#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x81 n LEU 56 N 0.00 0.00 -3.64 5.98 4.77 -1.26 -5.10 117.00 117.75 1x81 n LEU 56 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 1x81 n LEU 56 Cb 0.00 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.02 1x81 n LEU 56 CO 0.00 0.00 0.76 -0.55 -1.33 0.00 0.00 177.39 176.27 1x81 s SER 57 N -1.62 -0.43 0.60 -1.43 0.15 -1.26 -5.02 113.70 104.69 1x81 s SER 57 Ca 0.00 0.77 0.29 0.00 0.70 0.00 0.00 55.95 57.71 1x81 s SER 57 Cb 0.00 0.92 1.59 0.00 -1.71 0.00 0.00 66.02 66.82 1x81 s SER 57 CO 0.00 -0.13 2.00 0.25 1.20 0.00 0.00 173.24 176.56 1x81 h LEU 58 N 4.75 0.00 -0.08 3.45 5.85 -1.97 -2.89 115.31 124.41 1x81 h LEU 58 Ca -0.28 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1x81 h LEU 58 Cb 1.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1x81 h LEU 58 CO 0.15 0.00 -0.58 0.47 -0.34 0.00 0.00 178.44 178.14 1x81 n ASP 59 N -3.65 0.70 -4.64 1.25 8.00 -1.26 -4.96 116.55 111.98 1x81 n ASP 59 Ca 0.04 -0.85 -0.43 0.00 0.71 0.00 0.00 54.79 54.26 1x81 n ASP 59 Cb 0.47 0.95 -0.01 0.00 -0.02 0.00 0.00 41.12 42.51 1x81 n ASP 59 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1x81 n SER 60 N -1.19 1.95 0.04 -2.24 3.41 -1.09 -4.81 113.62 109.70 1x81 n SER 60 Ca 0.03 1.17 0.06 0.00 -0.26 0.00 0.00 58.87 59.87 1x81 n SER 60 Cb 0.21 -1.39 0.29 0.00 -0.26 0.00 0.00 64.21 63.06 1x81 n SER 60 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1x81 n PRO 61 N 0.53 0.05 -0.34 4.33 -0.04 -1.26 -0.70 135.00 137.57 1x81 n PRO 61 Ca 0.07 0.39 0.12 0.00 -0.04 0.00 0.00 63.50 64.05 1x81 n PRO 61 Cb 0.35 -1.62 0.31 0.00 -0.04 0.00 0.00 33.50 32.49 1x81 n PRO 61 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1x81 n THR 62 N -1.73 0.90 -1.85 0.52 5.66 -1.26 -4.99 114.28 111.53 1x81 n THR 62 Ca 0.02 -0.94 -0.37 0.00 -3.05 0.00 0.00 64.05 59.71 1x81 n THR 62 Cb 0.12 0.58 0.05 0.00 -1.55 0.00 0.00 70.33 69.53 1x81 n THR 62 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 1x81 s TYR 63 N -1.10 2.23 0.01 1.09 5.04 0.12 -5.05 117.35 119.69 1x81 s TYR 63 Ca 0.47 1.47 0.01 0.00 -2.44 0.00 0.00 57.07 56.59 1x81 s TYR 63 Cb 0.25 -3.65 -0.01 0.00 0.35 0.00 0.00 41.96 38.91 1x81 s TYR 63 CO 0.33 -2.67 -0.04 0.14 -1.34 0.00 0.00 175.55 171.97 1x81 s VAL 64 N -1.44 0.26 1.02 3.14 -7.23 -1.26 -5.07 120.40 109.82 1x81 s VAL 64 Ca 0.78 -0.36 -0.12 0.00 -1.81 0.00 0.00 61.98 60.47 1x81 s VAL 64 Cb -0.36 -0.27 0.16 0.00 0.56 0.00 0.00 36.38 36.47 1x81 s VAL 64 CO 0.39 -0.07 0.79 0.18 -0.31 0.00 0.00 175.10 176.08 1x81 n LEU 65 N 2.60 0.54 0.13 1.32 7.99 -1.26 -4.89 117.00 123.43 1x81 n LEU 65 Ca -0.15 0.18 0.00 0.00 -0.01 0.00 0.00 56.01 56.02 1x81 n LEU 65 Cb 0.58 -1.29 0.09 0.00 -0.11 0.00 0.00 43.42 42.69 1x81 n LEU 65 CO 0.24 -2.92 0.44 1.88 -1.51 0.00 0.00 177.39 175.53 1x81 h TYR 66 N -2.06 0.00 -0.30 -1.77 -1.99 -1.94 -3.22 116.97 105.69 1x81 h TYR 66 Ca -0.49 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.23 1x81 h TYR 66 Cb 1.30 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.02 1x81 h TYR 66 CO 0.37 0.62 0.17 -0.09 -0.00 0.00 0.00 178.16 179.22 1x81 h ARG 67 N 0.00 0.41 -1.42 4.88 2.43 -1.93 -2.43 114.38 116.32 1x81 h ARG 67 Ca -0.01 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 58.99 1x81 h ARG 67 Cb 1.32 -0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 30.72 1x81 h ARG 67 CO 0.08 0.34 0.17 -0.25 -1.51 0.00 0.00 179.97 178.80 1x81 n ASP 68 N -4.83 4.61 -4.46 -3.80 8.00 -1.22 -4.86 116.55 109.99 1x81 n ASP 68 Ca -0.02 -2.54 -0.29 0.00 0.71 0.00 0.00 54.79 52.66 1x81 n ASP 68 Cb 0.07 -0.85 -0.12 0.00 -0.02 0.00 0.00 41.12 40.20 1x81 n ASP 68 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1x81 s ARG 69 N -0.78 1.68 -0.16 -1.24 0.52 -0.92 -4.85 118.95 113.20 1x81 s ARG 69 Ca 0.13 -1.29 -0.27 0.00 -0.52 0.00 0.00 55.73 53.79 1x81 s ARG 69 Cb 0.11 -2.02 -0.24 0.00 0.52 0.00 0.00 34.95 33.32 1x81 s ARG 69 CO 0.01 0.45 0.59 0.00 0.02 0.00 0.00 175.30 176.38 1x81 h ALA 70 N 3.58 0.08 -1.00 2.13 0.00 -1.89 -3.24 119.26 118.92 1x81 h ALA 70 Ca -0.49 -0.73 0.29 0.00 0.00 0.00 0.00 54.91 53.98 1x81 h ALA 70 Cb 1.18 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 19.17 1x81 h ALA 70 CO 0.46 0.23 0.79 0.93 0.00 0.00 0.00 179.25 181.65 1x81 h GLU 71 N -1.00 0.00 -0.33 0.00 3.07 -1.96 0.81 114.58 115.18 1x81 h GLU 71 Ca -0.11 