0.00 178.31 178.91 1s3s n LEU 140 N -3.16 0.67 -4.08 1.54 7.94 0.16 -1.08 117.00 118.99 1s3s n LEU 140 Ca 0.03 0.60 -0.39 0.00 -1.11 0.00 0.00 56.01 55.14 1s3s n LEU 140 Cb 0.54 -0.84 -0.01 0.00 0.53 0.00 0.00 43.42 43.64 1s3s n LEU 140 CO 0.35 -0.72 -0.24 -0.62 -1.11 0.00 0.00 177.39 175.05 1s3s n GLU 141 N 7.09 -0.85 -0.00 1.96 -0.58 -1.26 -4.84 120.64 122.15 1s3s n GLU 141 Ca 0.52 0.16 -0.00 0.00 -0.42 0.00 0.00 57.16 57.42 1s3s n GLU 141 Cb -0.03 -3.20 -0.00 0.00 -0.57 0.00 0.00 31.44 27.64 1s3s n GLU 141 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1s3s n ALA 142 N -4.77 2.00 -2.97 0.62 0.00 -0.24 -5.04 120.51 110.11 1s3s n ALA 142 Ca -0.19 -0.01 -0.18 0.00 0.00 0.00 0.00 53.44 53.06 1s3s n ALA 142 Cb 0.61 0.42 0.04 0.00 0.00 0.00 0.00 19.45 20.52 1s3s n ALA 142 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1s3s n TYR 143 N -2.36 -1.73 -1.76 0.00 4.01 -1.22 -4.92 117.16 109.18 1s3s n TYR 143 Ca -0.00 0.50 -0.42 0.00 -0.16 0.00 0.00 57.90 57.82 1s3s n TYR 143 Cb 0.50 -3.93 -0.03 0.00 -0.31 0.00 0.00 39.34 35.58 1s3s n TYR 143 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1s3s s ARG 144 N -5.59 4.15 -0.17 -0.72 0.52 -1.26 -4.50 118.95 111.39 1s3s s ARG 144 Ca 0.29 2.50 -0.29 0.00 -0.52 0.00 0.00 55.73 57.71 1s3s s ARG 144 Cb -0.13 -4.09 -0.01 0.00 0.52 0.00 0.00 34.95 31.24 1s3s s ARG 144 CO 0.36 -0.92 1.22 -1.25 0.02 0.00 0.00 175.30 174.73 1s3s s PRO 145 N 4.28 4.25 0.04 3.54 0.04 -1.26 -1.48 135.00 144.40 1s3s s PRO 145 Ca 0.84 1.61 0.08 0.00 0.04 0.00 0.00 61.00 63.58 1s3s s PRO 145 Cb -0.40 -3.73 -0.03 0.00 0.04 0.00 0.00 34.50 30.38 1s3s s PRO 145 CO 0.38 -0.67 -0.24 0.96 0.04 0.00 0.00 177.00 177.48 1s3s s ILE 146 N 3.33 1.91 0.07 0.56 -4.36 -0.52 -4.46 121.20 117.74 1s3s s ILE 146 Ca 0.53 -1.28 0.08 0.00 -0.26 0.00 0.00 60.65 59.72 1s3s s ILE 146 Cb -0.21 -1.64 -0.04 0.00 1.25 0.00 0.00 42.46 41.83 1s3s s ILE 146 CO 0.14 0.30 -0.19 -0.60 0.24 0.00 0.00 174.94 174.83 1s3s s ARG 147 N -1.18 1.92 0.35 0.37 3.00 -1.26 -1.86 118.95 120.29 1s3s s ARG 147 Ca 0.10 -1.08 -0.28 0.00 -1.00 0.00 0.00 55.73 53.46 1s3s s ARG 147 Cb -0.09 -2.14 -0.12 0.00 0.00 0.00 0.00 34.95 32.60 1s3s s ARG 147 CO 0.02 0.51 1.45 1.17 0.00 0.00 0.00 175.30 178.45 1s3s n LYS 148 N 1.25 2.52 0.00 5.12 4.81 -1.10 -2.62 118.16 128.14 1s3s n LYS 148 Ca -0.16 0.88 0.00 0.00 -0.87 0.00 0.00 58.31 58.16 1s3s n LYS 148 Cb 0.52 -2.58 0.00 0.00 0.02 0.00 0.00 35.03 32.99 1s3s n LYS 148 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1s3s n GLY 149 N 0.84 2.93 3.23 3.14 0.00 0.70 -5.00 105.19 111.04 1s3s n GLY 149 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1s3s n GLY 149 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1s3s n ASP 150 N 0.18 -3.70 -3.74 1.61 9.92 -1.08 -4.40 116.55 115.34 1s3s n ASP 150 Ca 0.00 0.24 -0.24 0.00 -0.53 0.00 0.00 54.79 54.26 1s3s n ASP 150 Cb 0.00 -1.00 -0.17 0.00 -0.64 0.00 0.00 41.12 39.31 1s3s n ASP 150 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1s3s s ILE 151 N -2.22 0.34 0.46 0.53 1.01 -1.26 -1.10 121.20 118.97 1s3s s ILE 151 Ca 0.50 -0.04 0.06 0.00 0.00 0.00 0.00 60.65 61.17 1s3s s ILE 151 Cb -0.19 -0.63 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 1s3s s ILE 151 CO 0.74 0.10 0.26 0.72 0.00 0.00 0.00 174.94 176.76 1s3s s PHE 152 N 1.97 2.24 -0.05 3.97 -0.71 -0.37 -4.87 117.98 120.16 1s3s s PHE 152 Ca 0.03 -0.69 0.05 0.00 -1.04 0.00 0.00 56.93 55.28 1s3s s PHE 152 Cb -0.14 -1.94 -0.00 0.00 -1.21 0.00 0.00 43.02 39.73 1s3s s PHE 152 CO -0.06 -0.06 -0.19 -1.17 -1.34 0.00 0.00 175.22 172.40 1s3s s LEU 153 N -4.05 1.95 -0.19 -1.99 2.96 -1.26 -1.60 118.68 114.50 1s3s s LEU 153 Ca 0.36 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 1s3s s LEU 153 Cb 0.01 -1.08 0.04 0.00 0.50 0.00 0.00 46.19 45.66 1s3s s LEU 153 CO 0.21 0.17 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.62 1s3s s VAL 154 N 0.02 1.56 -0.39 1.68 1.01 -0.27 -4.97 120.40 119.03 1s3s s VAL 154 Ca -0.05 -0.93 -0.21 0.00 0.00 0.00 0.00 61.98 60.79 1s3s s VAL 154 Cb -0.12 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.63 1s3s s VAL 154 CO 0.03 0.18 0.66 -0.13 0.00 0.00 0.00 175.10 175.83 1s3s s ARG 155 N 1.44 3.52 -0.07 2.72 0.52 -1.26 -1.23 118.95 124.59 1s3s s ARG 155 Ca -0.01 -0.10 -0.31 0.00 -0.52 0.00 0.00 55.73 54.79 1s3s s ARG 155 Cb -0.16 -3.87 0.12 0.00 0.52 0.00 0.00 34.95 31.56 1s3s s ARG 155 CO -0.08 -0.87 1.08 0.20 0.02 0.00 0.00 175.30 175.65 1s3s s GLY 156 N 1.90 -0.36 -1.53 -3.53 0.00 -0.08 -4.87 107.32 98.86 1s3s s GLY 156 Ca 0.25 1.15 0.00 0.00 0.00 0.00 0.00 44.72 46.12 1s3s s GLY 156 CO 0.17 0.37 0.00 0.61 0.00 0.00 0.00 173.10 174.25 1s3s n GLY 157 N -0.23 1.08 3.13 0.20 0.00 -1.26 -3.07 105.19 105.06 1s3s n GLY 157 Ca -0.04 -0.29 -0.06 0.00 0.00 0.00 0.00 46.02 45.63 1s3s n GLY 157 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1s3s n MET 158 N -2.53 -1.66 0.00 1.61 0.00 0.43 -4.83 117.12 110.14 1s3s n MET 158 Ca -0.16 1.26 0.00 0.00 0.00 0.00 0.00 57.70 58.80 1s3s n MET 158 Cb 0.53 -5.78 0.00 0.00 0.00 0.00 0.00 33.22 27.97 1s3s n MET 158 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 175.97 178.86 1s3s n ARG 159 N -2.32 0.00 -5.18 0.03 1.85 -1.17 -4.96 116.66 104.90 1s3s n ARG 159 Ca -0.03 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.51 1s3s n ARG 159 Cb 0.54 0.00 -0.17 0.00 -1.05 0.00 0.00 32.46 31.79 1s3s n ARG 159 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1s3s s ALA 160 N -2.00 2.09 -0.11 2.89 0.00 -1.26 -0.90 121.76 122.47 1s3s s ALA 160 Ca 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 50.99 1s3s s ALA 160 Cb 0.00 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 1s3s s ALA 160 CO 0.00 0.32 -0.05 0.08 0.00 0.00 0.00 175.76 176.11 1s3s s VAL 161 N 0.20 3.86 -0.24 0.00 1.01 -0.36 -4.88 120.40 119.98 1s3s s VAL 161 Ca -0.14 -0.40 -0.10 0.00 0.00 0.00 0.00 61.98 61.35 1s3s s VAL 161 Cb -0.16 -2.64 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 1s3s s VAL 161 CO 0.07 0.55 0.14 -1.61 0.00 0.00 0.00 175.10 174.26 1s3s s GLU 162 N -0.28 3.98 0.12 2.72 2.02 -1.26 -1.11 118.70 124.90 1s3s s GLU 162 Ca 0.05 -0.31 0.07 0.00 0.02 0.00 0.00 54.97 54.79 1s3s s GLU 162 Cb -0.13 -3.50 -0.04 0.00 0.10 0.00 0.00 34.13 30.56 1s3s s GLU 162 CO 0.02 0.00 -0.07 -0.06 0.02 0.00 0.00 175.26 175.18 1s3s s PHE 163 N 1.20 2.79 -0.10 1.61 0.08 -0.63 -0.61 117.98 122.32 1s3s s PHE 163 Ca 0.07 -0.14 0.04 0.00 0.12 0.00 0.00 56.93 57.01 1s3s s PHE 163 Cb -0.14 -1.42 0.00 0.00 -0.57 0.00 0.00 43.02 40.89 1s3s s PHE 163 CO 0.05 0.46 -0.22 0.21 -0.10 0.00 0.00 175.22 175.62 1s3s s LYS 164 N -2.43 2.84 -0.35 0.44 2.47 -0.30 -1.24 119.74 121.18 1s3s s LYS 164 Ca 0.24 -0.81 -0.29 0.00 -1.56 0.00 0.00 55.97 53.55 1s3s s LYS 164 Cb -0.11 -2.17 0.00 0.00 -1.46 0.00 0.00 37.83 34.10 1s3s s LYS 164 CO 0.16 0.15 1.43 0.08 0.16 0.00 0.00 175.35 177.32 1s3s s VAL 165 N 0.41 3.92 -0.90 4.02 1.01 -0.26 -1.54 120.40 127.06 1s3s s VAL 165 Ca -0.18 0.99 0.22 0.00 0.00 0.00 0.00 61.98 63.01 1s3s s VAL 165 Cb -0.18 -4.09 -0.16 0.00 0.00 0.00 0.00 36.38 31.96 1s3s s VAL 165 CO 0.08 -0.59 1.03 0.52 0.00 0.00 0.00 175.10 176.14 1s3s n VAL 166 N 6.75 0.02 0.00 2.92 0.31 0.37 -0.21 118.33 128.49 1s3s n VAL 166 Ca 0.17 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 1s3s n VAL 166 Cb 0.47 0.64 0.00 0.00 -0.91 0.00 0.00 33.84 34.04 1s3s n VAL 166 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1s3s n GLU 167 N -1.60 0.00 -4.70 5.55 4.07 -1.00 -4.89 120.64 118.06 1s3s n GLU 167 Ca 0.04 0.00 -0.25 0.00 -0.06 0.00 0.00 57.16 56.88 1s3s n GLU 167 Cb 0.36 0.00 -0.16 0.00 -0.06 0.00 0.00 31.44 31.57 1s3s n GLU 167 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 1s3s s THR 168 N -1.15 1.27 0.17 6.31 -4.23 -1.26 -0.60 115.64 116.15 1s3s s THR 168 Ca 0.00 -0.59 -0.19 0.00 -1.18 0.00 0.00 61.69 59.73 1s3s s THR 168 Cb 0.00 -1.13 0.10 0.00 1.34 0.00 0.00 72.50 72.81 1s3s s THR 168 CO 0.00 0.38 1.63 -0.78 -0.54 0.00 0.00 174.62 175.31 1s3s h ASP 169 N 6.65 -0.69 -0.19 3.99 1.82 -1.62 -2.82 116.42 123.56 1s3s h ASP 169 Ca -0.31 0.15 -0.67 0.00 -0.39 0.00 0.00 57.03 55.82 1s3s h ASP 169 Cb 1.19 0.37 -0.03 0.00 0.68 0.00 0.00 39.33 41.53 1s3s h ASP 169 CO 0.48 -0.23 2.66 -2.65 -1.61 0.00 0.00 179.24 177.89 1s3s n PRO 170 N -5.38 2.55 -2.05 0.28 -0.02 -1.26 -4.93 135.00 124.19 1s3s n PRO 170 Ca 0.02 -2.56 -0.39 0.00 -2.02 0.00 0.00 63.50 58.55 1s3s n PRO 170 Cb 0.29 -3.28 -0.01 0.00 -0.02 0.00 0.00 33.50 30.49 1s3s n PRO 170 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1s3s s SER 171 N 3.97 6.33 0.02 2.55 0.15 -1.07 -2.60 113.70 123.05 1s3s s SER 171 Ca 0.52 2.66 -0.04 0.00 0.70 0.00 0.00 55.95 59.79 1s3s s SER 171 Cb 0.11 -2.64 -0.28 0.00 -1.71 0.00 0.00 66.02 61.50 1s3s s SER 171 CO -0.00 -0.84 0.93 1.55 1.20 0.00 0.00 173.24 176.08 1s3s h PRO 172 N 2.70 0.26 -6.36 5.44 0.13 -1.92 -3.49 132.00 128.77 1s3s h PRO 172 Ca -0.50 -0.45 -0.62 0.00 -0.87 0.00 0.00 66.00 63.56 1s3s h PRO 172 Cb 1.25 0.17 -0.15 0.00 0.13 0.00 0.00 31.00 32.39 1s3s h PRO 172 CO 0.63 1.15 -0.77 1.52 -0.23 0.00 0.00 178.00 180.29 1s3s s TYR 173 N -2.63 2.34 0.08 1.56 -0.85 -1.07 -2.71 117.35 114.08 1s3s s TYR 173 Ca -0.08 -0.33 -0.26 0.00 -0.52 0.00 0.00 57.07 55.89 1s3s s TYR 173 Cb 0.07 -1.07 0.08 0.00 0.38 0.00 0.00 41.96 41.41 1s3s s TYR 173 CO 0.86 0.63 0.67 0.00 -1.52 0.00 0.00 175.55 176.19 1s3s s ILE 175 N -3.04 4.90 -0.79 0.00 1.01 -1.18 -1.44 121.20 120.65 1s3s s ILE 175 Ca -0.01 1.08 -0.26 0.00 0.00 0.00 0.00 60.65 61.47 1s3s s ILE 175 Cb -0.01 -3.84 0.01 0.00 0.01 0.00 0.00 42.46 38.63 1s3s s ILE 175 CO -0.07 0.52 1.56 -0.69 0.00 0.00 0.00 174.94 176.25 1s3s s VAL 176 N -0.79 3.64 0.29 2.92 1.01 -0.55 -0.24 120.40 126.68 1s3s s VAL 176 Ca 0.27 -0.