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.57 1x81 h GLU 71 Cb 1.10 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 28.90 1x81 h GLU 71 CO -0.07 0.00 -0.18 0.91 -1.40 0.00 0.00 179.01 178.28 1x81 n TRP 72 N -4.03 1.03 0.08 4.33 7.02 -1.25 -4.71 117.44 119.92 1x81 n TRP 72 Ca 0.21 -1.66 -0.11 0.00 -1.02 0.00 0.00 57.50 54.91 1x81 n TRP 72 Cb 1.12 -0.47 -0.04 0.00 -2.42 0.00 0.00 31.31 29.51 1x81 n TRP 72 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1x81 h ALA 73 N 1.08 0.41 0.00 6.99 0.00 -0.86 -3.28 119.26 123.60 1x81 h ALA 73 Ca 0.20 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1x81 h ALA 73 Cb 1.53 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1x81 h ALA 73 CO 0.37 0.88 0.00 -0.40 0.00 0.00 0.00 179.25 180.10 1x81 n ASP 74 N -3.69 0.00 -4.00 0.00 5.75 -1.26 -4.77 116.55 108.58 1x81 n ASP 74 Ca -0.05 -0.79 -0.25 0.00 -0.01 0.00 0.00 54.79 53.68 1x81 n ASP 74 Cb 0.84 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.76 1x81 n ASP 74 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 1x81 s ILE 75 N -2.00 1.14 -0.05 2.12 1.10 -1.24 -5.11 121.20 117.15 1x81 s ILE 75 Ca 0.34 -0.45 -0.30 0.00 -0.51 0.00 0.00 60.65 59.73 1x81 s ILE 75 Cb 0.16 -1.06 -0.03 0.00 0.15 0.00 0.00 42.46 41.68 1x81 s ILE 75 CO 0.26 0.36 1.18 -1.81 -2.11 0.00 0.00 174.94 172.83 1x81 s ASP 76 N 0.87 7.07 0.75 4.50 1.01 -1.26 -5.02 116.67 124.59 1x81 s ASP 76 Ca -0.11 1.80 -0.12 0.00 0.71 0.00 0.00 52.55 54.83 1x81 s ASP 76 Cb -0.15 -2.56 0.05 0.00 1.01 0.00 0.00 42.92 41.26 1x81 s ASP 76 CO 0.01 -0.56 1.11 -2.16 0.21 0.00 0.00 175.17 173.78 1x81 s PRO 77 N 2.12 2.29 -0.27 8.23 0.04 -1.26 -4.77 135.00 141.39 1x81 s PRO 77 Ca 0.55 1.34 0.02 0.00 0.04 0.00 0.00 61.00 62.95 1x81 s PRO 77 Cb -0.24 -1.89 0.06 0.00 0.04 0.00 0.00 34.50 32.47 1x81 s PRO 77 CO 0.22 -1.64 -0.08 0.08 0.04 0.00 0.00 177.00 175.62 1x81 s VAL 78 N -2.60 2.32 1.23 -0.36 1.01 0.30 -4.95 120.40 117.35 1x81 s VAL 78 Ca 0.65 -1.63 -0.16 0.00 0.00 0.00 0.00 61.98 60.85 1x81 s VAL 78 Cb -0.20 -2.38 0.31 0.00 0.00 0.00 0.00 36.38 34.11 1x81 s VAL 78 CO 0.50 -0.07 1.01 -2.16 0.00 0.00 0.00 175.10 174.38 1x81 s PRO 79 N 1.12 -1.45 0.66 2.72 0.04 -1.26 -4.44 135.00 132.38 1x81 s PRO 79 Ca -0.07 0.57 -0.09 0.00 0.04 0.00 0.00 61.00 61.45 1x81 s PRO 79 Cb -0.20 -1.51 0.02 0.00 0.04 0.00 0.00 34.50 32.84 1x81 s PRO 79 CO -0.04 -4.01 1.01 -1.14 0.04 0.00 0.00 177.00 172.86 1x81 s GLN 80 N -4.68 2.83 -0.59 4.56 0.74 -1.26 -5.03 119.66 116.23 1x81 s GLN 80 Ca 0.68 0.22 0.06 0.00 0.05 0.00 0.00 55.36 56.37 1x81 s GLN 80 Cb -0.21 -2.13 0.30 0.00 1.10 0.00 0.00 33.01 32.07 1x81 s GLN 80 CO 0.62 -0.92 0.85 -1.71 -0.55 0.00 0.00 175.29 173.59 1x81 n ASN 81 N -2.83 3.99 0.00 6.67 5.15 -1.26 -4.86 115.26 122.11 1x81 n ASN 81 Ca 0.06 -3.55 0.08 0.00 -0.60 0.00 0.00 54.58 50.57 1x81 n ASN 81 Cb 0.58 -0.61 0.45 0.00 -0.53 0.00 0.00 39.78 39.66 1x81 n ASN 81 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1x81 n ASP 82 N 0.26 0.00 0.00 1.20 8.00 -1.26 -4.97 116.55 119.77 1x81 n ASP 82 Ca 0.30 -0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.57 1x81 n ASP 82 Cb 0.41 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1x81 n ASP 82 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x81 n GLY 83 N 0.06 -0.24 0.26 0.44 0.00 -1.26 -4.10 105.19 100.34 1x81 n GLY 83 Ca 0.10 -1.83 -0.07 0.00 0.00 0.00 0.00 46.02 44.22 1x81 n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x81 h PRO 84 N 0.00 0.85 -3.22 1.61 0.13 -2.03 -3.36 132.00 125.99 1x81 h PRO 84 Ca 0.00 -0.10 -0.63 0.00 -0.87 0.00 0.00 66.00 64.40 1x81 h PRO 84 Cb 0.00 -0.17 -0.41 0.00 0.13 0.00 0.00 31.00 30.55 1x81 h PRO 84 CO 0.00 0.65 -0.64 -1.54 -0.23 0.00 0.00 178.00 176.24 1x81 s SER 85 N -5.93 4.27 0.37 1.44 1.04 -1.26 -5.11 113.70 108.52 1x81 s SER 85 Ca -0.13 -3.19 -0.28 0.00 0.48 0.00 0.00 55.95 52.83 1x81 s SER 85 Cb 0.13 -1.52 -0.11 0.00 0.10 0.00 0.00 66.02 64.62 1x81 s SER 85 CO 0.78 -0.19 1.45 -2.65 0.98 0.00 0.00 173.24 173.60 1x81 n PRO 86 N 2.86 2.55 -4.40 4.02 -0.02 -1.26 -5.06 135.00 133.69 1x81 n PRO 86 Ca 0.10 0.90 -0.24 0.00 -2.02 0.00 0.00 63.50 62.24 1x81 n PRO 86 Cb 0.34 -2.59 -0.11 0.00 -0.02 0.00 0.00 33.50 31.11 1x81 n PRO 86 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1x81 s VAL 87 N -1.09 2.15 -0.67 -1.45 -7.23 -1.26 -4.73 120.40 106.12 1x81 s VAL 87 Ca 0.54 -2.07 -0.02 0.00 -1.81 0.00 0.00 61.98 58.61 1x81 s VAL 87 Cb -0.50 -2.05 0.02 0.00 0.56 0.00 0.00 36.38 34.41 1x81 s VAL 87 CO 0.63 -0.27 0.06 1.33 -0.31 0.00 0.00 175.10 176.55 1x81 n VAL 88 N 0.07 -0.31 -3.15 1.32 0.24 -1.26 -4.80 118.33 110.44 1x81 n VAL 88 Ca -0.11 -0.15 -0.39 0.00 -2.04 0.00 0.00 64.34 61.65 1x81 n VAL 88 Cb 0.57 -0.36 -0.06 0.00 -1.47 0.00 0.00 33.84 32.53 1x81 n VAL 88 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1x81 s GLN 89 N -4.49 4.33 -0.06 7.34 0.74 -1.26 -5.07 119.66 121.20 1x81 s GLN 89 Ca 0.09 0.90 -0.10 0.00 0.05 0.00 0.00 55.36 56.30 1x81 s GLN 89 Cb -0.05 -3.20 -0.05 0.00 1.10 0.00 0.00 33.01 30.81 1x81 s GLN 89 CO 0.41 0.59 0.25 0.42 -0.55 0.00 0.00 175.29 176.41 1x81 s ILE 90 N -1.18 5.31 -1.24 -2.34 1.01 -1.26 -5.00 121.20 116.51 1x81 s ILE 90 Ca 0.33 0.43 -0.06 0.00 0.00 0.00 0.00 60.65 61.34 1x81 s ILE 90 Cb -0.20 -3.53 0.19 0.00 0.01 0.00 0.00 42.46 38.92 1x81 s ILE 90 CO 0.22 0.57 1.99 -0.38 0.00 0.00 0.00 174.94 177.33 1x81 n ILE 91 N 1.80 4.98 -1.16 2.92 2.08 -1.26 -5.00 119.36 123.72 1x81 n ILE 91 Ca -0.17 -4.76 -0.37 0.00 0.56 0.00 0.00 62.75 58.01 1x81 n ILE 91 Cb 0.54 -2.14 0.01 0.00 -0.75 0.00 0.00 39.64 37.30 1x81 n ILE 91 CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 1x81 n TYR 92 N 2.36 -3.02 -0.17 1.39 4.01 -1.26 -4.95 117.16 115.52 1x81 n TYR 92 Ca 0.46 0.38 0.00 0.00 -0.16 0.00 0.00 57.90 58.58 1x81 n TYR 92 Cb 0.31 -1.57 0.00 0.00 -0.31 0.00 0.00 39.34 37.76 1x81 n TYR 92 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1x81 n SER 93 N 2.49 -0.21 -0.03 7.72 3.41 -1.26 -4.84 113.62 120.90 1x81 n SER 93 Ca 0.06 -0.17 0.06 0.00 -0.26 0.00 0.00 58.87 58.56 1x81 n SER 93 Cb 0.46 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.24 1x81 n SER 93 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1x81 n GLU 94 N -0.39 0.67 0.00 4.33 2.13 -1.26 -3.46 120.64 122.67 1x81 n GLU 94 Ca 0.00 -0.15 -0.18 0.00 0.66 0.00 0.00 57.16 57.48 1x81 n GLU 94 Cb 0.00 -1.51 -0.09 0.00 0.27 0.00 0.00 31.44 30.11 1x81 n GLU 94 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1x81 h LYS 95 N 0.00 0.71 0.61 5.31 3.64 -2.00 -2.80 116.57 122.04 1x81 h LYS 95 Ca -0.12 -0.66 -0.03 0.00 -1.27 0.00 0.00 60.65 58.57 1x81 h LYS 95 Cb 1.25 0.16 0.01 0.00 -0.41 0.00 0.00 32.23 33.24 1x81 h LYS 95 CO 0.01 1.26 -0.29 0.35 -2.27 0.00 0.00 179.45 178.50 1x81 h PHE 96 N 0.39 -0.76 -0.64 1.91 3.04 -1.95 -3.09 116.94 115.84 1x81 h PHE 96 Ca -0.08 -0.02 0.14 0.00 3.98 0.00 0.00 57.97 61.98 1x81 h PHE 96 Cb 1.49 0.25 -0.11 0.00 2.56 0.00 0.00 35.95 40.14 1x81 h PHE 96 CO 0.10 -0.44 -0.02 -0.09 -2.02 0.00 0.00 178.31 175.83 1x81 h ARG 97 N -1.17 0.09 0.00 1.11 2.43 -1.68 -2.72 114.38 112.44 1x81 h ARG 97 Ca -0.08 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1x81 h ARG 97 Cb 0.66 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1x81 h ARG 97 CO 0.14 0.06 0.00 -3.47 -1.51 0.00 0.00 179.97 175.19 1x81 n ASP 98 N -5.32 0.00 -0.36 -3.80 2.03 -1.06 -1.66 116.55 106.39 1x81 n ASP 98 Ca 0.10 0.96 0.05 0.00 0.52 0.00 0.00 54.79 56.41 1x81 n ASP 98 Cb 0.37 -0.46 0.12 0.00 -0.72 0.00 0.00 41.12 40.44 1x81 n ASP 98 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1x81 n VAL 99 N -2.57 -0.44 0.15 5.18 0.31 -1.04 -0.81 118.33 119.12 1x81 n VAL 99 Ca 0.00 2.29 0.00 0.00 -0.01 0.00 0.00 64.34 66.62 1x81 n VAL 99 Cb 0.00 -3.15 0.28 0.00 -0.91 0.00 0.00 33.84 30.06 1x81 n VAL 99 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 1x81 h TYR 100 N 0.00 0.08 -0.13 3.52 -1.99 -1.35 0.09 116.97 117.19 1x81 h TYR 100 Ca 0.46 -0.02 -0.05 0.00 2.00 0.00 0.00 58.73 61.11 1x81 h TYR 100 Cb 0.71 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 39.41 1x81 h TYR 100 CO -0.79 0.50 -0.17 -0.44 -0.00 0.00 0.00 178.16 177.27 1x81 h ASP 101 N 0.06 0.19 1.27 3.88 3.32 -0.03 0.37 116.42 125.48 1x81 h ASP 101 Ca 0.00 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1x81 h ASP 101 Cb 0.80 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.30 1x81 h ASP 101 CO 0.06 0.38 -0.68 1.88 -1.72 0.00 0.00 179.24 179.16 1x81 h TYR 102 N 0.19 0.00 0.00 4.55 -1.99 -1.13 0.87 116.97 119.46 1x81 h TYR 102 Ca 0.04 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.77 1x81 h TYR 102 Cb 0.41 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.14 1x81 h TYR 102 CO 0.01 