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.22 1s3s s VAL 176 Cb -0.18 -4.58 -0.04 0.00 0.00 0.00 0.00 36.38 31.58 1s3s s VAL 176 CO 0.16 -1.51 0.51 0.00 0.00 0.00 0.00 175.10 174.26 1s3s s ALA 177 N 7.01 3.70 -0.99 5.51 0.00 -1.26 -3.38 121.76 132.34 1s3s s ALA 177 Ca 0.50 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.72 1s3s s ALA 177 Cb -0.07 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.89 1s3s s ALA 177 CO 0.09 0.19 0.94 -0.35 0.00 0.00 0.00 175.76 176.63 1s3s n PRO 178 N -1.17 0.00 -0.04 0.00 -0.04 -1.26 -0.31 135.00 132.18 1s3s n PRO 178 Ca -0.03 0.44 -0.06 0.00 -0.04 0.00 0.00 63.50 63.81 1s3s n PRO 178 Cb 0.55 -1.53 -0.14 0.00 -0.04 0.00 0.00 33.50 32.34 1s3s n PRO 178 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1s3s n ASP 179 N -1.44 0.47 -4.75 3.54 9.92 -1.26 -4.96 116.55 118.07 1s3s n ASP 179 Ca 0.00 0.22 -0.42 0.00 -0.53 0.00 0.00 54.79 54.06 1s3s n ASP 179 Cb 0.03 0.53 -0.01 0.00 -0.64 0.00 0.00 41.12 41.04 1s3s n ASP 179 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1s3s n THR 180 N -2.85 1.53 -3.21 -3.53 -1.04 0.58 -4.98 114.28 100.79 1s3s n THR 180 Ca -0.21 -0.38 -0.32 0.00 -2.04 0.00 0.00 64.05 61.10 1s3s n THR 180 Cb 1.02 -1.91 -0.05 0.00 -1.82 0.00 0.00 70.33 67.56 1s3s n THR 180 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1s3s s VAL 181 N -0.59 4.79 -0.35 12.58 0.11 0.38 -4.85 120.40 132.47 1s3s s VAL 181 Ca 0.59 0.71 -0.00 0.00 -2.93 0.00 0.00 61.98 60.35 1s3s s VAL 181 Cb -0.50 -3.63 0.12 0.00 -1.53 0.00 0.00 36.38 30.84 1s3s s VAL 181 CO 0.57 -0.19 0.16 -0.63 -3.33 0.00 0.00 175.10 171.67 1s3s s ILE 182 N -1.98 0.78 0.52 7.04 1.01 -1.26 -0.59 121.20 126.72 1s3s s ILE 182 Ca 0.51 -1.70 -0.19 0.00 0.00 0.00 0.00 60.65 59.28 1s3s s ILE 182 Cb -0.11 -1.57 -0.07 0.00 0.01 0.00 0.00 42.46 40.72 1s3s s ILE 182 CO 0.21 -0.80 1.05 -1.00 0.00 0.00 0.00 174.94 174.39 1s3s s HIS 183 N 1.23 3.00 -0.42 3.97 3.76 0.52 -4.96 115.29 122.39 1s3s s HIS 183 Ca 0.13 1.55 0.08 0.00 -0.15 0.00 0.00 55.06 56.67 1s3s s HIS 183 Cb -0.20 -3.04 0.28 0.00 1.11 0.00 0.00 32.58 30.72 1s3s s HIS 183 CO -0.15 -0.93 0.76 0.00 -0.85 0.00 0.00 174.74 173.57 1s3s n GLU 185 N 1.10 0.02 0.00 0.00 4.07 -1.26 -4.91 120.64 119.66 1s3s n GLU 185 Ca 0.16 0.05 0.04 0.00 -0.06 0.00 0.00 57.16 57.36 1s3s n GLU 185 Cb 0.61 -1.87 0.26 0.00 -0.06 0.00 0.00 31.44 30.37 1s3s n GLU 185 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1s3s n GLY 186 N 1.53 -0.55 3.01 8.31 0.00 -1.26 -4.80 105.19 111.44 1s3s n GLY 186 Ca 0.09 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 1s3s n GLY 186 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1s3s s GLU 187 N -2.00 1.64 0.58 1.61 2.56 -1.26 -5.13 118.70 116.70 1s3s s GLU 187 Ca 0.13 -0.39 -0.18 0.00 0.00 0.00 0.00 54.97 54.53 1s3s s GLU 187 Cb 0.06 -1.37 -0.04 0.00 2.00 0.00 0.00 34.13 34.78 1s3s s GLU 187 CO 0.10 0.02 1.13 -1.25 -0.56 0.00 0.00 175.26 174.69 1s3s s PRO 188 N 0.69 3.17 0.19 4.30 0.04 -1.26 -4.72 135.00 137.40 1s3s s PRO 188 Ca -0.14 1.55 0.03 0.00 0.04 0.00 0.00 61.00 62.49 1s3s s PRO 188 Cb -0.16 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.37 1s3s s PRO 188 CO 0.03 -0.99 0.31 0.96 0.04 0.00 0.00 177.00 177.36 1s3s s ILE 189 N -1.94 5.29 1.14 0.56 -4.36 0.60 -4.61 121.20 117.89 1s3s s ILE 189 Ca 0.71 -0.81 -0.15 0.00 -0.26 0.00 0.00 60.65 60.14 1s3s s ILE 189 Cb -0.23 -3.79 0.26 0.00 1.25 0.00 0.00 42.46 39.95 1s3s s ILE 189 CO 0.32 -0.19 1.06 -0.75 0.24 0.00 0.00 174.94 175.62 1s3s s LYS 190 N -3.53 -0.70 -0.32 0.37 2.47 -1.26 -0.55 119.74 116.23 1s3s s LYS 190 Ca 0.34 0.41 -0.11 0.00 -1.56 0.00 0.00 55.97 55.06 1s3s s LYS 190 Cb -0.10 -1.62 -0.02 0.00 -1.46 0.00 0.00 37.83 34.64 1s3s s LYS 190 CO 0.29 -3.46 0.19 0.50 0.16 0.00 0.00 175.35 173.02 1s3s s ARG 191 N -4.94 3.48 -0.31 4.03 6.06 -1.26 -4.77 118.95 121.24 1s3s s ARG 191 Ca 0.68 -0.64 -0.19 0.00 -2.50 0.00 0.00 55.73 53.09 1s3s s ARG 191 Cb -0.18 -3.66 -0.01 0.00 0.06 0.00 0.00 34.95 31.16 1s3s s ARG 191 CO 0.59 -0.39 0.55 -1.21 -2.50 0.00 0.00 175.30 172.34 1s3s s GLU 192 N 1.67 3.85 0.00 5.12 2.02 -1.26 -4.91 118.70 125.20 1s3s s GLU 192 Ca 0.05 0.13 0.00 0.00 0.02 0.00 0.00 54.97 55.18 1s3s s GLU 192 Cb -0.17 -3.73 0.00 0.00 0.10 0.00 0.00 34.13 30.33 1s3s s GLU 192 CO 0.08 -0.52 1.10 -0.25 0.02 0.00 0.00 175.26 175.69 1s3s n ASP 193 N 5.72 3.11 -0.00 -0.19 8.00 -1.26 -1.21 116.55 130.71 1s3s n ASP 193 Ca -0.03 -1.79 0.10 0.00 0.71 0.00 0.00 54.79 53.77 1s3s n ASP 193 Cb 0.49 -0.59 -0.13 0.00 -0.02 0.00 0.00 41.12 40.87 1s3s n ASP 193 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1s3s n GLU 194 N 1.00 0.48 -4.47 -1.24 1.02 -1.26 -4.83 120.64 111.34 1s3s n GLU 194 Ca 0.00 -0.06 -0.34 0.00 -0.02 0.00 0.00 57.16 56.73 1s3s n GLU 194 Cb 0.40 -1.46 -0.10 0.00 -0.02 0.00 0.00 31.44 30.26 1s3s n GLU 194 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1s3s s GLU 195 N -3.07 2.88 -0.09 3.49 2.02 -0.35 -5.08 118.70 118.50 1s3s s GLU 195 Ca 0.02 -0.47 -0.02 0.00 0.02 0.00 0.00 54.97 54.52 1s3s s GLU 195 Cb 0.14 -2.70 -0.03 0.00 0.10 0.00 0.00 34.13 31.64 1s3s s GLU 195 CO 0.83 0.68 0.01 -1.21 0.02 0.00 0.00 175.26 175.59 1s3s s GLU 196 N -0.88 3.01 0.78 1.61 2.02 -1.26 -4.82 118.70 119.16 1s3s s GLU 196 Ca 0.13 -0.40 -0.11 0.00 0.02 0.00 0.00 54.97 54.61 1s3s s GLU 196 Cb -0.11 -2.81 0.07 0.00 0.10 0.00 0.00 34.13 31.37 1s3s s GLU 196 CO 0.02 0.70 1.11 0.45 0.02 0.00 0.00 175.26 177.56 1s3s s SER 197 N -0.87 4.26 -0.11 -0.19 0.15 -1.26 -4.90 113.70 110.78 1s3s s SER 197 Ca 0.13 1.94 0.19 0.00 0.70 0.00 0.00 55.95 58.91 1s3s s SER 197 Cb -0.11 -2.54 0.73 0.00 -1.71 0.00 0.00 66.02 62.39 1s3s s SER 197 CO 0.02 -2.20 1.64 0.18 1.20 0.00 0.00 173.24 174.08 1s3s n LEU 198 N -3.48 4.78 -0.55 3.45 4.77 -1.26 -3.66 117.00 121.06 1s3s n LEU 198 Ca 0.10 -2.43 0.13 0.00 -0.03 0.00 0.00 56.01 53.78 1s3s n LEU 198 Cb 0.53 -0.58 0.36 0.00 -2.33 0.00 0.00 43.42 41.39 1s3s n LEU 198 CO 0.52 0.83 0.73 -3.20 -1.33 0.00 0.00 177.39 174.94 1s3s n ASN 199 N 1.18 1.79 -4.91 -1.43 5.15 -1.26 -4.90 115.26 110.88 1s3s n ASN 199 Ca 0.26 -1.50 -0.30 0.00 -0.60 0.00 0.00 54.58 52.44 1s3s n ASN 199 Cb 0.89 0.06 -0.04 0.00 -0.53 0.00 0.00 39.78 40.16 1s3s n ASN 199 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1s3s s GLU 200 N -2.13 3.56 0.15 1.20 2.02 -1.24 -5.04 118.70 117.22 1s3s s GLU 200 Ca 0.32 -0.22 -0.32 0.00 0.02 0.00 0.00 54.97 54.76 1s3s s GLU 200 Cb 0.20 -2.86 -0.12 0.00 0.10 0.00 0.00 34.13 31.45 1s3s s GLU 200 CO 0.38 0.45 1.75 0.28 0.02 0.00 0.00 175.26 178.13 1s3s n VAL 201 N -0.21 0.17 -4.51 2.63 0.31 -1.26 -5.00 118.33 110.45 1s3s n VAL 201 Ca -0.03 -0.03 -0.24 0.00 -0.01 0.00 0.00 64.34 64.03 1s3s n VAL 201 Cb 0.52 -1.94 -0.10 0.00 -0.91 0.00 0.00 33.84 31.42 1s3s n VAL 201 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1s3s s GLY 202 N 1.84 2.33 0.47 2.92 0.00 -1.26 -4.46 107.32 109.16 1s3s s GLY 202 Ca 0.79 -1.73 0.14 0.00 0.00 0.00 0.00 44.72 43.92 1s3s s GLY 202 CO 0.36 -1.88 2.06 -0.97 0.00 0.00 0.00 173.10 172.67 1s3s h TYR 203 N 1.94 0.09 0.00 1.90 0.05 -1.95 -1.97 116.97 117.03 1s3s h TYR 203 Ca -0.40 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.38 1s3s h TYR 203 Cb 1.26 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.97 1s3s h TYR 203 CO 0.90 0.14 0.04 0.38 -1.05 0.00 0.00 178.16 178.58 1s3s h ASP 204 N 0.09 0.00 1.44 3.88 2.03 -1.99 0.19 116.42 122.07 1s3s h ASP 204 Ca 0.02 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.29 1s3s h ASP 204 Cb 0.15 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.65 1s3s h ASP 204 CO 0.01 0.00 -0.57 0.44 -1.03 0.00 0.00 179.24 178.09 1s3s h ASP 205 N 0.00 0.00 -3.38 4.15 3.32 -1.76 -3.44 116.42 115.31 1s3s h ASP 205 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 1s3s h ASP 205 Cb 0.08 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.53 1s3s h ASP 205 CO 0.00 0.12 0.30 -0.69 -1.72 0.00 0.00 179.24 177.25 1s3s s VAL 206 N -3.20 4.92 0.02 -1.35 1.01 0.67 -4.99 120.40 117.47 1s3s s VAL 206 Ca 0.03 1.34 0.08 0.00 0.00 0.00 0.00 61.98 63.43 1s3s s VAL 206 Cb 0.07 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.41 1s3s s VAL 206 CO 0.74 -0.00 -0.24 -0.83 0.00 0.00 0.00 175.10 174.76 1s3s s GLY 207 N 1.37 1.23 0.00 4.51 0.00 -1.26 -4.69 107.32 108.48 1s3s s GLY 207 Ca 0.31 -1.12 0.00 0.00 0.00 0.00 0.00 44.72 43.91 1s3s s GLY 207 CO 0.08 -0.99 0.00 0.61 0.00 0.00 0.00 173.10 172.81 1s3s n GLY 208 N 2.08 1.91 2.76 0.20 0.00 -1.26 -4.73 105.19 106.15 1s3s n GLY 208 Ca -0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 1s3s n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s3s n ARG 210 N 1.18 0.00 -0.27 0.00 1.85 -1.26 -2.46 116.66 115.69 1s3s n ARG 210 Ca 0.27 0.09 0.33 0.00 -1.00 0.00 0.00 57.85 57.54 1s3s n ARG 210 Cb 0.37 -0.57 0.74 0.00 -1.05 0.00 0.00 32.46 31.95 1s3s n ARG 210 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 1s3s h LYS 211 N 0.00 0.01 0.51 2.89 1.79 -1.99 -0.43 116.57 119.35 1s3s h LYS 211 Ca 0.00 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 1s3s h LYS 211 Cb 0.00 -0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.65 1s3s h LYS 211 CO 0.00 0.01 -0.25 1.96 -1.08 0.00 0.00 179.45 180.09 1s3s h GLN 212 N 0.01 -0.67 -0.14 3.15 1.08 -1.94 -2.87 115.11 113.74 1s3s h GLN 212 Ca 0.52 0.05 0.04 0.00 -1.45 0.00 0.00 58.65 57.80 1s3s h GLN 212 Cb 2.05 0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 29.63 1s3s h GLN 212 CO -0.01 -0.44 0.12 -0.07 -0.95 0.00 0.00 178.83 177.47 1s3s h LEU 213 N -0.96 0.00 0.43 1.46 3.38 -1.04 -2.55 115.31 116.04 1s3s h LEU 213 Ca -0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1s3s h LEU 213 Cb 0.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1s3s h LEU 213 CO 0.12 0.00 -0.35 0.00 0.09 0.00 0.00 178.44 178.30 1s3s h ALA 214 N 1.89 -1.08 -0.16 1.53 0.00 -1.03 -1.80 119.26 118.61 1s3s h ALA 214 Ca 0.07 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1s3s h ALA 214 Cb 0.31 0.53 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1s3s h ALA 214 CO -0.00 -1.08 -0.19 1.96 0.00 0.00 0.00 179.25 179.94 1s3s h GLN 215 N -0.76 -0.22 -0.50 0.00 4.20 -1.23 -1.81 115.11 114.79 1s3s h GLN 215 Ca -0.06 0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.74 1s3s h GLN 215 Cb 0.63 0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.40 1s3s h GLN 215 CO 0.00 -0.14 0.16 0.82 -0.67 0.00 0.00 178.83 179.00 1s3s h ILE 216 N -0.22 0.80 -0.16 2.54 2.04 -1.52 -0.80 117.51 120.19 1s3s h ILE 216 Ca 0.11 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.88 1s3s h ILE 216 Cb 0.38 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1s3s h ILE 216 CO -0.29 0.06 0.03 0.11 0.00 0.00 0.00 178.15 178.06 1s3s h LYS 217 N 0.32 0.10 0.00 2.37 1.57 -0.92 -1.24 116.57 118.77 1s3s h LYS 217 Ca 0.25 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1s3s h LYS 217 Cb 0.29 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1s3s h LYS 217 CO -0.27 0.06 0.00 -0.85 -0.57 0.00 0.00 179.45 177.82 1s3s n GLU 218 N -5.08 0.80 -0.09 3.15 0.28 -0.70 -1.31 120.64 117.69 1s3s n GLU 218 Ca -0.04 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 56.85 1s3s n GLU 218 Cb 0.07 -1.24 -0.11 0.00 1.43 0.00 0.00 31.44 31.58 1s3s n GLU 218 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 1s3s n MET 219 N -0.74 0.96 0.01 3.44 2.81 -0.39 -4.48 117.12 118.72 1s3s n MET 219 Ca 0.09 0.05 0.11 0.00 -1.81 0.00 0.00 57.70 56.14 1s3s n MET 219 Cb 0.04 -1.42 -0.04 0.00 -0.71 0.00 0.00 33.22 31.09 1s3s n MET 219 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 1s3s n VAL 220 N -2.84 0.04 -0.02 2.03 0.24 -0.70 -4.62 118.33 112.46 1s3s n VAL 220 Ca -0.31 -0.11 -0.01 0.00 -2.04 0.00 0.00 64.34 61.86 1s3s n VAL 220 Cb 0.97 0.59 -0.01 0.00 -1.47 0.00 0.00 33.84 33.92 1s3s n VAL 220 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1s3s h GLU 221 N 0.00 -0.01 0.09 7.34 4.57 -1.42 0.33 114.58 125.47 1s3s h GLU 221 Ca 0.00 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1s3s h GLU 221 Cb 0.61 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 1s3s h GLU 221 CO 0.00 -0.01 -0.04 -0.07 -1.18 0.00 0.00 179.01 177.71 1s3s h LEU 222 N -0.01 -0.10 -1.16 1.64 3.38 -1.86 0.13 115.31 117.32 1s3s h LEU 222 Ca 0.01 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 