0.00 -0.00 0.35 -0.00 0.00 0.00 178.16 178.52 1x81 h PHE 103 N 0.00 0.00 -0.93 4.88 3.57 0.44 -2.83 116.94 122.07 1x81 h PHE 103 Ca 0.00 0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.65 1x81 h PHE 103 Cb 0.97 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.56 1x81 h PHE 103 CO 0.00 0.48 -0.37 0.00 -2.23 0.00 0.00 178.31 176.19 1x81 h ARG 104 N -1.00 -0.03 -0.22 1.11 3.08 -0.46 0.24 114.38 117.10 1x81 h ARG 104 Ca -0.00 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.07 1x81 h ARG 104 Cb 0.48 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 1x81 h ARG 104 CO -0.00 -0.02 -0.19 0.00 -1.07 0.00 0.00 179.97 178.69 1x81 h ALA 105 N 1.34 -0.33 -0.36 0.04 0.00 -1.60 2.22 119.26 120.58 1x81 h ALA 105 Ca 0.33 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.33 1x81 h ALA 105 Cb 0.59 0.97 -0.09 0.00 0.00 0.00 0.00 17.79 19.27 1x81 h ALA 105 CO -0.94 -0.44 -0.38 0.28 0.00 0.00 0.00 179.25 177.77 1x81 h VAL 106 N -0.07 0.17 0.11 0.00 2.07 -0.63 -1.46 116.25 116.43 1x81 h VAL 106 Ca 0.04 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.58 1x81 h VAL 106 Cb 0.17 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.06 1x81 h VAL 106 CO -0.25 0.00 -0.37 0.25 0.02 0.00 0.00 177.57 177.22 1x81 h LEU 107 N -0.32 -1.08 -1.96 2.57 5.85 0.43 0.15 115.31 120.95 1x81 h LEU 107 Ca 0.14 0.12 0.23 0.00 0.84 0.00 0.00 57.88 59.21 1x81 h LEU 107 Cb 0.57 0.41 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 1x81 h LEU 107 CO -0.53 -0.45 0.61 -0.61 -0.34 0.00 0.00 178.44 177.12 1x81 h GLN 108 N -0.59 0.00 -0.30 1.25 4.15 0.44 0.76 115.11 120.82 1x81 h GLN 108 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1x81 h GLN 108 Cb 0.63 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.32 1x81 h GLN 108 CO -0.22 0.00 0.00 2.89 -1.93 0.00 0.00 178.83 179.57 1x81 n ARG 109 N -4.11 2.15 -3.81 1.69 1.85 -0.62 -4.97 116.66 108.85 1x81 n ARG 109 Ca 0.16 -1.98 -0.28 0.00 -1.00 0.00 0.00 57.85 54.76 1x81 n ARG 109 Cb 0.89 -1.38 0.04 0.00 -1.05 0.00 0.00 32.46 30.96 1x81 n ARG 109 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1x81 n ASP 110 N 1.04 -4.74 -4.56 2.89 2.03 0.27 -4.85 116.55 108.62 1x81 n ASP 110 Ca 0.14 -0.73 -0.37 0.00 0.52 0.00 0.00 54.79 54.36 1x81 n ASP 110 Cb 0.48 -4.19 -0.03 0.00 -0.72 0.00 0.00 41.12 36.66 1x81 n ASP 110 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 1x81 s GLU 111 N -6.46 3.07 -0.78 -0.67 2.12 -0.57 -4.89 118.70 110.51 1x81 s GLU 111 Ca 0.57 -0.40 -0.05 0.00 0.36 0.00 0.00 54.97 55.45 1x81 s GLU 111 Cb -0.28 -4.83 -0.07 0.00 0.26 0.00 0.00 34.13 29.21 1x81 s GLU 111 CO 0.80 -2.57 2.19 0.54 -0.54 0.00 0.00 175.26 175.68 1x81 n ARG 112 N 9.05 1.99 -3.87 4.30 3.00 -1.26 -4.85 116.66 125.03 1x81 n ARG 112 Ca 0.25 -1.33 -0.35 0.00 -0.01 0.00 0.00 57.85 56.41 1x81 n ARG 112 Cb 0.50 -2.35 -0.05 0.00 0.00 0.00 0.00 32.46 30.56 1x81 n ARG 112 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1x81 s SER 113 N 3.17 6.40 0.48 0.55 1.04 -1.26 -4.79 113.70 119.29 1x81 s SER 113 Ca 0.41 0.43 0.32 0.00 0.48 0.00 0.00 55.95 57.59 1x81 s SER 113 Cb 0.12 -2.04 1.75 0.00 0.10 0.00 0.00 66.02 65.95 1x81 s SER 113 CO -0.03 0.31 1.99 -0.08 0.98 0.00 0.00 173.24 176.41 1x81 h GLU 114 N 4.23 0.00 0.16 4.02 4.57 -1.98 0.76 114.58 126.35 1x81 h GLU 114 Ca -0.51 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 57.34 1x81 h GLU 114 Cb 1.20 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 1x81 h GLU 114 CO 0.65 0.00 -1.62 0.07 -1.18 0.00 0.00 179.01 176.93 1x81 h ARG 115 N 0.00 0.33 -0.30 1.92 0.11 -1.96 -3.32 114.38 111.17 1x81 h ARG 115 Ca 0.00 -0.57 -0.18 0.00 0.10 0.00 0.00 59.98 59.34 1x81 h ARG 115 Cb 0.00 0.21 -0.00 0.00 1.11 0.00 0.00 29.97 31.29 1x81 h ARG 115 CO 0.00 1.22 -0.51 0.00 0.10 0.00 0.00 179.97 180.78 1x81 h ALA 116 N 0.32 0.54 -0.88 0.08 0.00 -1.38 -2.68 119.26 115.25 1x81 h ALA 116 Ca -0.29 -0.50 0.23 0.00 0.00 0.00 0.00 54.91 54.36 1x81 h ALA 116 Cb 2.06 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 19.61 1x81 h ALA 116 CO 0.18 0.68 0.10 0.35 0.00 0.00 0.00 179.25 180.56 1x81 h PHE 117 N 0.65 0.11 0.00 0.00 3.57 -1.03 1.58 116.94 121.82 1x81 h PHE 117 Ca 0.02 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 1x81 h PHE 117 Cb 1.10 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.93 1x81 h PHE 117 CO 0.07 -0.30 -0.25 0.87 -2.23 0.00 0.00 178.31 176.47 1x81 h LYS 118 N 0.11 0.00 -0.57 1.11 1.57 -1.64 -2.90 116.57 114.25 1x81 h LYS 118 Ca 0.53 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.26 1x81 h LYS 118 Cb 1.06 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.35 1x81 h LYS 118 CO -0.75 0.25 0.13 1.25 -0.57 0.00 0.00 179.45 179.75 1x81 h LEU 119 N 0.00 0.83 -1.78 2.94 5.85 0.25 -1.79 115.31 121.60 1x81 h LEU 119 Ca -0.00 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 1x81 h LEU 119 Cb 1.03 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.84 1x81 h LEU 119 CO 0.03 0.81 -0.15 0.71 -0.34 0.00 0.00 178.44 179.50 1x81 h THR 120 N 0.84 0.71 0.00 1.05 1.35 -0.85 -1.58 112.91 114.44 1x81 h THR 120 Ca 0.18 -0.63 -0.07 0.00 -0.55 0.00 0.00 66.41 65.34 1x81 h THR 120 Cb 0.32 1.39 -0.01 0.00 -1.73 0.00 0.00 68.15 68.12 1x81 h THR 120 CO 0.00 0.15 -0.34 -0.09 -0.25 0.00 0.00 175.52 175.00 1x81 h ARG 121 N 0.00 0.00 0.02 4.72 2.43 -1.35 -1.25 114.38 118.95 1x81 h ARG 121 Ca -0.00 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.93 1x81 h ARG 121 Cb 0.38 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.90 1x81 h ARG 121 CO 0.02 0.34 -1.22 -0.44 -1.51 0.00 0.00 179.97 177.15 1x81 h ASP 122 N 0.00 0.06 0.12 -3.80 3.45 -1.29 -2.73 116.42 112.22 1x81 h ASP 122 Ca -0.00 -0.07 -0.15 0.00 0.43 0.00 0.00 57.03 57.23 1x81 h ASP 122 Cb 0.72 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 39.47 1x81 h ASP 122 CO 0.04 1.06 -0.55 0.00 -1.57 0.00 0.00 179.24 178.23 1x81 h ALA 123 N 0.93 0.77 0.05 3.45 0.00 -1.15 -2.04 119.26 121.27 1x81 h ALA 123 Ca -0.10 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 1x81 h ALA 123 Cb 1.86 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1x81 h ALA 123 CO 0.13 0.69 -0.02 0.82 0.00 0.00 0.00 179.25 180.86 1x81 h ILE 124 N 0.35 1.13 0.00 0.00 2.04 -1.30 -2.53 117.51 117.21 1x81 h ILE 124 Ca 0.01 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.23 1x81 h ILE 124 Cb 1.07 1.53 -0.00 0.00 -0.74 0.00 0.00 36.82 38.68 1x81 h ILE 124 CO 0.10 0.15 -0.14 -0.33 0.00 0.00 0.00 178.15 177.93 1x81 h GLU 125 N -0.34 0.00 0.00 2.37 5.08 -1.39 0.76 114.58 121.06 1x81 h GLU 125 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1x81 h GLU 125 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1x81 h GLU 125 CO 0.01 0.14 0.00 -0.07 -1.00 0.00 0.00 179.01 178.09 1x81 h LEU 126 N 0.00 0.00 -5.00 1.33 3.38 -1.27 -3.40 115.31 110.35 1x81 h LEU 126 Ca -0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 1x81 h LEU 126 Cb 0.25 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.86 1x81 h LEU 126 CO 0.02 0.00 -0.33 -3.20 0.09 0.00 0.00 178.44 175.02 1x81 n ASN 127 N -3.01 -2.40 0.00 -0.43 5.15 -0.85 -5.01 115.26 108.71 1x81 n ASN 127 Ca 0.04 -2.61 0.00 0.00 -0.60 0.00 0.00 54.58 51.42 1x81 n ASN 127 Cb 0.50 1.41 0.02 0.00 -0.53 0.00 0.00 39.78 41.18 1x81 n ASN 127 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1x81 n ALA 128 N 1.89 1.49 0.34 5.20 0.00 0.26 -0.02 120.51 129.66 1x81 n ALA 128 Ca 0.08 -0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.62 1x81 n ALA 128 Cb 0.64 -1.01 0.27 0.00 0.00 0.00 0.00 19.45 19.35 1x81 n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x81 n ALA 129 N -1.04 2.43 -2.85 0.00 0.00 -1.26 -4.52 120.51 113.27 1x81 n ALA 129 Ca 0.01 -0.95 -0.43 0.00 0.00 0.00 0.00 53.44 52.06 1x81 n ALA 129 Cb 0.00 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.47 1x81 n ALA 129 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1x81 s ASN 130 N -1.25 6.31 0.44 0.00 3.84 0.97 -4.87 114.94 120.38 1x81 s ASN 130 Ca 0.38 -1.27 0.13 0.00 0.21 0.00 0.00 52.86 52.31 1x81 s ASN 130 Cb 0.21 -2.43 0.99 0.00 -0.55 0.00 0.00 41.25 39.47 1x81 s ASN 130 CO 0.29 -1.36 2.01 0.10 -2.79 0.00 0.00 177.10 175.34 1x81 h TYR 131 N 9.41 0.11 -0.10 0.43 -0.00 -1.87 -2.50 116.97 122.45 1x81 h TYR 131 Ca -0.15 -0.01 -0.01 0.00 0.00 0.00 0.00 58.73 58.57 1x81 h TYR 131 Cb 1.05 -0.03 -0.00 0.00 0.00 0.00 0.00 36.73 37.75 1x81 h TYR 131 CO 1.04 0.21 0.03 1.15 -0.00 0.00 0.00 178.16 180.59 1x81 h THR 132 N 0.10 1.19 -0.35 -0.90 2.02 -1.98 -1.06 112.91 111.93 1x81 h THR 132 Ca 0.02 -0.58 -0.01 0.00 0.77 0.00 0.00 66.41 66.61 1x81 h THR 132 Cb 0.24 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 1x81 h THR 132 CO 0.01 0.17 0.18 0.58 0.37 0.00 0.00 175.52 176.84 1x81 h