1s3s h LEU 222 Cb 0.04 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1s3s h LEU 222 CO -0.06 0.04 -0.31 1.55 0.09 0.00 0.00 178.44 179.76 1s3s h PRO 223 N -0.24 0.19 0.00 1.13 0.13 -1.81 0.90 132.00 132.29 1s3s h PRO 223 Ca -0.01 -0.07 -0.05 0.00 -0.87 0.00 0.00 66.00 65.00 1s3s h PRO 223 Cb 0.20 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.31 1s3s h PRO 223 CO 0.02 0.48 -1.15 -0.11 -0.23 0.00 0.00 178.00 177.02 1s3s n LEU 224 N -4.12 0.84 -0.04 1.56 7.94 0.10 -3.96 117.00 119.32 1s3s n LEU 224 Ca -0.01 0.34 -0.04 0.00 -1.11 0.00 0.00 56.01 55.18 1s3s n LEU 224 Cb 0.39 -0.02 -0.04 0.00 0.53 0.00 0.00 43.42 44.28 1s3s n LEU 224 CO 0.40 -0.09 -0.74 0.54 -1.11 0.00 0.00 177.39 176.40 1s3s n ARG 225 N -2.73 1.46 -2.79 1.96 5.12 0.47 -4.77 116.66 115.37 1s3s n ARG 225 Ca -0.03 0.02 -0.27 0.00 -1.93 0.00 0.00 57.85 55.64 1s3s n ARG 225 Cb 0.64 -1.16 -0.03 0.00 -1.16 0.00 0.00 32.46 30.75 1s3s n ARG 225 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1s3s n HIS 226 N -2.51 3.85 -0.15 -1.55 8.25 0.31 -4.91 115.22 118.51 1s3s n HIS 226 Ca -0.12 -3.70 -0.05 0.00 -0.26 0.00 0.00 57.72 53.58 1s3s n HIS 226 Cb 0.68 -0.37 0.01 0.00 1.12 0.00 0.00 29.99 31.42 1s3s n HIS 226 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1s3s h PRO 227 N 2.87 -0.16 -1.10 -0.41 0.11 -1.67 -0.26 132.00 131.38 1s3s h PRO 227 Ca 0.19 0.01 0.32 0.00 0.11 0.00 0.00 66.00 66.63 1s3s h PRO 227 Cb 0.63 0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.73 1s3s h PRO 227 CO 0.84 -0.11 0.86 0.00 -0.21 0.00 0.00 178.00 179.38 1s3s h ALA 228 N 1.04 3.00 -0.75 -0.75 0.00 -1.91 0.11 119.26 120.02 1s3s h ALA 228 Ca 0.21 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.15 1s3s h ALA 228 Cb 0.50 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1s3s h ALA 228 CO -0.56 -1.43 0.49 1.25 0.00 0.00 0.00 179.25 179.00 1s3s h LEU 229 N 0.00 0.67 0.00 0.00 5.85 -1.38 -1.22 115.31 119.23 1s3s h LEU 229 Ca 0.52 0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.25 1s3s h LEU 229 Cb 2.24 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 43.13 1s3s h LEU 229 CO -0.01 0.42 -0.29 0.49 -0.34 0.00 0.00 178.44 178.71 1s3s n PHE 230 N -4.49 0.28 0.09 1.25 3.72 0.39 -2.79 117.46 115.91 1s3s n PHE 230 Ca 0.11 0.08 -0.15 0.00 -0.05 0.00 0.00 57.45 57.44 1s3s n PHE 230 Cb 0.25 -0.53 -0.09 0.00 -0.94 0.00 0.00 39.48 38.18 1s3s n PHE 230 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1s3s h LYS 231 N 0.00 0.37 -0.61 -1.08 3.64 -1.23 -3.16 116.57 114.49 1s3s h LYS 231 Ca 0.00 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1s3s h LYS 231 Cb 0.59 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1s3s h LYS 231 CO 0.00 1.17 0.00 0.00 -2.27 0.00 0.00 179.45 178.35 1s3s n ALA 232 N -2.55 3.70 -2.42 5.00 0.00 -1.05 -4.95 120.51 118.24 1s3s n ALA 232 Ca -0.08 -1.78 -0.23 0.00 0.00 0.00 0.00 53.44 51.35 1s3s n ALA 232 Cb 0.92 -1.11 -0.08 0.00 0.00 0.00 0.00 19.45 19.18 1s3s n ALA 232 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1s3s s ILE 233 N -2.54 0.37 0.00 0.00 1.10 -1.12 -5.06 121.20 113.96 1s3s s ILE 233 Ca 0.52 -2.00 0.00 0.00 -0.51 0.00 0.00 60.65 58.66 1s3s s ILE 233 Cb 0.39 -2.41 0.00 0.00 0.15 0.00 0.00 42.46 40.59 1s3s s ILE 233 CO 0.17 0.00 0.59 0.61 -2.11 0.00 0.00 174.94 174.20 1s3s n GLY 234 N -0.78 0.12 3.77 1.50 0.00 -1.26 -4.91 105.19 103.63 1s3s n GLY 234 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1s3s n GLY 234 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s3s s VAL 235 N -0.32 4.24 -0.23 1.61 1.01 -1.26 -5.04 120.40 120.41 1s3s s VAL 235 Ca 0.00 1.85 -0.11 0.00 0.00 0.00 0.00 61.98 63.72 1s3s s VAL 235 Cb 0.00 -4.18 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 1s3s s VAL 235 CO 0.00 0.44 0.18 -1.59 0.00 0.00 0.00 175.10 174.14 1s3s s LYS 236 N -1.34 4.09 0.56 2.72 -2.85 -1.26 -4.96 119.74 116.71 1s3s s LYS 236 Ca 0.40 -0.21 -0.09 0.00 -1.00 0.00 0.00 55.97 55.07 1s3s s LYS 236 Cb -0.23 -3.53 -0.04 0.00 -2.06 0.00 0.00 37.83 31.97 1s3s s LYS 236 CO 0.28 0.08 0.93 -1.25 0.10 0.00 0.00 175.35 175.49 1s3s s PRO 237 N 1.01 3.60 0.26 1.78 0.04 -1.26 -5.01 135.00 135.42 1s3s s PRO 237 Ca 0.09 0.55 -0.30 0.00 0.04 0.00 0.00 61.00 61.38 1s3s s PRO 237 Cb -0.13 -2.20 -0.11 0.00 0.04 0.00 0.00 34.50 32.10 1s3s s PRO 237 CO 0.04 -0.41 1.56 -2.14 0.04 0.00 0.00 177.00 176.09 1s3s s PRO 238 N -4.94 4.17 -0.19 0.56 0.02 -1.26 -4.92 135.00 128.44 1s3s s PRO 238 Ca 0.52 2.48 0.05 0.00 0.02 0.00 0.00 61.00 64.07 1s3s s PRO 238 Cb -0.11 -3.06 -0.15 0.00 0.02 0.00 0.00 34.50 31.20 1s3s s PRO 238 CO 0.49 -0.58 -0.12 0.54 -0.33 0.00 0.00 177.00 177.01 1s3s n ARG 239 N 2.53 0.76 -4.23 5.54 1.74 -1.26 -4.86 116.66 116.87 1s3s n ARG 239 Ca 0.09 0.08 -0.24 0.00 -0.77 0.00 0.00 57.85 57.01 1s3s n ARG 239 Cb 0.38 -1.41 -0.17 0.00 -1.02 0.00 0.00 32.46 30.24 1s3s n ARG 239 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1s3s s GLY 240 N -5.70 0.69 -0.07 -0.13 0.00 -1.18 0.89 107.32 101.81 1s3s s GLY 240 Ca -0.22 -0.34 0.01 0.00 0.00 0.00 0.00 44.72 44.17 1s3s s GLY 240 CO 0.53 0.46 -0.07 -0.42 0.00 0.00 0.00 173.10 173.60 1s3s s ILE 241 N 1.11 3.66 -0.18 0.90 1.01 0.32 -3.06 121.20 124.97 1s3s s ILE 241 Ca -0.07 -0.49 -0.01 0.00 0.00 0.00 0.00 60.65 60.08 1s3s s ILE 241 Cb -0.14 -2.50 -0.00 0.00 0.01 0.00 0.00 42.46 39.83 1s3s s ILE 241 CO -0.01 0.59 -0.11 -0.22 0.00 0.00 0.00 174.94 175.19 1s3s s LEU 242 N -0.73 2.63 -0.28 2.97 2.96 0.14 -1.16 118.68 125.20 1s3s s LEU 242 Ca 0.11 -0.44 -0.08 0.00 -0.22 0.00 0.00 54.13 53.50 1s3s s LEU 242 Cb -0.11 -1.63 -0.01 0.00 0.50 0.00 0.00 46.19 44.94 1s3s s LEU 242 CO 0.01 0.05 0.11 -0.76 -1.32 0.00 0.00 176.35 174.44 1s3s s LEU 243 N 1.05 3.80 0.42 -0.68 1.43 0.26 0.72 118.68 125.68 1s3s s LEU 243 Ca -0.00 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.70 1s3s s LEU 243 Cb -0.15 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.10 1s3s s LEU 243 CO -0.02 -0.13 0.63 -0.31 0.23 0.00 0.00 176.35 176.75 1s3s s TYR 244 N 1.60 3.29 0.00 0.29 2.02 0.07 -1.51 117.35 123.12 1s3s s TYR 244 Ca 0.05 0.24 0.00 0.00 -0.37 0.00 0.00 57.07 56.99 1s3s s TYR 244 Cb -0.16 -2.18 0.00 0.00 -0.40 0.00 0.00 41.96 39.22 1s3s s TYR 244 CO 0.05 -0.21 0.00 0.41 -1.57 0.00 0.00 175.55 174.23 1s3s n GLY 245 N -1.97 3.71 3.76 0.71 0.00 -1.18 -1.87 105.19 108.35 1s3s n GLY 245 Ca -0.00 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.02 1s3s n GLY 245 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1s3s s PRO 246 N -2.57 1.97 0.84 1.61 0.02 -1.26 -4.08 135.00 131.52 1s3s s PRO 246 Ca 0.00 0.98 -0.12 0.00 0.02 0.00 0.00 61.00 61.87 1s3s s PRO 246 Cb 0.00 -1.88 0.10 0.00 0.02 0.00 0.00 34.50 32.74 1s3s s PRO 246 CO 0.00 -1.79 1.19 -2.14 -0.33 0.00 0.00 177.00 173.93 1s3s s PRO 247 N -4.95 1.46 -0.47 5.54 0.02 -1.26 -3.01 135.00 132.33 1s3s s PRO 247 Ca 0.62 1.71 0.00 0.00 0.02 0.00 0.00 61.00 63.34 1s3s s PRO 247 Cb -0.17 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.59 1s3s s PRO 247 CO 0.56 -2.34 0.00 0.41 -0.33 0.00 0.00 177.00 175.30 1s3s n GLY 248 N 0.43 0.63 0.13 0.52 0.00 -1.26 -4.88 105.19 100.76 1s3s n GLY 248 Ca 0.13 -0.20 0.15 0.00 0.00 0.00 0.00 46.02 46.10 1s3s n GLY 248 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1s3s n THR 249 N -2.55 0.00 -1.40 2.61 -1.04 -1.16 -1.56 114.28 109.17 1s3s n THR 249 Ca -0.04 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 1s3s n THR 249 Cb 0.31 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.60 1s3s n THR 249 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1s3s n GLY 250 N 1.07 0.79 0.09 3.41 0.00 -1.26 -4.85 105.19 104.44 1s3s n GLY 250 Ca 0.22 -0.66 -0.13 0.00 0.00 0.00 0.00 46.02 45.45 1s3s n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s3s h LYS 251 N 0.00 0.16 -0.09 1.61 1.57 -1.94 -1.51 116.57 116.37 1s3s h LYS 251 Ca 0.00 -0.09 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1s3s h LYS 251 Cb 0.68 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.99 1s3s h LYS 251 CO 0.00 0.64 0.08 1.15 -0.57 0.00 0.00 179.45 180.75 1s3s h THR 252 N -0.32 0.76 0.34 -0.16 2.02 -1.97 -1.47 112.91 112.12 1s3s h THR 252 Ca 0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1s3s h THR 252 Cb 0.63 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 67.98 1s3s h THR 252 CO 0.02 0.00 -0.16 0.25 0.37 0.00 0.00 175.52 175.99 1s3s h LEU 253 N 0.00 -0.39 -0.82 2.58 5.85 -1.87 -2.79 115.31 117.87 1s3s h LEU 253 Ca 0.04 0.01 0.20 0.00 0.84 0.00 0.00 57.88 58.98 1s3s h LEU 253 Cb 0.20 0.10 -0.13 0.00 0.37 0.00 0.00 40.66 41.20 1s3s h LEU 253 CO -0.00 -0.17 0.23 0.40 -0.34 0.00 0.00 178.44 178.56 1s3s h ILE 254 N -0.68 0.42 0.41 4.05 2.04 -0.98 0.40 117.51 123.17 1s3s h ILE 254 Ca -0.05 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1s3s h ILE 254 Cb 0.35 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 1s3s h ILE 254 CO 0.08 0.05 -0.49 0.00 0.00 0.00 0.00 178.15 177.79 1s3s h ALA 255 N 1.70 -1.05 0.00 1.87 0.00 -1.33 0.11 119.26 120.55 1s3s h ALA 255 Ca 0.49 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 1s3s h ALA 255 Cb 0.93 0.72 -0.00 0.00 0.00 0.00 0.00 17.79 19.44 1s3s h ALA 255 CO -0.58 -1.14 -0.17 -0.09 0.00 0.00 0.00 179.25 177.27 1s3s h ARG 256 N -0.93 0.00 0.11 0.00 2.43 -1.01 -2.32 114.38 112.67 1s3s h ARG 256 Ca -0.04 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 1s3s h ARG 256 Cb 0.83 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 1s3s h ARG 256 CO -0.10 0.17 -0.05 0.00 -1.51 0.00 0.00 179.97 178.47 1s3s h ALA 257 N 1.83 -0.79 -1.16 2.80 0.00 0.50 -1.68 119.26 120.77 1s3s h ALA 257 Ca -0.00 -0.03 0.36 0.00 0.00 0.00 0.00 54.91 55.24 1s3s h ALA 257 Cb 0.30 0.06 -0.13 0.00 0.00 0.00 0.00 17.79 18.03 1s3s h ALA 257 CO 0.02 -0.78 0.72 0.28 0.00 0.00 0.00 179.25 179.50 1s3s h VAL 258 N -0.19 0.27 0.60 0.00 2.07 -0.78 0.17 116.25 118.39 1s3s h VAL 258 Ca -0.02 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1s3s h VAL 258 Cb 0.12 0.03 0.01 0.00 -1.52 0.00 0.00 31.29 29.92 1s3s h VAL 258 CO 0.03 0.04 -0.29 0.00 0.02 0.00 0.00 177.57 177.37 1s3s h ALA 259 N 1.68 -0.80 0.76 1.67 0.00 -1.35 -2.31 119.26 118.90 1s3s h ALA 259 Ca 0.74 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.41 1s3s h ALA 259 Cb 2.05 0.31 0.01 0.00 0.00 0.00 0.00 17.79 20.16 1s3s h ALA 259 CO -0.44 -0.86 -0.36 -0.91 0.00 0.00 0.00 179.25 176.67 1s3s h ASN 260 N -0.98 -0.86 0.00 0.00 2.35 0.07 0.12 115.58 116.27 1s3s h ASN 260 Ca -0.08 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1s3s h ASN 260 Cb 0.67 0.22 0.00 0.00 0.05 0.00 0.00 38.32 39.26 1s3s h ASN 260 CO 0.14 -0.62 0.37 1.21 -1.65 0.00 0.00 177.43 176.87 1s3s n GLU 261 N -5.53 0.05 -0.19 0.81 4.07 0.35 0.69 120.64 120.90 1s3s n GLU 261 Ca -0.14 0.46 0.07 0.00 -0.06 0.00 0.00 57.16 57.49 1s3s n GLU 261 Cb 0.41 -2.04 0.10 0.00 -0.06 0.00 0.00 31.44 29.85 1s3s n GLU 261 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1s3s n THR 262 N -1.79 1.33 -1.12 6.31 -2.24 -0.87 -4.32 114.28 111.58 1s3s n THR 262 