VAL 133 N -0.04 1.15 -0.53 3.16 2.07 -1.94 -0.76 116.25 119.36 1x81 h VAL 133 Ca 0.03 -0.40 0.14 0.00 0.82 0.00 0.00 66.70 67.29 1x81 h VAL 133 Cb 0.24 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1x81 h VAL 133 CO -0.00 0.15 0.38 -0.50 0.02 0.00 0.00 177.57 177.62 1x81 h TRP 134 N 0.44 0.08 0.61 1.57 4.06 -1.22 -1.72 115.95 119.76 1x81 h TRP 134 Ca 0.12 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.04 1x81 h TRP 134 Cb 0.08 -0.02 0.01 0.00 -1.00 0.00 0.00 29.16 28.22 1x81 h TRP 134 CO -0.02 0.03 -0.29 1.25 -3.56 0.00 0.00 178.44 175.84 1x81 h HIS 135 N 0.07 -0.76 0.00 0.49 2.76 0.18 -2.77 115.15 115.12 1x81 h HIS 135 Ca 0.25 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.41 1x81 h HIS 135 Cb 0.92 0.25 0.00 0.00 1.55 0.00 0.00 27.41 30.13 1x81 h HIS 135 CO -0.00 -0.45 0.28 0.34 -1.30 0.00 0.00 177.93 176.80 1x81 n PHE 136 N -5.33 0.28 0.05 5.26 7.35 -0.71 0.13 117.46 124.49 1x81 n PHE 136 Ca -0.11 0.15 -0.21 0.00 -0.76 0.00 0.00 57.45 56.52 1x81 n PHE 136 Cb 0.34 -0.53 -0.15 0.00 0.35 0.00 0.00 39.48 39.49 1x81 n PHE 136 CO 0.00 0.00 0.00 -0.09 -0.76 0.00 0.00 176.76 175.91 1x81 h ARG 137 N 0.00 0.32 0.00 -4.13 2.43 -1.10 -2.83 114.38 109.08 1x81 h ARG 137 Ca 0.00 -0.55 -0.08 0.00 -0.81 0.00 0.00 59.98 58.54 1x81 h ARG 137 Cb 0.56 0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 1x81 h ARG 137 CO 0.00 1.22 -0.37 0.00 -1.51 0.00 0.00 179.97 179.31 1x81 h ARG 138 N 0.09 0.00 0.08 0.20 3.08 -0.21 0.29 114.38 117.91 1x81 h ARG 138 Ca -0.34 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.70 1x81 h ARG 138 Cb 2.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.12 1x81 h ARG 138 CO 0.15 0.37 -0.04 0.28 -1.07 0.00 0.00 179.97 179.66 1x81 h VAL 139 N 0.00 0.98 -0.09 2.04 2.07 -1.41 -2.18 116.25 117.66 1x81 h VAL 139 Ca -0.00 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 1x81 h VAL 139 Cb 0.68 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1x81 h VAL 139 CO 0.05 0.05 -0.28 -0.07 0.02 0.00 0.00 177.57 177.34 1x81 h LEU 140 N -0.20 0.17 -0.67 2.57 3.38 -1.11 -2.45 115.31 117.00 1x81 h LEU 140 Ca -0.01 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1x81 h LEU 140 Cb 0.17 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1x81 h LEU 140 CO 0.02 0.46 0.30 -0.07 0.09 0.00 0.00 178.44 179.23 1x81 h LEU 141 N 0.15 0.90 0.07 1.67 3.38 -0.13 -1.46 115.31 119.90 1x81 h LEU 141 Ca 0.02 -0.15 -0.28 0.00 0.09 0.00 0.00 57.88 57.56 1x81 h LEU 141 Cb 0.59 -0.23 0.03 0.00 0.09 0.00 0.00 40.66 41.13 1x81 h LEU 141 CO 0.04 0.80 -1.12 0.08 0.09 0.00 0.00 178.44 178.33 1x81 h ARG 142 N 0.94 0.64 0.09 1.13 -0.00 -1.12 0.84 114.38 116.89 1x81 h ARG 142 Ca 0.23 -0.78 -0.00 0.00 -0.00 0.00 0.00 59.98 59.42 1x81 h ARG 142 Cb 0.16 0.24 0.00 0.00 -0.00 0.00 0.00 29.97 30.38 1x81 h ARG 142 CO -0.02 1.35 -0.04 0.77 -0.00 0.00 0.00 179.97 182.02 1x81 h SER 143 N 0.29 -0.10 0.03 0.08 0.02 -1.50 -2.95 113.55 109.41 1x81 h SER 143 Ca -0.16 -0.46 0.00 0.00 -0.84 0.00 0.00 61.79 60.33 1x81 h SER 143 Cb 1.79 0.03 0.00 0.00 0.14 0.00 0.00 62.40 64.36 1x81 h SER 143 CO 0.22 0.56 0.00 -0.07 -1.14 0.00 0.00 176.83 176.40 1x81 h LEU 144 N -0.91 0.00 -2.47 5.07 3.38 -1.43 -3.46 115.31 115.50 1x81 h LEU 144 Ca -0.01 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.65 1x81 h LEU 144 Cb 0.55 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.46 1x81 h LEU 144 CO 0.02 0.00 -0.86 0.00 0.09 0.00 0.00 178.44 177.68 1x81 n GLN 145 N -2.78 -2.74 -2.80 1.13 6.02 -0.59 -4.94 117.38 110.68 1x81 n GLN 145 Ca -0.02 0.76 -0.35 0.00 -0.01 0.00 0.00 57.00 57.37 1x81 n GLN 145 Cb 0.06 -5.42 -0.07 0.00 1.02 0.00 0.00 30.24 25.84 1x81 n GLN 145 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1x81 s LYS 146 N -4.98 4.44 -0.58 -1.09 -0.14 0.19 -4.93 119.74 112.65 1x81 s LYS 146 Ca 0.37 1.24 -0.26 0.00 -1.36 0.00 0.00 55.97 55.96 1x81 s LYS 146 Cb -0.07 -2.55 -0.08 0.00 -1.68 0.00 0.00 37.83 33.45 1x81 s LYS 146 CO 0.77 0.15 2.34 0.34 -0.76 0.00 0.00 175.35 178.20 1x81 s ASP 147 N -1.85 4.41 0.10 2.83 3.68 -1.26 -4.81 116.67 119.77 1x81 s ASP 147 Ca 0.55 0.74 0.05 0.00 2.13 0.00 0.00 52.55 56.02 1x81 s ASP 147 Cb -0.15 -2.52 0.28 0.00 -1.45 0.00 0.00 42.92 39.09 1x81 s ASP 147 CO 0.19 -3.05 1.06 0.18 0.13 0.00 0.00 175.17 173.68 1x81 n LEU 148 N 16.17 0.13 0.09 -1.34 4.77 -1.26 -0.53 117.00 135.04 1x81 n