Ca -0.01 -1.59 -0.08 0.00 -2.27 0.00 0.00 64.05 60.10 1s3s n THR 262 Cb 0.38 -0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.57 1s3s n THR 262 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s3s n GLY 263 N -1.00 0.80 3.70 3.38 0.00 0.22 -4.89 105.19 107.39 1s3s n GLY 263 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1s3s n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s3s s ALA 264 N -1.58 3.36 0.20 4.61 0.00 0.37 -4.97 121.76 123.75 1s3s s ALA 264 Ca 0.00 0.52 -0.32 0.00 0.00 0.00 0.00 51.96 52.15 1s3s s ALA 264 Cb 0.00 -3.43 -0.14 0.00 0.00 0.00 0.00 23.12 19.55 1s3s s ALA 264 CO 0.00 -0.53 1.37 0.34 0.00 0.00 0.00 175.76 176.94 1s3s n PHE 265 N 4.67 1.94 -4.06 0.00 7.35 -0.59 -4.39 117.46 122.38 1s3s n PHE 265 Ca 0.09 0.48 -0.32 0.00 -0.76 0.00 0.00 57.45 56.93 1s3s n PHE 265 Cb 0.48 -2.42 -0.15 0.00 0.35 0.00 0.00 39.48 37.74 1s3s n PHE 265 CO 0.00 0.00 0.00 0.12 -0.76 0.00 0.00 176.76 176.12 1s3s s PHE 266 N 0.10 2.99 -0.11 -5.13 5.36 -1.26 0.06 117.98 119.99 1s3s s PHE 266 Ca 0.72 -2.04 -0.02 0.00 -0.96 0.00 0.00 56.93 54.63 1s3s s PHE 266 Cb -0.72 -1.87 -0.03 0.00 -0.34 0.00 0.00 43.02 40.06 1s3s s PHE 266 CO 0.48 -0.84 -0.02 0.12 -1.46 0.00 0.00 175.22 173.50 1s3s s PHE 267 N 1.20 3.08 -0.18 10.12 2.19 -0.78 -4.99 117.98 128.62 1s3s s PHE 267 Ca -0.05 -0.01 -0.05 0.00 0.33 0.00 0.00 56.93 57.15 1s3s s PHE 267 Cb -0.18 -1.85 -0.03 0.00 -1.31 0.00 0.00 43.02 39.65 1s3s s PHE 267 CO -0.07 0.25 0.01 -1.17 1.83 0.00 0.00 175.22 176.06 1s3s s LEU 268 N -0.36 3.40 -0.18 6.12 2.96 -1.26 -1.08 118.68 128.27 1s3s s LEU 268 Ca 0.06 -0.11 0.00 0.00 -0.22 0.00 0.00 54.13 53.87 1s3s s LEU 268 Cb -0.12 -1.85 0.01 0.00 0.50 0.00 0.00 46.19 44.73 1s3s s LEU 268 CO 0.02 0.12 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.37 1s3s s ILE 269 N 0.64 2.28 -0.22 6.68 1.01 -0.05 -4.96 121.20 126.59 1s3s s ILE 269 Ca -0.00 -0.87 -0.05 0.00 0.00 0.00 0.00 60.65 59.73 1s3s s ILE 269 Cb -0.14 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.34 1s3s s ILE 269 CO 0.02 0.52 0.01 0.21 0.00 0.00 0.00 174.94 175.70 1s3s s ASN 270 N 1.27 4.73 0.09 3.58 3.84 -1.26 -0.71 114.94 126.48 1s3s s ASN 270 Ca 0.04 -0.27 -0.17 0.00 0.21 0.00 0.00 52.86 52.67 1s3s s ASN 270 Cb -0.13 -1.82 -0.04 0.00 -0.55 0.00 0.00 41.25 38.70 1s3s s ASN 270 CO -0.10 0.01 1.26 0.61 -2.79 0.00 0.00 177.10 176.09 1s3s n GLY 271 N 4.63 -2.72 0.36 1.21 0.00 -1.26 -1.14 105.19 106.27 1s3s n GLY 271 Ca -0.17 0.90 0.10 0.00 0.00 0.00 0.00 46.02 46.85 1s3s n GLY 271 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1s3s h PRO 272 N 0.00 0.70 -0.53 1.61 0.11 -1.88 -1.07 132.00 130.94 1s3s h PRO 272 Ca 0.09 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 66.22 1s3s h PRO 272 Cb 0.23 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 31.13 1s3s h PRO 272 CO -0.52 0.46 0.23 1.49 -0.21 0.00 0.00 178.00 179.45 1s3s h GLU 273 N 0.72 0.43 -0.05 1.05 4.57 -1.55 -1.75 114.58 118.00 1s3s h GLU 273 Ca 0.39 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.46 1s3s h GLU 273 Cb 0.52 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 1s3s h GLU 273 CO -0.16 0.28 -0.28 0.82 -1.18 0.00 0.00 179.01 178.50 1s3s h ILE 274 N 0.44 1.45 0.00 2.32 1.08 -0.51 -3.24 117.51 119.05 1s3s h ILE 274 Ca 0.25 -1.74 0.00 0.00 -0.39 0.00 0.00 64.86 62.98 1s3s h ILE 274 Cb 0.22 2.42 0.00 0.00 -3.07 0.00 0.00 36.82 36.39 1s3s h ILE 274 CO -0.21 0.49 0.00 0.23 -0.69 0.00 0.00 178.15 177.97 1s3s n MET 275 N -4.48 0.17 0.11 2.37 2.81 -0.50 -1.97 117.12 115.64 1s3s n MET 275 Ca -0.09 0.17 0.09 0.00 -1.81 0.00 0.00 57.70 56.07 1s3s n MET 275 Cb 0.48 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.50 1s3s n MET 275 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1s3s h SER 276 N 0.00 0.00 -3.36 7.83 4.64 -1.34 -3.47 113.55 117.85 1s3s h SER 276 Ca 0.00 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.92 1s3s h SER 276 Cb 0.11 0.00 0.20 0.00 -0.31 0.00 0.00 62.40 62.40 1s3s h SER 276 CO 0.00 0.11 0.07 -0.54 -0.87 0.00 0.00 176.83 175.60 1s3s s LYS 277 N -3.26 -1.81 0.35 4.77 -0.14 -0.83 -5.03 119.74 113.78 1s3s s LYS 277 Ca 0.00 -0.09 -0.09 0.00 -1.36 0.00 0.00 55.97 54.42 1s3s s LYS 277 Cb 0.09 -1.53 -0.06 0.00 -1.68 0.00 0.00 37.83 34.64 1s3s s LYS 277 CO 0.78 -4.09 0.69 -0.51 -0.76 0.00 0.00 175.35 171.45 1s3s s LEU 278 N -7.20 3.95 0.12 3.17 1.43 -1.26 -4.77 118.68 114.12 1s3s s LEU 278 Ca 0.71 1.01 -0.35 0.00 -1.03 0.00 0.00 54.13 54.47 1s3s s LEU 278 Cb -0.09 -3.86 -0.15 0.00 0.03 0.00 0.00 46.19 42.12 1s3s s LEU 278 CO 0.56 -0.29 1.45 0.00 0.23 0.00 0.00 176.35 178.30 1s3s n ALA 279 N -0.99 0.09 0.00 4.21 0.00 -1.26 -0.27 120.51 122.29 1s3s n ALA 279 Ca 0.01 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1s3s n ALA 279 Cb 0.54 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1s3s n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s3s n GLY 280 N 2.94 2.58 0.23 0.00 0.00 -1.26 -4.66 105.19 105.02 1s3s n GLY 280 Ca 0.18 -0.58 0.10 0.00 0.00 0.00 0.00 46.02 45.71 1s3s n GLY 280 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1s3s h GLU 281 N 0.00 0.00 0.17 1.61 4.81 -1.01 0.11 114.58 120.27 1s3s h GLU 281 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1s3s h GLU 281 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1s3s h GLU 281 CO 0.00 0.23 -0.08 1.03 -0.73 0.00 0.00 179.01 179.46 1s3s h SER 282 N 0.00 -0.19 0.04 1.04 0.87 -1.28 -2.27 113.55 111.76 1s3s h SER 282 Ca -0.00 -0.30 -0.07 0.00 -1.23 0.00 0.00 61.79 60.19 1s3s h SER 282 Cb 0.62 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.62 1s3s h SER 282 CO 0.03 0.23 -0.19 -0.33 -0.53 0.00 0.00 176.83 176.04 1s3s h GLU 283 N -0.66 0.28 -0.01 2.24 3.07 -1.80 -2.92 114.58 114.78 1s3s h GLU 283 Ca -0.02 -0.08 0.03 0.00 -0.50 0.00 0.00 59.36 58.79 1s3s h GLU 283 Cb 0.48 -0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 28.31 1s3s h GLU 283 CO 0.04 0.47 -0.32 1.03 -1.40 0.00 0.00 179.01 178.83 1s3s h SER 284 N 0.26 -0.97 -0.98 1.42 0.87 -0.65 -2.37 113.55 111.13 1s3s h SER 284 Ca 0.05 0.13 0.01 0.00 -1.23 0.00 0.00 61.79 60.75 1s3s h SER 284 Cb 0.50 0.39 -0.05 0.00 -0.44 0.00 0.00 62.40 62.80 1s3s h SER 284 CO 0.03 -0.38 0.65 0.78 -0.53 0.00 0.00 176.83 177.38 1s3s h ASN 285 N -0.47 1.12 -0.47 6.23 2.35 -1.22 -2.67 115.58 120.45 1s3s h ASN 285 Ca 0.06 -0.03 0.08 0.00 -0.55 0.00 0.00 56.30 55.87 1s3s h ASN 285 Cb 0.56 -0.28 -0.07 0.00 0.05 0.00 0.00 38.32 38.58 1s3s h ASN 285 CO -0.27 0.80 0.05 -0.07 -1.65 0.00 0.00 177.43 176.29 1s3s h LEU 286 N 1.32 -0.09 0.07 1.61 3.38 -1.33 0.16 115.31 120.43 1s3s h LEU 286 Ca 0.37 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.43 1s3s h LEU 286 Cb -0.13 0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1s3s h LEU 286 CO -0.09 -0.01 -0.04 0.03 0.09 0.00 0.00 178.44 178.42 1s3s h ARG 287 N 0.17 -0.10 -0.45 1.13 3.08 -1.19 -2.14 114.38 114.89 1s3s h ARG 287 Ca 0.24 0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.39 1s3s h ARG 287 Cb 0.33 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1s3s h ARG 287 CO -0.35 0.10 0.31 -0.22 -1.07 0.00 0.00 179.97 178.75 1s3s h LYS 288 N -0.28 0.15 0.80 0.04 3.11 -1.14 0.15 116.57 119.41 1s3s h LYS 288 Ca -0.01 -0.01 -0.04 0.00 -2.81 0.00 0.00 60.65 57.78 1s3s h LYS 288 Cb 0.24 -0.03 0.01 0.00 -1.00 0.00 0.00 32.23 31.44 1s3s h LYS 288 CO 0.02 0.10 -0.38 0.00 -2.81 0.00 0.00 179.45 176.38 1s3s h ALA 289 N 1.77 -1.07 -0.62 5.00 0.00 -0.16 0.72 119.26 124.90 1s3s h ALA 289 Ca 0.21 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.92 1s3s h ALA 289 Cb 0.63 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 1s3s h ALA 289 CO -0.03 -1.04 0.36 0.74 0.00 0.00 0.00 179.25 179.28 1s3s h PHE 290 N -1.20 0.66 0.05 0.00 -1.00 -0.74 -1.94 116.94 112.76 1s3s h PHE 290 Ca -0.11 0.02 0.01 0.00 2.81 0.00 0.00 57.97 60.71 1s3s h PHE 290 Cb 0.83 -0.21 -0.05 0.00 3.61 0.00 0.00 35.95 40.14 1s3s h PHE 290 CO -0.00 0.35 -0.47 0.93 -1.61 0.00 0.00 178.31 177.51 1s3s h GLU 291 N 0.69 -0.60 -0.86 1.51 5.08 -0.58 0.48 114.58 120.29 1s3s h GLU 291 Ca 0.26 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.81 1s3s h GLU 291 Cb 0.09 0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.41 1s3s h GLU 291 CO -0.14 -0.40 0.56 1.49 -1.00 0.00 0.00 179.01 179.52 1s3s h GLU 292 N -0.62 0.59 0.00 2.33 4.81 -0.66 0.17 114.58 121.19 1s3s h GLU 292 Ca 0.00 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 1s3s h GLU 292 Cb 0.65 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 1s3s h GLU 292 CO -0.29 0.39 -0.25 0.00 -0.73 0.00 0.00 179.01 178.13 1s3s h ALA 293 N 1.61 1.07 -0.03 2.92 0.00 -0.39 -2.86 119.26 121.59 1s3s h ALA 293 Ca 0.43 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.94 1s3s h ALA 293 Cb 0.79 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.56 1s3s h ALA 293 CO -0.19 0.32 -0.68 0.93 0.00 0.00 0.00 179.25 179.63 1s3s h GLU 294 N 0.00 0.51 0.14 0.00 5.08 0.14 -3.21 114.58 117.24 1s3s h GLU 294 Ca -0.00 -0.51 0.01 0.00 -1.00 0.00 0.00 59.36 57.85 1s3s h GLU 294 Cb 0.71 0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.05 1s3s h GLU 294 CO 0.03 1.15 -0.47 0.87 -1.00 0.00 0.00 179.01 179.59 1s3s h LYS 295 N 0.08 -0.67 -1.36 2.33 1.57 -1.12 -3.08 116.57 114.33 1s3s h LYS 295 Ca -0.08 0.05 -0.47 0.00 -1.87 0.00 0.00 60.65 58.28 1s3s h LYS 295 Cb 1.36 0.15 -0.20 0.00 0.08 0.00 0.00 32.23 33.62 1s3s h LYS 295 CO 0.14 -0.45 0.60 0.09 -0.57 0.00 0.00 179.45 179.26 1s3s n ASN 296 N -5.15 6.96 -4.82 0.86 3.02 -1.14 -4.98 115.26 110.01 1s3s n ASN 296 Ca -0.08 -3.36 -0.32 0.00 -0.03 0.00 0.00 54.58 50.79 1s3s n ASN 296 Cb 0.37 -1.04 -0.00 0.00 -0.61 0.00 0.00 39.78 38.50 1s3s n ASN 296 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s3s s ALA 297 N -2.61 2.88 0.30 5.41 0.00 -1.17 -4.31 121.76 122.26 1s3s s ALA 297 Ca 0.45 0.28 -0.28 0.00 0.00 0.00 0.00 51.96 52.41 1s3s s ALA 297 Cb 0.35 -3.18 -0.14 0.00 0.00 0.00 0.00 23.12 20.15 1s3s s ALA 297 CO -0.02 -0.61 1.05 -2.30 0.00 0.00 0.00 175.76 173.88 1s3s n PRO 298 N -1.95 1.47 -3.71 0.00 -0.02 -1.26 -5.01 135.00 124.53 1s3s n PRO 298 Ca 0.08 0.52 -0.14 0.00 -2.02 0.00 0.00 63.50 61.94 1s3s n PRO 298 Cb 0.53 -1.92 -0.08 0.00 -0.02 0.00 0.00 33.50 32.02 1s3s n PRO 298 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s3s s ALA 299 N -1.06 -0.97 -0.16 3.55 0.00 -1.19 -1.54 121.76 120.41 1s3s s ALA 299 Ca 0.58 0.45 0.00 0.00 0.00 0.00 0.00 51.96 53.00 1s3s s ALA 299 Cb -0.68 0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.59 1s3s s ALA 299 CO 0.60 -0.32 -0.13 0.42 0.00 0.00 0.00 175.76 176.34 1s3s s ILE 300 N -1.59 1.52 -0.17 0.00 1.01 0.11 -1.92 121.20 120.15 1s3s s ILE 300 Ca -0.11 -0.67 -0.15 0.00 0.00 0.00 0.00 60.65 59.72 1s3s s ILE 300 Cb -0.03 -1.48 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 1s3s s ILE 300 CO 0.04 0.39 0.35 -0.63 0.00 0.00 0.00 174.94 175.08 1s3s s ILE 301 N 1.50 5.25 -0.25 2.92 1.01 -0.46 -1.87 121.20 129.30 1s3s s ILE 301 Ca 0.04 0.64 -0.04 0.00 0.00 0.00 0.00 60.65 61.29 1s3s s ILE 301 Cb -0.13 -3.69 0.01 0.00 0.01 0.00 0.00 42.46 38.66 1s3s s ILE 301 CO -0.10 0.33 -0.02 0.12 0.00 0.00 0.00 174.94 175.27 1s3s s PHE 302 N 0.84 3.05 -0.43 3.97 5.36 -0.24 0.30 117.98 130.82 1s3s s PHE 302 Ca 0.18 -1.17 -0.18 0.00 -0.96 0.00 0.00 56.93 54.80 1s3s s PHE 302 Cb -0.14 -2.13 0.02 0.00 -0.34 0.00 0.00 43.02 40.44 1s3s s PHE 302 CO 0.06 -0.62 0.48 0.42 -1.46 0.00 0.00 175.22 174.10 1s3s s ILE 303 N 1.43 5.03 0.00 3.12 1.01 0.33 -0.87 121.20 131.24 1s3s s ILE 303 Ca 0.03 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.43 1s3s s ILE 303 Cb -0.16 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.23 1s3s s ILE 303 CO -0.02 -0.47 0.37 -0.67 0.00 0.00 0.00 174.94 174.15 1s3s n ASP 304 N 5.75 0.00 -4.00 3.58 -0.08 0.11 -0.97 116.55 120.94 1s3s n ASP 304 Ca -0.06 0.37 -0.42 0.00 -1.51 0.00 0.00 54.79 53.17 1s3s n ASP 304 Cb 0.47 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.94 1s3s n ASP 304 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1s3s n GLU 305 N -0.45 4.31 -0.26 -0.67 1.02 -1.26 -3.51 120.64 119.82 1s3s n GLU 305 Ca 0.00 -4.56 0.05 0.00 -0.02 0.00 0.00 57.16 52.64 1s3s n GLU 305 Cb 0.00 -2.50 0.16 0.00 -0.02 0.00 0.00 31.44 29.08 1s3s n GLU 305 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1s3s h LEU 306 N 5.47 -0.31 -1.00 -4.62 5.85 -1.68 0.26 115.31 119.27 1s3s h LEU 306 Ca 0.20 0.19 0.00 0.00 0.84 0.00 0.00 57.88 59.11 1s3s h LEU 306 Cb 0.64 0.33 0.00 0.00 0.37 0.00 0.00 40.66 42.00 1s3s h LEU 306 CO 1.28 -0.17 0.02 -0.90 -0.34 0.00 0.00 178.44 178.34 1s3s n ASP 307 N -5.33 0.39 -0.02 1.25 5.68 -1.26 -0.43 116.55 116.83 1s3s n ASP 307 Ca 0.14 0.67 0.13 0.00 -0.50 0.00 0.00 54.79 55.23 1s3s n ASP 307 Cb 0.48 -0.72 0.50 0.00 -1.14 0.00 0.00 41.12 40.25 1s3s n ASP 307 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1s3s n ALA 308 N -1.68 2.81 -0.01 2.12 0.00 0.91 -3.86 120.51 120.79 1s3s n ALA 308 Ca -0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 53.44 53.21 1s3s n ALA 308 Cb 0.05 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.16 1s3s n ALA 308 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1s3s n ILE 309 N -1.39 0.10 -3.32 0.00 5.41 0.43 -4.82 119.36 115.77 1s3s n ILE 309 Ca 0.08 -0.05 -0.26 0.00 1.00 0.00 0.00 62.75 63.52 1s3s n ILE 309 Cb 0.32 -0.68 -0.07 0.00 -0.71 0.00 0.00 39.64 38.50 1s3s n ILE 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1s3s n ALA 310 N -2.41 3.73 -2.00 -1.39 0.00 -0.35 -4.17 120.51 113.92 1s3s n ALA 310 Ca -0.03 -4.44 -0.37 0.00 0.00 0.00 0.00 53.44 48.59 1s3s n ALA 310 Cb 0.54 -0.87 -0.06 0.00 0.00 0.00 0.00 19.45 19.06 1s3s n ALA 310 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1s3s s PRO 311 N -2.31 4.40 0.98 0.00 0.04 -1.25 -1.94 135.00 134.92 1s3s s PRO 311 Ca 0.40 1.04 -0.15 0.00 0.04 0.00 0.00 61.00 62.33 1s3s s PRO 311 Cb 0.17 -2.96 0.01 0.00 0.04 0.00 0.00 34.50 31.76 1s3s s PRO 311 CO -0.05 0.42 0.11 1.17 0.04 0.00 0.00 177.00 178.69 1s3s n LYS 312 N 0.91 -0.41 -0.25 4.56 4.81 -1.16 -4.50 118.16 122.12 1s3s n LYS 312 Ca -0.02 -0.09 0.04 0.00 -0.87 0.00 0.00 58.31 57.37 1s3s n LYS 312 Cb 0.50 -1.68 0.15 0.00 0.02 0.00 0.00 35.03 34.03 1s3s n LYS 312 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1s3s h ARG 313 N -1.53 0.11 -1.07 1.64 2.47 -1.94 0.53 114.38 114.60 1s3s h ARG 313 Ca -0.45 -0.01 0.30 0.00 -1.26 0.00 0.00 59.98 58.56 1s3s h ARG 313 Cb 1.30 -0.03 -0.06 0.00 -1.65 0.00 0.00 29.97 29.53 1s3s h ARG 313 CO 0.33 0.07 0.74 0.93 0.56 0.00 0.00 179.97 182.60 1s3s h GLU 314 N 0.11 0.13 -0.27 0.04 3.07 -2.01 -0.07 114.58 115.58 1s3s h GLU 314 Ca 0.40 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 1s3s h GLU 314 Cb 0.69 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.57 1s3s h GLU 314 CO -0.63 0.08 0.00 1.63 -1.40 0.00 0.00 179.01 178.69 1s3s n LYS 315 N -4.35 2.09 -3.66 2.33 4.76 0.13 -4.99 118.16 114.48 1s3s n LYS 315 Ca 0.24 -1.95 -0.23 0.00 -2.87 0.00 0.00 58.31 53.51 1s3s n LYS 315 Cb 1.06 -1.38 -0.02 0.00 -1.84 0.00 0.00 35.03 32.85 1s3s n LYS 315 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1s3s s THR 316 N -1.25 5.18 -0.34 -0.18 -1.32 -0.04 -4.93 115.64 112.76 1s3s s THR 316 Ca 0.28 -0.71 -0.01 0.00 -1.21 0.00 0.00 61.69 60.04 1s3s s THR 316 Cb 0.17 -3.86 0.28 0.00 -1.51 0.00 0.00 72.50 67.57 1s3s s THR 316 CO 0.24 -0.45 1.23 0.00 -2.21 0.00 0.00 174.62 173.42 1s3s n HIS 317 N -1.59 -0.71 -3.61 9.09 1.44 -1.26 -4.99 115.22 113.59 1s3s n HIS 317 Ca -0.07 -0.77 0.02 0.00 -2.01 0.00 0.00 57.72 54.89 1s3s n HIS 317 Cb 0.57 1.13 -0.06 0.00 0.12 0.00 0.00 29.99 31.74 1s3s n HIS 317 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1s3s s GLY 318 N -0.35 0.48 0.55 -1.39 0.00 -1.26 -4.92 107.32 100.43 1s3s s GLY 318 Ca 0.26 3.69 0.25 0.00 0.00 0.00 0.00 44.72 48.93 1s3s s GLY 318 CO -0.10 2.80 2.03 -2.09 0.00 0.00 0.00 173.10 175.74 1s3s h GLU 319 N 5.50 0.00 0.02 2.90 4.22 -2.01 0.42 114.58 125.62 1s3s h GLU 319 Ca -0.25 0.00 -0.34 0.00 0.08 0.00 0.00 59.36 58.85 1s3s h GLU 319 Cb 1.16 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.35 1s3s h GLU 319 CO 0.21 0.00 -2.05 0.28 -2.18 0.00 0.00 179.01 175.27 1s3s n VAL 320 N -4.20 1.55 0.18 0.32 0.31 -1.26 -3.30 118.33 111.92 1s3s n VAL 320 Ca 0.06 -0.78 -0.14 0.00 -0.01 0.00 0.00 64.34 63.47 1s3s n VAL 320 Cb 0.48 -0.97 -0.08 0.00 -0.91 0.00 0.00 33.84 32.35 1s3s n VAL 320 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1s3s h GLU 321 N 0.01 -0.37 -0.56 5.55 4.39 -1.58 -2.59 114.58 119.43 1s3s h GLU 321 Ca -0.42 0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.33 1s3s h GLU 321 Cb 2.08 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 30.78 1s3s h GLU 321 CO 0.05 -0.22 0.33 -0.09 -1.16 0.00 0.00 179.01 177.92 1s3s h ARG 322 N -0.42 0.64 -0.87 2.33 2.43 -1.15 -2.79 114.38 114.55 1s3s h ARG 322 Ca -0.04 -0.04 0.11 0.00 -0.81 0.00 0.00 59.98 59.20 1s3s h ARG 322 Cb 0.32 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 29.66 1s3s h ARG 322 CO 0.06 0.42 0.56 -0.09 -1.51 0.00 0.00 179.97 179.42 1s3s h ARG 323 N 0.66 0.77 -0.09 0.20 2.43 -1.51 -1.68 114.38 115.15 1s3s h ARG 323 Ca 0.22 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.27 1s3s h ARG 323 Cb 0.03 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 1s3s h ARG 323 CO -0.10 0.51 -0.25 0.82 -1.51 0.00 0.00 179.97 179.44 1s3s h ILE 324 N 0.79 1.40 -0.19 1.20 2.04 -1.20 -0.87 117.51 120.67 1s3s h ILE 324 Ca 0.41 -1.57 0.04 0.00 1.00 0.00 0.00 64.86 64.74 1s3s h ILE 324 Cb 0.51 2.18 -0.04 0.00 -0.74 0.00 0.00 36.82 38.73 1s3s h ILE 324 CO -0.18 0.45 -0.07 0.58 0.00 0.00 0.00 178.15 178.93 1s3s h VAL 325 N -0.12 0.75 -0.36 1.67 2.07 -1.29 0.16 116.25 119.12 1s3s h VAL 325 Ca -0.00 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.59 1s3s h VAL 325 Cb 0.86 0.75 -0.08 0.00 -1.52 0.00 0.00 31.29 31.29 1s3s h VAL 325 CO 0.05 0.00 -0.24 0.28 0.02 0.00 0.00 177.57 177.69 1s3s h SER 326 N -0.04 -0.78 -0.53 0.57 0.02 -1.29 -0.22 113.55 111.28 1s3s h SER 326 Ca 0.10 0.16 0.11 0.00 -0.84 0.00 0.00 61.79 61.31 1s3s h SER 326 Cb 0.19 0.39 -0.10 0.00 0.14 0.00 0.00 62.40 63.02 1s3s h SER 326 CO -0.22 -0.26 -0.17 -0.61 -1.14 0.00 0.00 176.83 174.43 1s3s h GLN 327 N -0.19 -0.04 -0.60 3.45 5.75 -0.16 0.26 115.11 123.59 1s3s h GLN 327 Ca 0.18 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.71 1s3s h GLN 327 Cb 0.46 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 28.98 1s3s h GLN 327 CO -0.47 -0.03 0.35 1.25 -2.65 0.00 0.00 178.83 177.29 1s3s h LEU 328 N -0.04 0.55 -0.38 -2.39 5.85 0.65 -1.51 115.31 118.04 1s3s h LEU 328 Ca 0.25 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.99 1s3s h LEU 328 Cb 0.42 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1s3s h LEU 328 CO -0.56 0.38 0.25 -0.07 -0.34 0.00 0.00 178.44 178.09 1s3s h LEU 329 N 0.68 0.42 -1.11 2.25 3.38 0.03 -2.59 115.31 118.37 1s3s h LEU 329 Ca 0.25 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.26 1s3s h LEU 329 Cb 0.07 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 1s3s h LEU 329 CO -0.12 0.30 0.61 0.74 0.09 0.00 0.00 178.44 180.05 1s3s h THR 330 N 0.50 1.12 -0.26 0.22 2.02 -0.39 -1.47 112.91 114.65 1s3s h THR 330 Ca 0.14 -0.38 -0.08 0.00 0.77 0.00 0.00 66.41 66.86 1s3s h THR 330 Cb -0.04 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.26 1s3s h THR 330 CO -0.04 0.20 -0.17 -0.07 0.37 0.00 0.00 175.52 175.82 1s3s h LEU 331 N 1.12 0.43 -0.17 2.58 3.38 -1.01 0.06 115.31 121.70 1s3s h LEU 331 Ca 0.38 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 58.17 1s3s h LEU 331 Cb 0.09 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1s3s h LEU 331 CO -0.13 0.62 -0.15 0.24 0.09 0.00 0.00 178.44 179.11 1s3s h MET 332 N 0.41 0.40 0.11 1.13 2.86 -0.97 -3.14 114.93 115.73 1s3s h MET 332 Ca 0.07 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1s3s h MET 332 Cb 0.53 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.20 1s3s h MET 332 CO 0.03 0.76 -0.05 -0.44 1.06 0.00 0.00 176.91 178.27 1s3s h ASP 333 N 0.05 -0.12 0.00 1.22 3.32 -1.07 -2.31 116.42 117.51 1s3s h ASP 333 Ca 0.03 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1s3s h ASP 333 Cb 0.68 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1s3s h ASP 333 CO 0.04 -0.03 0.00 0.61 -1.72 0.00 0.00 179.24 178.14 1s3s n GLY 334 N -0.98 0.92 3.02 2.75 0.00 -0.01 -4.48 105.19 106.40 1s3s n GLY 334 Ca -0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 1s3s n GLY 334 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1s3s s LEU 335 N 0.00 4.73 0.17 0.99 2.96 -0.87 -4.99 118.68 121.67 1s3s s LEU 335 Ca 0.00 -2.70 -0.10 0.00 -0.22 0.00 0.00 54.13 51.12 1s3s s LEU 335 Cb 0.00 -1.71 -0.07 0.00 0.50 0.00 0.00 46.19 44.91 1s3s s LEU 335 CO 0.00 -0.33 0.50 -0.54 -1.32 0.00 0.00 176.35 174.66 1s3s s LYS 336 N 0.16 3.80 0.49 1.98 1.02 -1.26 -4.98 119.74 120.96 1s3s s LYS 336 Ca 0.15 0.25 0.43 0.00 0.02 0.00 0.00 55.97 56.82 1s3s s LYS 336 Cb -0.23 -2.79 1.57 0.00 -0.52 0.00 0.00 37.83 35.86 1s3s s LYS 336 CO -0.03 0.41 1.47 1.04 -0.92 0.00 0.00 175.35 177.33 1s3s n GLN 337 N 0.26 -0.01 0.24 1.68 3.00 -1.26 -0.32 117.38 120.97 1s3s n GLN 337 Ca -0.03 1.07 0.09 0.00 -0.01 0.00 0.00 57.00 58.13 1s3s n GLN 337 Cb 0.52 -2.35 0.59 0.00 0.00 0.00 0.00 30.24 29.00 1s3s n GLN 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1s3s h ARG 338 N 0.00 0.00 0.00 -1.09 2.47 -1.96 -2.73 114.38 111.08 1s3s h ARG 338 Ca 0.87 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 59.56 1s3s h ARG 338 Cb 3.32 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 31.63 1s3s h ARG 338 CO -0.14 0.19 -0.17 0.00 0.56 0.00 0.00 179.97 180.42 1s3s h ALA 339 N 1.81 1.64 -0.77 0.04 0.00 -1.06 -3.47 119.26 117.45 1s3s h ALA 339 Ca -0.00 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 1s3s h ALA 339 Cb 0.44 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 1s3s h ALA 339 CO 0.02 0.21 -0.20 0.72 0.00 0.00 0.00 179.25 180.01 1s3s n HIS 340 N -4.22 -0.17 -4.04 0.00 8.25 -1.03 -4.62 115.22 109.39 1s3s n HIS 340 Ca -0.02 