LEU 148 Ca 0.37 0.46 0.09 0.00 -0.03 0.00 0.00 56.01 56.90 1x81 n LEU 148 Cb 0.52 -0.46 -0.01 0.00 -2.33 0.00 0.00 43.42 41.13 1x81 n LEU 148 CO 0.67 -0.51 -0.02 1.56 -1.33 0.00 0.00 177.39 177.76 1x81 h GLN 149 N 0.00 0.00 0.05 3.23 1.08 -1.98 -1.67 115.11 115.82 1x81 h GLN 149 Ca 0.00 0.00 -0.25 0.00 -1.45 0.00 0.00 58.65 56.95 1x81 h GLN 149 Cb 0.28 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 1x81 h GLN 149 CO 0.00 0.07 -1.27 1.49 -0.95 0.00 0.00 178.83 178.18 1x81 h GLU 150 N 0.00 0.10 0.00 1.46 4.81 -1.20 -2.97 114.58 116.79 1x81 h GLU 150 Ca -0.04 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 1x81 h GLU 150 Cb 1.14 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.59 1x81 h GLU 150 CO 0.01 0.99 0.00 -1.91 -0.73 0.00 0.00 179.01 177.37 1x81 n GLU 151 N -3.36 0.18 0.07 1.92 4.07 -0.86 -2.30 120.64 120.36 1x81 n GLU 151 Ca -0.08 0.21 -0.14 0.00 -0.06 0.00 0.00 57.16 57.09 1x81 n GLU 151 Cb 0.99 -1.74 -0.14 0.00 -0.06 0.00 0.00 31.44 30.50 1x81 n GLU 151 CO 0.00 0.00 0.00 0.52 -0.06 0.00 0.00 177.13 177.59 1x81 h MET 152 N 0.00 0.20 -0.18 5.31 2.86 -1.17 -2.86 114.93 119.09 1x81 h MET 152 Ca 0.00 -0.34 -0.09 0.00 -2.06 0.00 0.00 59.70 57.20 1x81 h MET 152 Cb 0.58 0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 1x81 h MET 152 CO 0.00 1.09 -0.29 -0.91 1.06 0.00 0.00 176.91 177.85 1x81 h ASN 153 N 0.05 0.36 0.64 1.22 2.35 -1.33 -0.38 115.58 118.49 1x81 h ASN 153 Ca -0.18 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.42 1x81 h ASN 153 Cb 1.97 -0.10 0.01 0.00 0.05 0.00 0.00 38.32 40.25 1x81 h ASN 153 CO 0.16 0.64 -0.31 0.22 -1.65 0.00 0.00 177.43 176.50 1x81 h TYR 154 N 0.31 -0.79 0.00 1.19 3.20 -1.46 -2.96 116.97 116.46 1x81 h TYR 154 Ca 0.04 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1x81 h TYR 154 Cb 0.68 0.26 -0.00 0.00 1.54 0.00 0.00 36.73 39.21 1x81 h TYR 154 CO 0.02 -0.46 -0.08 0.97 -1.64 0.00 0.00 178.16 176.97 1x81 h ILE 155 N -0.98 0.93 -0.80 1.81 6.09 -1.34 -0.91 117.51 122.31 1x81 h ILE 155 Ca -0.09 -0.30 -0.03 0.00 -1.37 0.00 0.00 64.86 63.07 1x81 h ILE 155 Cb 0.69 1.17 -0.04 0.00 0.47 0.00 0.00 36.82 39.11 1x81 h ILE 155 CO 0.14 0.08 0.37 0.40 -3.07 0.00 0.00 178.15 176.08 1x81 h ILE 156 N 0.00 1.25 -0.38 2.19 2.04 -1.00 -2.93 117.51 118.68 1x81 h ILE 156 Ca -0.00 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.10 1x81 h ILE 156 Cb 0.16 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1x81 h ILE 156 CO 0.01 0.31 0.09 0.00 0.00 0.00 0.00 178.15 178.56 1x81 h ALA 157 N 1.26 0.50 -0.38 1.87 0.00 -1.00 -2.80 119.26 118.70 1x81 h ALA 157 Ca 0.27 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 1x81 h ALA 157 Cb 0.13 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1x81 h ALA 157 CO -0.03 0.17 -0.28 0.82 0.00 0.00 0.00 179.25 179.93 1x81 h ILE 158 N 0.46 1.28 -0.70 0.00 1.08 -1.47 -2.72 117.51 115.44 1x81 h ILE 158 Ca 0.12 -1.43 -0.05 0.00 -0.39 0.00 0.00 64.86 63.11 1x81 h ILE 158 Cb 0.31 1.29 -0.03 0.00 -3.07 0.00 0.00 36.82 35.32 1x81 h ILE 158 CO 0.00 0.47 0.25 0.40 -0.69 0.00 0.00 178.15 178.59 1x81 h ILE 159 N 0.69 1.25 0.00 -0.67 2.04 -1.52 0.31 117.51 119.61 1x81 h ILE 159 Ca 0.08 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 65.10 1x81 h ILE 159 Cb 0.82 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1x81 h ILE 159 CO 0.07 0.33 -0.09 -0.33 0.00 0.00 0.00 178.15 178.13 1x81 h GLU 160 N 1.01 0.00 0.00 2.37 4.39 -1.38 -0.64 114.58 120.33 1x81 h GLU 160 Ca 0.23 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.76 1x81 h GLU 160 Cb 0.25 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 1x81 h GLU 160 CO -0.01 0.09 -1.28 0.93 -1.16 0.00 0.00 179.01 177.57 1x81 h GLU 161 N 0.00 0.00 -1.49 2.33 5.08 -0.87 -3.41 114.58 116.22 1x81 h GLU 161 Ca -0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.89 1x81 h GLU 161 Cb 0.18 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 29.10 1x81 h GLU 161 CO 0.01 0.37 -0.95 1.04 -1.00 0.00 0.00 179.01 178.48 1x81 n GLN 162 N -2.97 0.73 0.00 2.33 6.02 0.97 -4.98 117.38 119.47 1x81 n GLN 162 Ca -0.08 -2.85 0.00 0.00 -0.01 0.00 0.00 57.00 54.06 1x81 n GLN 162 Cb 0.85 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.83 1x81 n GLN 162 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1x81 n PRO 163 N 1.45 0.00 -0.25 -1.09 -0.02 -0.28 -2.47 135.00 132.34 1x81 n PRO 