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.14 1s3s n HIS 340 Cb 0.24 -2.02 -0.06 0.00 1.12 0.00 0.00 29.99 29.27 1s3s n HIS 340 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1s3s s VAL 341 N -2.39 4.58 -0.06 1.59 1.01 -1.26 -3.14 120.40 120.73 1s3s s VAL 341 Ca 0.00 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.23 1s3s s VAL 341 Cb 0.00 -3.22 0.01 0.00 0.00 0.00 0.00 36.38 33.17 1s3s s VAL 341 CO 0.00 0.10 -0.13 -0.63 0.00 0.00 0.00 175.10 174.45 1s3s s ILE 342 N -1.43 1.15 -0.17 2.22 1.01 -0.81 -4.79 121.20 118.38 1s3s s ILE 342 Ca 0.30 -0.50 -0.08 0.00 0.00 0.00 0.00 60.65 60.37 1s3s s ILE 342 Cb -0.12 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 1s3s s ILE 342 CO 0.22 0.36 0.11 -0.69 0.00 0.00 0.00 174.94 174.94 1s3s s VAL 343 N 0.59 5.19 -0.11 2.92 1.01 0.26 -1.35 120.40 128.90 1s3s s VAL 343 Ca -0.13 0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.97 1s3s s VAL 343 Cb -0.15 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 32.92 1s3s s VAL 343 CO 0.04 0.51 -0.15 -0.04 0.00 0.00 0.00 175.10 175.45 1s3s s MET 344 N -0.11 2.20 0.18 2.72 -1.94 0.15 0.12 119.30 122.62 1s3s s MET 344 Ca 0.09 -0.55 0.10 0.00 -1.71 0.00 0.00 55.69 53.61 1s3s s MET 344 Cb -0.12 -1.89 -0.04 0.00 2.01 0.00 0.00 34.83 34.80 1s3s s MET 344 CO 0.00 -0.07 -0.21 0.00 -0.01 0.00 0.00 175.02 174.74 1s3s s ALA 345 N 1.02 2.22 -0.02 3.03 0.00 -0.31 0.12 121.76 127.82 1s3s s ALA 345 Ca -0.06 -1.55 0.06 0.00 0.00 0.00 0.00 51.96 50.41 1s3s s ALA 345 Cb -0.15 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 22.71 1s3s s ALA 345 CO -0.02 0.31 -0.21 0.00 0.00 0.00 0.00 175.76 175.85 1s3s s ALA 346 N -1.89 1.72 0.24 0.00 0.00 -0.14 -0.58 121.76 121.11 1s3s s ALA 346 Ca 0.18 -0.88 -0.10 0.00 0.00 0.00 0.00 51.96 51.16 1s3s s ALA 346 Cb -0.07 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.60 1s3s s ALA 346 CO 0.08 0.41 0.40 -0.08 0.00 0.00 0.00 175.76 176.58 1s3s s THR 347 N -0.45 0.00 0.09 0.00 -1.32 -0.57 -2.63 115.64 110.76 1s3s s THR 347 Ca 0.07 -1.55 -0.04 0.00 -1.21 0.00 0.00 61.69 58.96 1s3s s THR 347 Cb -0.08 -2.30 -0.27 0.00 -1.51 0.00 0.00 72.50 68.34 1s3s s THR 347 CO -0.01 0.00 1.17 0.78 -2.21 0.00 0.00 174.62 174.35 1s3s h ASN 348 N 2.33 0.45 -4.26 8.08 -0.26 -1.86 -3.11 115.58 116.94 1s3s h ASN 348 Ca -0.28 -0.45 0.25 0.00 -0.56 0.00 0.00 56.30 55.25 1s3s h ASN 348 Cb 1.25 -0.14 -0.19 0.00 -1.06 0.00 0.00 38.32 38.18 1s3s h ASN 348 CO 0.39 1.33 0.80 0.00 -1.06 0.00 0.00 177.43 178.90 1s3s s ARG 349 N -2.76 0.32 0.15 0.81 1.70 -1.26 -3.19 118.95 114.71 1s3s s ARG 349 Ca -0.04 -0.12 -0.30 0.00 -0.47 0.00 0.00 55.73 54.80 1s3s s ARG 349 Cb 0.07 0.15 -0.07 0.00 -0.57 0.00 0.00 34.95 34.53 1s3s s ARG 349 CO 0.88 -0.14 1.51 -1.35 -1.08 0.00 0.00 175.30 175.13 1s3s h PRO 350 N 2.00 -0.06 -0.84 3.89 0.11 -1.96 -1.59 132.00 133.54 1s3s h PRO 350 Ca -0.09 0.00 0.31 0.00 0.11 0.00 0.00 66.00 66.33 1s3s h PRO 350 Cb 1.17 0.01 -0.15 0.00 0.11 0.00 0.00 31.00 32.14 1s3s h PRO 350 CO 0.23 -0.04 0.29 0.09 -0.21 0.00 0.00 178.00 178.36 1s3s n ASN 351 N -5.16 0.15 -0.06 -2.05 5.03 -1.26 -1.96 115.26 109.96 1s3s n ASN 351 Ca 0.01 1.41 -0.06 0.00 0.87 0.00 0.00 54.58 56.81 1s3s n ASN 351 Cb 0.26 -0.62 -0.04 0.00 -1.02 0.00 0.00 39.78 38.35 1s3s n ASN 351 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1s3s h SER 352 N 0.00 -0.84 -4.20 6.41 0.02 -1.70 -3.44 113.55 109.81 1s3s h SER 352 Ca 0.64 0.11 -0.51 0.00 -0.84 0.00 0.00 61.79 61.19 1s3s h SER 352 Cb 1.58 0.34 0.17 0.00 0.14 0.00 0.00 62.40 64.62 1s3s h SER 352 CO -0.70 -0.19 0.25 -0.63 -1.14 0.00 0.00 176.83 174.42 1s3s s ILE 353 N -4.19 2.62 -0.12 3.27 -1.09 -0.83 -3.01 121.20 117.85 1s3s s ILE 353 Ca -0.07 0.20 -0.27 0.00 -2.23 0.00 0.00 60.65 58.29 1s3s s ILE 353 Cb 0.04 -2.46 -0.02 0.00 -1.58 0.00 0.00 42.46 38.44 1s3s s ILE 353 CO 0.28 -0.27 0.89 -0.62 -1.23 0.00 0.00 174.94 173.99 1s3s s ASP 354 N -3.03 7.09 0.52 3.58 2.15 -0.82 -3.96 116.67 122.20 1s3s s ASP 354 Ca 0.64 1.34 0.43 0.00 0.43 0.00 0.00 52.55 55.40 1s3s s ASP 354 Cb -0.20 -2.50 1.64 0.00 -0.30 0.00 0.00 42.92 41.57 1s3s s ASP 354 CO 0.58 -0.38 1.60 -0.65 -0.17 0.00 0.00 175.17 176.14 1s3s h PRO 355 N 7.15 0.01 -0.73 4.34 0.11 -1.93 -0.16 132.00 140.79 1s3s h PRO 355 Ca -0.32 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.85 1s3s h PRO 355 Cb 1.15 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 1s3s h PRO 355 CO 0.83 0.01 0.48 0.00 -0.21 0.00 0.00 178.00 179.11 1s3s h ALA 356 N 1.23 1.69 0.00 -0.75 0.00 -2.00 -1.82 119.26 117.62 1s3s h ALA 356 Ca 0.89 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.78 1s3s h ALA 356 Cb 3.34 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 20.93 1s3s h ALA 356 CO -0.16 0.20 0.00 1.28 0.00 0.00 0.00 179.25 180.57 1s3s n LEU 357 N -4.48 0.26 0.10 0.00 4.77 -0.07 -2.04 117.00 115.54 1s3s n LEU 357 Ca 0.11 0.59 0.03 0.00 -0.03 0.00 0.00 56.01 56.70 1s3s n LEU 357 Cb 0.22 -0.59 -0.01 0.00 -2.33 0.00 0.00 43.42 40.72 1s3s n LEU 357 CO 0.34 -0.53 0.16 0.03 -1.33 0.00 0.00 177.39 176.05 1s3s h ARG 358 N 0.00 0.00 -6.08 3.23 2.47 -1.50 -2.26 114.38 110.24 1s3s h ARG 358 Ca 0.00 0.00 -0.76 0.00 -1.26 0.00 0.00 59.98 57.96 1s3s h ARG 358 Cb 0.15 0.00 0.05 0.00 -1.65 0.00 0.00 29.97 28.53 1s3s h ARG 358 CO 0.00 0.36 0.15 -2.13 0.56 0.00 0.00 179.97 178.91 1s3s n ARG 359 N -3.05 0.32 -0.59 0.04 0.63 -0.87 -4.17 116.66 108.97 1s3s n ARG 359 Ca -0.02 0.11 0.45 0.00 -0.92 0.00 0.00 57.85 57.47 1s3s n ARG 359 Cb 0.75 -1.64 0.70 0.00 0.45 0.00 0.00 32.46 32.72 1s3s n ARG 359 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1s3s n PHE 360 N 1.73 0.11 1.99 -0.14 3.01 -1.26 0.91 117.46 123.81 1s3s n PHE 360 Ca 0.19 0.11 0.13 0.00 1.01 0.00 0.00 57.45 58.89 1s3s n PHE 360 Cb 0.12 -0.55 0.74 0.00 -0.01 0.00 0.00 39.48 39.78 1s3s n PHE 360 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1s3s n GLY 361 N -1.75 -0.99 0.00 1.37 0.00 -1.26 -4.56 105.19 98.00 1s3s n GLY 361 Ca 0.39 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1s3s n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s3s n ARG 362 N -0.89 0.00 -2.18 1.61 1.74 0.26 -4.59 116.66 112.61 1s3s n ARG 362 Ca 0.19 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.84 1s3s n ARG 362 Cb 0.09 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.53 1s3s n ARG 362 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1s3s n PHE 363 N 0.00 3.87 1.35 -1.55 3.72 -0.85 -3.13 117.46 120.87 1s3s n PHE 363 Ca 0.00 -2.95 0.13 0.00 -0.05 0.00 0.00 57.45 54.59 1s3s n PHE 363 Cb 0.00 -2.43 0.40 0.00 -0.94 0.00 0.00 39.48 36.51 1s3s n PHE 363 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1s3s n ASP 364 N 6.25 1.93 -4.33 4.37 5.68 -1.22 -4.38 116.55 124.86 1s3s n ASP 364 Ca 0.47 -1.65 -0.32 0.00 -0.50 0.00 0.00 54.79 52.80 1s3s n ASP 364 Cb 0.41 -0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 40.23 1s3s n ASP 364 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1s3s s ARG 365 N -1.99 2.63 -0.01 0.11 1.81 -1.17 -5.02 118.95 115.30 1s3s s ARG 365 Ca 0.35 -0.83 0.03 0.00 -1.72 0.00 0.00 55.73 53.56 1s3s s ARG 365 Cb 0.21 -2.27 -0.01 0.00 -0.45 0.00 0.00 34.95 32.43 1s3s s ARG 365 CO 0.32 0.42 -0.09 -1.21 -0.68 0.00 0.00 175.30 174.07 1s3s s GLU 366 N -0.25 0.75 -0.10 3.54 2.02 -1.26 -0.68 118.70 122.73 1s3s s GLU 366 Ca -0.00 -0.32 0.01 0.00 0.02 0.00 0.00 54.97 54.68 1s3s s GLU 366 Cb -0.13 -0.73 0.02 0.00 0.10 0.00 0.00 34.13 33.39 1s3s s GLU 366 CO 0.03 0.18 -0.10 0.08 0.02 0.00 0.00 175.26 175.47 1s3s s VAL 367 N -0.15 1.13 -0.41 2.63 1.01 0.22 -4.91 120.40 119.92 1s3s s VAL 367 Ca 0.03 -0.41 -0.18 0.00 0.00 0.00 0.00 61.98 61.41 1s3s s VAL 367 Cb -0.04 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.27 1s3s s VAL 367 CO -0.00 0.37 0.51 -1.81 0.00 0.00 0.00 175.10 174.17 1s3s s ASP 368 N 1.21 6.25 -0.95 3.32 1.11 -1.26 -0.75 116.67 125.60 1s3s s ASP 368 Ca -0.04 -0.47 -0.07 0.00 0.18 0.00 0.00 52.55 52.16 1s3s s ASP 368 Cb -0.14 -2.26 0.24 0.00 1.07 0.00 0.00 42.92 41.83 1s3s s ASP 368 CO -0.03 -0.62 0.89 -0.63 1.18 0.00 0.00 175.17 175.96 1s3s s ILE 369 N 2.38 5.19 0.00 0.77 1.01 -0.78 -4.94 121.20 124.82 1s3s s ILE 369 Ca 0.16 -3.39 0.00 0.00 0.00 0.00 0.00 60.65 57.43 1s3s s ILE 369 Cb -0.16 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.14 1s3s s ILE 369 CO 0.15 -1.10 0.00 0.61 0.00 0.00 0.00 174.94 174.60 1s3s n GLY 370 N 2.84 -2.76 3.76 6.18 0.00 -1.26 -4.38 105.19 109.57 1s3s n GLY 370 Ca 0.20 -1.36 -0.39 0.00 0.00 0.00 0.00 46.02 44.47 1s3s n GLY 370 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s3s s ILE 371 N -0.59 3.83 1.20 -0.61 1.01 -1.26 -4.90 121.20 119.88 1s3s s ILE 371 Ca 0.00 1.72 -0.17 0.00 0.00 0.00 0.00 60.65 62.19 1s3s s ILE 371 Cb 0.00 -4.04 0.23 0.00 0.01 0.00 0.00 42.46 38.66 1s3s s ILE 371 CO 0.00 0.32 0.53 -2.65 0.00 0.00 0.00 174.94 173.14 1s3s n PRO 372 N 0.99 -2.71 -2.71 2.79 -0.02 -1.26 -5.05 135.00 127.02 1s3s n PRO 372 Ca 0.00 -0.78 -0.09 0.00 -2.02 0.00 0.00 63.50 60.61 1s3s n PRO 372 Cb 0.47 -1.85 -0.02 0.00 -0.02 0.00 0.00 33.50 32.09 1s3s n PRO 372 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1s3s n ASP 373 N -3.48 2.34 -0.13 2.55 5.75 -1.26 -4.89 116.55 117.43 1s3s n ASP 373 Ca 0.04 -1.62 -0.05 0.00 -0.01 0.00 0.00 54.79 53.16 1s3s n ASP 373 Cb 0.55 0.09 0.04 0.00 -1.03 0.00 0.00 41.12 40.77 1s3s n ASP 373 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1s3s h ALA 374 N 1.05 0.50 -0.20 2.12 0.00 -1.94 0.08 119.26 120.87 1s3s h ALA 374 Ca -0.12 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1s3s h ALA 374 Cb 0.36 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1s3s h ALA 374 CO 0.19 -0.26 -0.03 1.15 0.00 0.00 0.00 179.25 180.31 1s3s h THR 375 N 0.29 1.27 0.13 0.00 2.02 -1.96 -2.98 112.91 111.68 1s3s h THR 375 Ca 0.20 -0.96 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1s3s h THR 375 Cb 0.21 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 1s3s h THR 375 CO -0.22 0.29 -0.10 1.23 0.37 0.00 0.00 175.52 177.08 1s3s h GLY 376 N 0.11 -0.24 0.17 2.16 0.00 -1.84 -2.00 103.07 101.43 1s3s h GLY 376 Ca 0.05 0.12 0.16 0.00 0.00 0.00 0.00 47.33 47.66 1s3s h GLY 376 CO 0.02 -0.11 0.48 3.21 0.00 0.00 0.00 176.54 180.13 1s3s h ARG 377 N -0.25 0.62 0.10 4.80 3.08 -1.02 -0.79 114.38 120.93 1s3s h ARG 377 Ca -0.00 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 1s3s h ARG 377 Cb 0.22 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1s3s h ARG 377 CO -0.01 0.41 -0.05 1.25 -1.07 0.00 0.00 179.97 180.50 1s3s h LEU 378 N 0.64 -0.11 -0.72 3.04 7.12 -1.32 -1.68 115.31 122.28 1s3s h LEU 378 Ca 0.50 -0.08 0.13 0.00 0.13 0.00 0.00 57.88 58.56 1s3s h LEU 378 Cb 0.74 0.03 -0.09 0.00 -0.53 0.00 0.00 40.66 40.81 1s3s h LEU 378 CO -0.38 0.01 0.27 -0.08 -0.13 0.00 0.00 178.44 178.12 1s3s h GLU 379 N -0.22 0.40 -0.05 1.25 4.81 -0.45 -1.41 114.58 118.92 1s3s h GLU 379 Ca -0.01 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1s3s h GLU 379 Cb 0.18 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.47 1s3s h GLU 379 CO 0.02 0.26 0.02 0.82 -0.73 0.00 0.00 179.01 179.41 1s3s h ILE 380 N 0.41 1.13 -0.52 2.32 2.04 -1.06 -2.19 117.51 119.64 1s3s h ILE 380 Ca 0.39 -0.39 0.15 0.00 1.00 0.00 0.00 64.86 66.01 1s3s h ILE 380 Cb 0.58 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 1s3s h ILE 380 CO -0.40 0.11 0.38 -0.07 0.00 0.00 0.00 178.15 178.17 1s3s h LEU 381 N -0.08 0.00 0.00 1.44 3.38 -0.34 0.16 115.31 119.88 1s3s h LEU 381 Ca 0.02 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.82 1s3s h LEU 381 Cb 0.16 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1s3s h LEU 381 CO -0.00 0.00 -0.79 1.56 0.09 0.00 0.00 178.44 179.30 1s3s h GLN 382 N 0.00 0.00 -0.05 1.13 4.20 -0.91 -3.25 115.11 116.23 1s3s h GLN 382 Ca 0.25 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.75 1s3s h GLN 382 Cb 0.99 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.77 1s3s h GLN 382 CO -0.00 0.77 -0.82 0.82 -0.67 0.00 0.00 178.83 178.92 1s3s h ILE 383 N 0.00 1.38 -0.64 2.54 2.04 -0.11 -3.13 117.51 119.59 1s3s h ILE 383 Ca -0.01 -2.26 -0.32 0.00 1.00 0.00 0.00 64.86 63.27 1s3s h ILE 383 Cb 1.60 2.23 -0.19 0.00 -0.74 0.00 0.00 36.82 39.72 1s3s h ILE 383 CO 0.10 0.68 0.41 1.41 0.00 0.00 0.00 178.15 180.74 1s3s n HIS 384 N -3.81 1.98 -0.64 1.37 8.25 -0.59 -3.77 115.22 118.03 1s3s n HIS 384 Ca -0.05 -1.33 0.00 0.00 -0.26 0.00 0.00 57.72 56.08 1s3s n HIS 384 Cb 0.76 -0.69 0.00 0.00 1.12 0.00 0.00 29.99 31.18 1s3s n HIS 384 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1s3s n THR 385 N -0.52 0.00 0.12 1.59 -2.24 -1.22 -4.84 114.28 107.16 1s3s n THR 385 Ca 0.38 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 62.17 1s3s n THR 385 Cb 1.25 1.16 0.06 0.00 -2.10 0.00 0.00 70.33 70.70 1s3s n THR 385 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1s3s n LYS 386 N 0.00 0.05 0.00 -0.78 2.85 -1.19 -0.72 118.16 118.37 1s3s n LYS 386 Ca 0.00 0.12 0.03 0.00 -1.05 0.00 0.00 58.31 57.42 1s3s n LYS 386 Cb 0.11 -1.50 0.01 0.00 -0.65 0.00 0.00 35.03 33.00 1s3s n LYS 386 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1s3s n ASN 387 N -1.13 1.18 -4.58 -5.58 5.03 -1.26 -4.73 115.26 104.20 1s3s n ASN 387 Ca 0.01 -1.09 -0.23 0.00 0.87 0.00 0.00 54.58 54.14 1s3s n ASN 387 Cb 0.01 0.31 -0.08 0.00 -1.02 0.00 0.00 39.78 38.99 1s3s n ASN 387 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1s3s s MET 388 N -0.88 2.04 -1.16 3.52 0.23 0.10 -0.43 119.30 122.72 1s3s s MET 388 Ca 0.06 -1.58 -0.14 0.00 -1.03 0.00 0.00 55.69 53.00 1s3s s MET 388 Cb 0.05 -1.99 0.17 0.00 -1.53 0.00 0.00 34.83 31.53 1s3s s MET 388 CO 0.14 0.33 1.37 0.21 -2.03 0.00 0.00 175.02 175.03 1s3s s LYS 389 N -3.61 4.02 1.08 3.16 2.20 -1.26 -4.99 119.74 120.34 1s3s s LYS 389 Ca 0.31 -2.49 -0.14 0.00 -0.36 0.00 0.00 55.97 53.30 1s3s s LYS 389 Cb -0.05 -5.01 0.19 0.00 -1.51 0.00 0.00 37.83 31.44 1s3s s LYS 389 CO 0.18 -1.74 0.73 1.28 -0.36 0.00 0.00 175.35 175.45 1s3s n LEU 390 N 5.63 -0.49 -4.95 5.43 4.77 -1.26 -2.56 117.00 123.57 1s3s n LEU 390 Ca 0.34 0.03 -0.25 0.00 -0.03 0.00 0.00 56.01 56.10 1s3s n LEU 390 Cb 0.44 -1.23 -0.03 0.00 -2.33 0.00 0.00 43.42 40.27 1s3s n LEU 390 CO 0.59 -3.06 -0.04 0.00 -1.33 0.00 0.00 177.39 173.55 1s3s s ALA 391 N -2.41 3.91 0.44 -1.18 0.00 0.96 -4.69 121.76 118.79 1s3s s ALA 391 Ca 0.64 -1.02 0.12 0.00 0.00 0.00 0.00 51.96 51.71 1s3s s ALA 391 Cb -0.21 -1.84 0.98 0.00 0.00 0.00 0.00 23.12 22.05 1s3s s ALA 391 CO 0.64 0.42 2.02 -0.44 0.00 0.00 0.00 175.76 178.39 1s3s h ASP 392 N 1.81 0.13 0.82 0.00 5.19 -1.95 -1.53 116.42 120.89 1s3s h ASP 392 Ca -0.49 -0.02 -0.05 0.00 -0.62 0.00 0.00 57.03 55.85 1s3s h ASP 392 Cb 1.20 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.67 1s3s h ASP 392 CO 0.66 0.22 -0.25 -2.24 -3.12 0.00 0.00 179.24 174.51 1s3s h ASP 393 N 0.14 0.00 -2.04 6.45 3.04 -1.94 -3.44 116.42 118.62 1s3s h ASP 393 Ca 0.03 0.00 -0.62 0.00 -3.24 0.00 0.00 57.03 53.20 1s3s h ASP 393 Cb 0.21 0.00 0.05 0.00 -1.04 0.00 0.00 39.33 38.55 1s3s h ASP 393 CO 0.01 0.25 0.71 0.52 -2.04 0.00 0.00 179.24 178.70 1s3s n VAL 394 N -3.47 0.06 -3.28 4.15 0.31 -0.58 -4.69 118.33 110.83 1s3s n VAL 394 Ca -0.00 -0.01 -0.26 0.00 -0.01 0.00 0.00 64.34 64.06 1s3s n VAL 394 Cb 0.42 -1.32 -0.07 0.00 -0.91 0.00 0.00 33.84 31.96 1s3s n VAL 394 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1s3s n ASP 395 N 3.45 2.96 -0.34 4.52 -0.08 -1.26 -4.96 116.55 120.85 1s3s n ASP 395 Ca 0.18 -3.30 0.33 0.00 -1.51 0.00 0.00 54.79 50.49 1s3s n ASP 395 Cb 0.25 -0.64 0.60 0.00 2.34 0.00 0.00 41.12 43.66 1s3s n ASP 395 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1s3s h LEU 396 N 3.87 0.31 -1.39 -2.67 3.38 -1.98 2.27 115.31 119.11 1s3s h LEU 396 Ca 0.16 0.25 0.06 0.00 0.09 0.00 0.00 57.88 58.43 1s3s h LEU 396 Cb 0.70 0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.66 1s3s h LEU 396 CO 0.74 -0.41 0.46 -0.33 0.09 0.00 0.00 178.44 178.99 1s3s h GLU 397 N 0.01 0.73 0.81 1.13 4.39 -1.94 0.35 114.58 120.06 1s3s h GLU 397 Ca 0.85 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 60.47 1s3s h GLU 397 Cb 2.30 -0.17 0.01 0.00 -0.10 0.00 0.00 28.75 30.79 1s3s h GLU 397 CO -0.73 0.49 -0.39 0.37 -1.16 0.00 0.00 179.01 177.58 1s3s h GLN 398 N 0.76 -1.05 -0.99 2.33 5.75 0.34 -1.20 115.11 121.05 1s3s h GLN 398 Ca 0.30 0.07 0.15 0.00 -0.15 0.00 0.00 58.65 59.01 1s3s h GLN 398 Cb 0.21 0.24 -0.09 0.00 1.07 0.00 0.00 27.48 28.91 1s3s h GLN 398 CO -0.09 -0.69 0.62 0.28 -2.65 0.00 0.00 178.83 176.30 1s3s h VAL 399 N -1.14 0.84 0.00 2.39 2.07 -1.05 0.98 116.25 120.34 1s3s h VAL 399 Ca -0.11 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1s3s h VAL 399 Cb 0.84 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1s3s h VAL 399 CO 0.18 0.16 0.00 0.00 0.02 0.00 0.00 177.57 177.93 1s3s h ALA 400 N 1.58 1.00 0.01 1.67 0.00 -0.10 -2.93 119.26 120.48 1s3s h ALA 400 Ca 0.52 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 55.17 1s3s h ALA 400 Cb 0.66 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 1s3s h ALA 400 CO -0.29 0.00 -1.41 -0.91 0.00 0.00 0.00 179.25 176.64 1s3s h ASN 401 N 0.00 0.02 -0.83 0.00 2.35 0.22 -3.38 115.58 113.96 1s3s h ASN 401 Ca 0.00 -0.04 -0.54 0.00 -0.55 0.00 0.00 56.30 55.17 1s3s h ASN 401 Cb 0.31 -0.01 -0.29 0.00 0.05 0.00 0.00 38.32 38.38 1s3s h ASN 401 CO 0.00 1.03 0.29 -1.84 -1.65 0.00 0.00 177.43 175.26 1s3s n GLU 402 N -3.20 2.69 -0.01 0.81 0.28 -0.90 -4.23 120.64 116.08 1s3s n GLU 402 Ca -0.10 -3.43 0.01 0.00 -0.16 0.00 0.00 57.16 53.47 1s3s n GLU 402 Cb 1.01 -2.19 -0.03 0.00 1.43 0.00 0.00 31.44 31.65 1s3s n GLU 402 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1s3s n THR 403 N -0.94 0.08 0.00 3.84 -2.24 -1.24 -4.99 114.28 108.79 1s3s n THR 403 Ca 0.53 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 62.19 1s3s n THR 403 Cb 0.95 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 1s3s n THR 403 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1s3s n HIS 404 N -1.80 0.00 0.01 4.78 8.25 -1.26 -1.64 115.22 123.56 1s3s n HIS 404 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1s3s n HIS 404 Cb 0.26 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.37 1s3s n HIS 404 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1s3s n GLY 405 N 0.00 0.23 3.68 -1.41 0.00 -1.26 -4.98 105.19 101.45 1s3s n GLY 405 Ca 0.00 -0.02 -0.45 0.00 0.00 0.00 0.00 46.02 45.56 1s3s n GLY 405 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1s3s n HIS 406 N -1.39 2.33 -2.07 1.61 -0.00 -0.65 -4.88 115.22 110.17 1s3s n HIS 406 Ca -0.00 0.31 -0.28 0.00 -0.00 0.00 0.00 57.72 57.75 1s3s n HIS 406 Cb 0.01 -2.53 0.14 0.00 -0.00 0.00 0.00 29.99 27.61 1s3s n HIS 406 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 1s3s s VAL 407 N 0.49 2.07 0.57 1.59 -7.23 -1.26 -4.67 120.40 111.96 1s3s s VAL 407 Ca 0.73 -0.13 0.27 0.00 -1.81 0.00 0.00 61.98 61.04 1s3s s VAL 407 Cb -0.64 -2.93 0.37 0.00 0.56 0.00 0.00 36.38 33.74 1s3s s VAL 407 CO 0.43 0.00 2.02 1.23 -0.31 0.00 0.00 175.10 178.47 1s3s h GLY 408 N -1.19 0.00 0.93 2.32 0.00 -1.88 -1.43 103.07 101.81 1s3s h GLY 408 Ca -0.44 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.78 1s3s h GLY 408 CO 0.48 0.00 -0.30 0.00 0.00 0.00 0.00 176.54 176.72 1s3s h ALA 409 N 1.68 0.37 0.15 3.60 0.00 -1.63 -0.93 119.26 122.51 1s3s h ALA 409 Ca 0.16 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1s3s h ALA 409 Cb 0.79 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1s3s h ALA 409 CO -0.00 0.38 -0.12 -0.44 0.00 0.00 0.00 179.25 179.07 1s3s h ASP 410 N 0.34 -0.32 -0.73 0.00 3.32 -1.56 -1.80 116.42 115.67 1s3s h ASP 410 Ca 0.03 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.12 1s3s h ASP 410 Cb 0.87 0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.49 1s3s h ASP 410 CO 0.07 -0.19 0.49 -0.07 -1.72 0.00 0.00 179.24 177.81 1s3s h LEU 411 N -0.29 0.83 -1.17 1.55 3.38 -1.50 0.47 115.31 118.57 1s3s h LEU 411 Ca -0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1s3s h LEU 411 Cb 0.26 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1s3s h LEU 411 CO -0.01 0.59 0.35 0.00 0.09 0.00 0.00 178.44 179.46 1s3s h ALA 412 N 1.55 1.37 0.16 1.53 0.00 -0.66 -2.38 119.26 120.83 1s3s h ALA 412 Ca 0.27 -0.11 -0.27 0.00 0.00 0.00 0.00 54.91 54.80 1s3s h ALA 412 Cb -0.08 -0.27 0.03 0.00 0.00 0.00 0.00 17.79 17.47 1s3s h ALA 412 CO -0.06 0.51 -1.17 0.00 0.00 0.00 0.00 179.25 178.53 1s3s h ALA 413 N 1.46 -0.08 -0.76 0.00 0.00 -0.36 -3.09 119.26 116.43 1s3s h ALA 413 Ca 0.23 -0.77 0.15 0.00 0.00 0.00 0.00 54.91 54.53 1s3s h ALA 413 Cb 0.05 0.13 -0.14 0.00 0.00 0.00 0.00 17.79 17.82 1s3s h ALA 413 CO -0.04 0.58 -0.20 1.25 0.00 0.00 0.00 179.25 180.85 1s3s h LEU 414 N 0.04 -0.73 0.59 0.00 5.85 0.26 0.52 115.31 121.84 1s3s h LEU 414 Ca -0.19 0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1s3s h LEU 414 Cb 1.89 0.48 -0.00 0.00 0.37 0.00 0.00 40.66 43.40 1s3s h LEU 414 CO 0.22 -0.25 -0.33 0.00 -0.34 0.00 0.00 178.44 177.74 1s3s h SER 416 N -0.85 0.26 0.35 0.00 0.02 -0.86 0.45 113.55 112.92 1s3s h SER 416 Ca -0.07 0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 1s3s h SER 416 Cb 0.68 0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.37 1s3s h SER 416 CO 0.10 -0.01 -0.17 -0.08 -1.14 0.00 0.00 176.83 175.52 1s3s h GLU 417 N 0.37 -0.46 -0.56 3.45 4.57 0.70 0.96 114.58 123.61 1s3s h GLU 417 Ca 0.54 0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.81 1s3s h GLU 417 Cb 1.00 0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 29.64 1s3s h GLU 417 CO -0.53 -0.30 0.27 0.00 -1.18 0.00 0.00 179.01 177.27 1s3s h ALA 418 N 0.17 0.73 -0.88 2.92 0.00 0.11 0.29 119.26 122.59 1s3s h ALA 418 Ca -0.05 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1s3s h ALA 418 Cb 0.37 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1s3s h ALA 418 CO 0.08 -0.10 0.58 0.00 0.00 0.00 0.00 179.25 179.81 1s3s h ALA 419 N 1.33 1.15 0.00 0.00 0.00 0.08 -0.16 119.26 121.65 1s3s h ALA 419 Ca 0.26 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 1s3s h ALA 419 Cb 0.21 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1s3s h ALA 419 CO -0.20 0.46 -0.60 -0.07 0.00 0.00 0.00 179.25 178.83 1s3s h LEU 420 N 1.14 0.00 -0.08 0.00 3.38 0.24 -2.11 115.31 117.88 1s3s h LEU 420 Ca 0.34 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 1s3s h LEU 420 Cb -0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1s3s h LEU 420 CO -0.10 0.60 -0.00 -0.61 0.09 0.00 0.00 178.44 178.42 1s3s h GLN 421 N 0.00 0.15 0.62 1.13 5.75 0.73 -1.15 115.11 122.34 1s3s h GLN 421 Ca -0.01 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.42 1s3s h GLN 421 Cb 1.12 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.64 1s3s h GLN 421 CO 0.08 0.43 -0.49 0.00 -2.65 0.00 0.00 178.83 176.19 1s3s h ALA 422 N 0.71 -1.18 -0.71 3.38 0.00 -1.00 0.11 119.26 120.57 1s3s h ALA 422 Ca 0.02 -0.21 0.14 0.00 0.00 0.00 0.00 54.91 54.86 1s3s h ALA 422 Cb 0.36 0.67 -0.13 0.00 0.00 0.00 0.00 17.79 18.69 1s3s h ALA 422 CO 0.01 -1.19 -0.19 0.82 0.00 0.00 0.00 179.25 178.69 1s3s h ILE 423 N -1.08 0.27 -0.51 0.00 2.04 -1.38 0.33 117.51 117.18 1s3s h ILE 423 Ca -0.08 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1s3s h ILE 423 Cb 0.91 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1s3s h ILE 423 CO 0.01 0.00 0.25 -0.09 0.00 0.00 0.00 178.15 178.32 1s3s h ARG 424 N -0.01 0.70 0.00 2.37 2.43 -0.77 -0.47 114.38 118.62 1s3s h ARG 424 Ca 0.34 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1s3s h ARG 424 Cb 0.53 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1s3s h ARG 424 CO -0.74 0.54 -0.59 0.87 -1.51 0.00 0.00 179.97 178.54 1s3s h LYS 425 N 0.71 0.00 0.00 0.20 1.57 0.21 -3.34 116.57 115.92 1s3s h LYS 425 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1s3s h LYS 425 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1s3s h LYS 425 CO -0.03 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.48 1s3s n LYS 426 N -2.61 0.00 0.31 3.15 4.01 0.60 -4.71 118.16 118.91 1s3s n LYS 426 Ca 0.02 0.00 0.21 0.00 -0.51 0.00 0.00 58.31 58.03 1s3s n LYS 426 Cb 0.51 0.00 1.09 0.00 -0.51 0.00 0.00 35.03 36.12 1s3s n LYS 426 CO 0.00 0.00 0.00 1.98 -1.11 0.00 0.00 177.40 178.27 1s3s h MET 427 N 0.00 0.00 -0.05 1.97 4.05 -1.79 -2.26 114.93 116.84 1s3s h MET 427 Ca 0.00 0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.46 1s3s h MET 427 Cb 0.00 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 30.75 1s3s h MET 427 CO 0.00 0.00 -0.23 0.22 0.23 0.00 0.00 176.91 177.13 1s3s h ASP 428 N 0.00 -0.69 0.36 1.39 -0.00 -1.25 0.31 116.42 116.54 1s3s h ASP 428 Ca 0.00 0.10 -0.02 0.00 -0.00 0.00 0.00 57.03 57.12 1s3s h ASP 428 Cb 0.06 0.29 0.00 0.00 -0.00 0.00 0.00 39.33 39.68 1s3s h ASP 428 CO 0.00 -0.29 -0.17 -0.07 -0.00 0.00 0.00 179.24 178.71 1s3s h LEU 429 N -0.33 -0.41 0.00 2.28 -0.00 -1.54 -2.79 115.31 112.52 1s3s h LEU 429 Ca 0.08 -0.14 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 1s3s h LEU 429 Cb 0.44 0.11 0.00 0.00 -0.00 0.00 0.00 40.66 41.21 1s3s h LEU 429 CO -0.25 0.01 0.12 -0.38 -0.00 0.00 0.00 178.44 177.94 1s3s n ILE 430 N -5.13 0.58 -3.15 1.22 -0.00 -0.96 -4.82 119.36 107.10 1s3s n ILE 430 Ca -0.09 0.26 -0.00 0.00 -0.00 0.00 0.00 62.75 62.92 1s3s n ILE 430 Cb 0.27 -1.26 -0.00 0.00 -0.00 0.00 0.00 39.64 38.65 1s3s n ILE 430 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1s3s n ASP 431 N -1.04 -6.71 -2.37 4.38 -0.08 0.09 -4.98 116.55 105.84 1s3s n ASP 431 Ca 0.00 0.52 -0.01 0.00 -1.51 0.00 0.00 54.79 53.79 1s3s n ASP 431 Cb 0.12 -1.83 0.06 0.00 2.34 0.00 0.00 41.12 41.81 1s3s n ASP 431 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1s3s n LEU 432 N 1.36 -0.04 0.08 -2.67 -0.00 -1.20 -4.88 117.00 109.64 1s3s n LEU 432 Ca -0.00 -2.84 0.12 0.00 -0.00 0.00 0.00 56.01 53.29 1s3s n LEU 432 Cb 0.43 0.21 0.18 0.00 -0.00 0.00 0.00 43.42 44.24 1s3s n LEU 432 CO 0.03 1.30 0.41 -0.33 -0.00 0.00 0.00 177.39 178.80 1s3s h GLU 433 N 1.44 0.00 -6.15 1.96 4.39 -1.91 -3.46 114.58 110.84 1s3s h GLU 433 Ca -0.33 0.00 -0.74 0.00 0.34 0.00 0.00 59.36 58.63 1s3s h GLU 433 Cb 1.38 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 30.06 1s3s h GLU 433 CO -0.04 0.00 0.57 -0.25 -1.16 0.00 0.00 179.01 178.13 1s3s n ASP 434 N -2.25 1.57 0.00 1.42 8.00 -1.26 -4.52 116.55 119.51 1s3s n ASP 434 Ca 0.03 1.12 0.00 0.00 0.71 0.00 0.00 54.79 56.65 1s3s n ASP 434 Cb 0.46 -1.09 0.00 0.00 -0.02 0.00 0.00 41.12 40.47 1s3s n ASP 434 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1s3s n GLU 435 N 3.50 0.00 -2.69 -1.24 -0.00 -1.26 -4.39 120.64 114.55 1s3s n GLU 435 Ca 0.23 0.00 -0.43 0.00 -0.00 0.00 0.00 57.16 56.96 1s3s n GLU 435 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.56 1s3s n GLU 435 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1s3s n THR 436 N 0.00 4.14 0.00 3.84 -1.04 -1.26 -4.97 114.28 114.99 1s3s n THR 436 Ca 0.00 -4.42 0.00 0.00 -2.04 0.00 0.00 64.05 57.59 1s3s n THR 436 Cb 0.00 -2.43 0.00 0.00 -1.82 0.00 0.00 70.33 66.08 1s3s n THR 436 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1s3s n ILE 437 N 4.91 0.00 -2.58 12.58 5.41 -1.26 -3.57 119.36 134.85 1s3s n ILE 437 Ca 0.41 0.00 -0.34 0.00 1.00 0.00 0.00 62.75 63.82 1s3s n ILE 437 Cb 0.42 0.00 -0.04 0.00 -0.71 0.00 0.00 39.64 39.31 1s3s n ILE 437 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 1s3s s ASP 438 N 0.00 6.46 0.23 4.38 -4.77 -1.26 -3.14 116.67 118.58 1s3s s ASP 438 Ca 0.00 1.92 -0.03 0.00 -3.30 0.00 0.00 52.55 51.14 1s3s s ASP 438 Cb 0.00 -2.56 0.25 0.00 -1.09 0.00 0.00 42.92 39.52 1s3s s ASP 438 CO 0.00 -0.70 1.66 0.00 0.70 0.00 0.00 175.17 176.83 1s3s h ALA 439 N 1.71 0.95 0.27 2.11 0.00 -1.85 -3.05 119.26 119.39 1s3s h ALA 439 Ca -0.49 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1s3s h ALA 439 Cb 1.22 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 1s3s h ALA 439 CO 0.60 0.61 -0.50 0.93 0.00 0.00 0.00 179.25 180.89 1s3s h GLU 440 N 0.63 -0.79 -0.22 0.00 3.07 -1.88 0.72 114.58 116.11 1s3s h GLU 440 Ca 0.09 0.05 0.03 0.00 -0.50 0.00 0.00 59.36 59.04 1s3s h GLU 440 Cb 0.69 0.18 -0.06 0.00 -0.84 0.00 0.00 28.75 28.72 1s3s h GLU 440 CO 0.05 -0.53 -0.43 0.28 -1.40 0.00 0.00 179.01 176.99 1s3s h VAL 441 N -0.82 0.00 -0.23 3.13 2.07 -1.96 -0.69 116.25 117.74 1s3s h VAL 441 Ca -0.03 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1s3s h VAL 441 Cb 0.77 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1s3s h VAL 441 CO -0.19 0.00 0.16 0.24 0.02 0.00 0.00 177.57 177.80 1s3s h MET 442 N -0.37 0.28 0.00 1.57 2.86 -1.41 0.48 114.93 118.35 1s3s h MET 442 Ca 0.04 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1s3s h MET 442 Cb 0.49 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.08 1s3s h MET 442 CO -0.41 0.19 -0.05 -0.97 1.06 0.00 0.00 176.91 176.73 1s3s h ASN 443 N 0.29 0.00 0.38 1.22 -0.73 0.19 -2.67 115.58 114.27 1s3s h ASN 443 Ca 0.09 0.00 -0.32 0.00 1.87 0.00 0.00 56.30 57.94 1s3s h ASN 443 Cb 0.00 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.59 1s3s h ASN 443 CO -0.02 0.05 -1.58 0.77 -0.37 0.00 0.00 177.43 176.28 1s3s h SER 444 N 0.00 0.46 -1.45 1.15 4.64 0.07 -3.46 113.55 114.96 1s3s h SER 444 Ca -0.00 -0.64 -0.76 0.00 -0.47 0.00 0.00 61.79 59.92 1s3s h SER 444 Cb 0.32 -0.15 0.02 0.00 -0.31 0.00 0.00 62.40 62.28 1s3s h SER 444 CO 0.01 1.54 0.79 0.18 -0.87 0.00 0.00 176.83 178.47 1s3s n LEU 445 N -3.49 2.02 -3.79 5.97 4.77 -1.01 -4.94 117.00 116.54 1s3s n LEU 445 Ca -0.18 1.10 -0.27 0.00 -0.03 0.00 0.00 56.01 56.63 1s3s n LEU 445 Cb 1.05 -1.09 -0.17 0.00 -2.33 0.00 0.00 43.42 40.88 1s3s n LEU 445 CO 0.51 -0.62 -0.38 0.00 -1.33 0.00 0.00 177.39 175.57 1s3s s ALA 446 N 2.99 1.13 0.30 -1.18 0.00 -1.26 -4.25 121.76 119.49 1s3s s ALA 446 Ca 0.98 -0.69 -0.29 0.00 0.00 0.00 0.00 51.96 51.96 1s3s s ALA 446 Cb -1.14 -1.12 -0.10 0.00 0.00 0.00 0.00 23.12 20.76 1s3s s ALA 446 CO 0.66 -0.98 1.20 0.54 0.00 0.00 0.00 175.76 177.18 1s3s s VAL 447 N 1.79 3.13 0.20 0.00 0.11 -1.06 -4.76 120.40 119.82 1s3s s VAL 447 Ca -0.00 1.13 0.06 0.00 -2.93 0.00 0.00 61.98 60.23 1s3s s VAL 447 Cb -0.16 -3.72 -0.04 0.00 -1.53 0.00 0.00 36.38 30.94 1s3s s VAL 447 CO -0.07 0.26 0.16 0.42 -3.33 0.00 0.00 175.10 172.54 1s3s s THR 448 N -1.08 4.47 -1.09 5.04 -4.23 -1.26 -0.03 115.64 117.46 1s3s s THR 448 Ca 0.47 -1.22 0.00 0.00 -1.18 0.00 0.00 61.69 59.76 1s3s s THR 448 Cb -0.36 -3.34 0.00 0.00 1.34 0.00 0.00 72.50 70.14 1s3s s THR 448 CO 0.46 -0.21 0.84 0.80 -0.54 0.00 0.00 174.62 175.97 1s3s n MET 449 N -0.71 0.00 0.11 3.99 1.56 -1.26 -0.03 117.12 120.78 1s3s n MET 449 Ca -0.08 0.35 -0.23 0.00 -0.27 0.00 0.00 57.70 57.47 1s3s n MET 449 Cb 0.56 -1.54 -0.15 0.00 2.15 0.00 0.00 33.22 34.24 1s3s n MET 449 CO 0.00 0.00 0.00 0.22 -0.73 0.00 0.00 175.97 175.46 1s3s h ASP 450 N 0.00 0.71 0.25 6.12 1.82 -1.95 -3.06 116.42 120.32 1s3s h ASP 450 Ca 0.00 -0.88 -0.04 0.00 -0.39 0.00 0.00 57.03 55.72 1s3s h ASP 450 Cb 0.08 -0.23 -0.01 0.00 0.68 0.00 0.00 39.33 39.85 1s3s h ASP 450 CO 0.00 1.71 -0.17 0.44 -1.61 0.00 0.00 179.24 179.62 1s3s h ASP 451 N 0.12 0.00 0.76 2.28 5.19 -0.82 -2.06 116.42 121.90 1s3s h ASP 451 Ca -0.29 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 55.97 1s3s h ASP 451 Cb 2.13 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 41.62 1s3s h ASP 451 CO 0.23 0.17 -0.74 -0.26 -3.12 0.00 0.00 179.24 175.52 1s3s h PHE 452 N 0.00 0.00 0.00 4.55 -1.00 -1.54 -2.56 116.94 116.40 1s3s h PHE 452 Ca -0.00 0.00 -0.16 0.00 2.81 0.00 0.00 57.97 60.62 1s3s h PHE 452 Cb 0.34 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.88 1s3s h PHE 452 CO 0.00 0.74 -0.77 0.00 -1.61 0.00 0.00 178.31 176.67 1s3s h ARG 453 N 0.00 0.00 -0.01 1.51 3.08 -1.29 -2.71 114.38 114.96 1s3s h ARG 453 Ca -0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1s3s h ARG 453 Cb 1.31 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.36 1s3s h ARG 453 CO 0.10 0.77 -0.00 2.35 -1.07 0.00 0.00 179.97 182.11 1s3s h TRP 454 N 0.00 0.02 -0.56 3.04 7.01 -1.29 -2.95 115.95 121.23 1s3s h TRP 454 Ca -0.01 -0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.02 1s3s h TRP 454 Cb 1.46 -0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 28.48 1s3s h TRP 454 CO 0.00 0.36 0.33 0.00 -2.79 0.00 0.00 178.44 176.34 1s3s h ALA 455 N 0.66 0.72 -0.80 2.65 0.00 -1.49 -2.67 119.26 118.32 1s3s h ALA 455 Ca 0.00 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.03 1s3s h ALA 455 Cb 0.36 -0.15 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 1s3s h ALA 455 CO 0.00 0.03 0.42 -0.07 0.00 0.00 0.00 179.25 179.63 1s3s h LEU 456 N 0.64 0.53 -3.18 0.00 3.38 -1.44 -2.29 115.31 112.95 1s3s h LEU 456 Ca 0.23 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.24 1s3s h LEU 456 Cb 0.05 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1s3s h LEU 456 CO -0.11 0.26 -0.07 -1.20 0.09 0.00 0.00 178.44 177.41 1s3s n SER 457 N -4.85 5.32 0.00 -0.43 7.64 -1.01 -5.12 113.62 115.18 1s3s n SER 457 Ca 0.15 -2.42 0.00 0.00 1.01 0.00 0.00 58.87 57.61 1s3s n SER 457 Cb 0.36 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 1s3s n SER 457 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70