163 Ca 0.18 0.19 0.07 0.00 -2.02 0.00 0.00 63.50 61.92 1x81 n PRO 163 Cb 0.56 -1.50 0.18 0.00 -0.02 0.00 0.00 33.50 32.71 1x81 n PRO 163 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1x81 n LYS 164 N -1.19 2.66 -3.32 -0.52 4.76 -1.26 -4.82 118.16 114.47 1x81 n LYS 164 Ca 0.00 -2.39 -0.38 0.00 -2.87 0.00 0.00 58.31 52.66 1x81 n LYS 164 Cb 0.00 -1.51 -0.06 0.00 -1.84 0.00 0.00 35.03 31.62 1x81 n LYS 164 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1x81 s ASN 165 N -1.68 7.01 0.07 4.39 3.04 -1.03 -4.97 114.94 121.76 1x81 s ASN 165 Ca 0.29 1.20 0.13 0.00 0.04 0.00 0.00 52.86 54.52 1x81 s ASN 165 Cb 0.22 -2.34 -0.16 0.00 -1.54 0.00 0.00 41.25 37.44 1x81 s ASN 165 CO 0.09 0.28 0.97 0.22 -3.04 0.00 0.00 177.10 175.62 1x81 h TYR 166 N 4.56 0.00 0.00 0.43 3.20 -1.92 -3.35 116.97 119.89 1x81 h TYR 166 Ca -0.50 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.27 1x81 h TYR 166 Cb 1.21 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.47 1x81 h TYR 166 CO 0.69 0.82 -0.47 1.96 -1.64 0.00 0.00 178.16 179.51 1x81 h GLN 167 N 0.00 0.00 0.00 1.82 1.08 -1.94 -3.31 115.11 112.77 1x81 h GLN 167 Ca -0.14 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.06 1x81 h GLN 167 Cb 1.75 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.18 1x81 h GLN 167 CO 0.08 0.47 0.00 1.55 -0.95 0.00 0.00 178.83 179.98 1x81 n VAL 168 N -3.28 0.41 -0.03 -0.54 3.14 -1.25 -3.48 118.33 113.30 1x81 n VAL 168 Ca 0.01 -0.13 -0.00 0.00 -2.96 0.00 0.00 64.34 61.26 1x81 n VAL 168 Cb 0.68 -0.60 -0.13 0.00 -1.06 0.00 0.00 33.84 32.72 1x81 n VAL 168 CO 0.00 0.00 0.00 0.79 -6.46 0.00 0.00 176.83 171.16 1x81 n TRP 169 N -1.96 0.36 -0.05 1.45 7.02 -1.25 -3.88 117.44 119.14 1x81 n TRP 169 Ca 0.06 0.12 -0.09 0.00 -1.02 0.00 0.00 57.50 56.57 1x81 n TRP 169 Cb 0.38 -0.89 0.06 0.00 -2.42 0.00 0.00 31.31 28.44 1x81 n TRP 169 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1x81 h HIS 170 N 0.00 0.83 -0.35 -5.99 2.76 -1.64 -1.59 115.15 109.16 1x81 h HIS 170 Ca -0.25 -0.24 -0.02 0.00 -2.20 0.00 0.00 60.37 57.65 1x81 h HIS 170 Cb 1.65 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 30.42 1x81 h HIS 170 CO 0.00 0.98 0.13 1.25 -1.30 0.00 0.00 177.93 178.99 1x81 h HIS 171 N 0.57 0.55 0.00 5.26 6.17 -1.72 0.13 115.15 126.12 1x81 h HIS 171 Ca 0.05 -0.05 -0.01 0.00 0.71 0.00 0.00 60.37 61.07 1x81 h HIS 171 Cb 0.93 -0.16 -0.00 0.00 2.52 0.00 0.00 27.41 30.69 1x81 h HIS 171 CO 0.05 0.52 -0.04 -0.09 0.71 0.00 0.00 177.93 179.08 1x81 h ARG 172 N 0.42 0.00 0.10 5.26 2.43 -1.62 -0.27 114.38 120.71 1x81 h ARG 172 Ca 0.12 0.00 -0.27 0.00 -0.81 0.00 0.00 59.98 59.01 1x81 h ARG 172 Cb 0.21 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1x81 h ARG 172 CO -0.01 0.04 -1.30 -0.09 -1.51 0.00 0.00 179.97 177.10 1x81 h ARG 173 N 0.00 0.22 0.04 0.20 2.43 -0.27 -2.62 114.38 114.38 1x81 h ARG 173 Ca -0.00 -0.37 -0.00 0.00 -0.81 0.00 0.00 59.98 58.79 1x81 h ARG 173 Cb 0.39 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1x81 h ARG 173 CO 0.01 1.14 -0.02 0.28 -1.51 0.00 0.00 179.97 179.86 1x81 h VAL 174 N 0.06 1.17 0.38 0.20 2.07 0.32 -2.71 116.25 117.74 1x81 h VAL 174 Ca -0.15 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 1x81 h VAL 174 Cb 1.96 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 33.33 1x81 h VAL 174 CO 0.18 0.17 -0.36 -0.07 0.02 0.00 0.00 177.57 177.51 1x81 h LEU 175 N -0.35 -0.97 -1.37 2.57 3.38 -1.16 0.59 115.31 118.00 1x81 h LEU 175 Ca -0.01 0.08 0.37 0.00 0.09 0.00 0.00 57.88 58.41 1x81 h LEU 175 Cb 0.32 0.32 -0.12 0.00 0.09 0.00 0.00 40.66 41.27 1x81 h LEU 175 CO 0.01 -0.48 0.76 0.58 0.09 0.00 0.00 178.44 179.40 1x81 h VAL 176 N -0.73 0.28 0.00 1.22 2.07 -1.52 1.63 116.25 119.20 1x81 h VAL 176 Ca -0.05 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1x81 h VAL 176 Cb 0.63 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1x81 h VAL 176 CO -0.03 0.04 -0.56 -1.84 0.02 0.00 0.00 177.57 175.19 1x81 n GLU 177 N -4.70 0.08 0.11 1.57 0.28 -1.02 -1.45 120.64 115.51 1x81 n GLU 177 Ca 0.32 0.02 -0.02 0.00 -0.16 0.00 0.00 57.16 57.32 1x81 n GLU 177 Cb 1.20 -1.54 0.02 0.00 1.43 0.00 0.00 31.44 32.55 1x81 n GLU 177 CO 0.00 0.00 0.00 -1.49 -0.16 0.00 0.00 177.13 175.48 1x81 h TRP 178 N 0.00 0.00 0.00 -1.84 4.06 0.47 -3.32 115.95 115.32 1x81 h TRP 178 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1x81 h TRP 178 Cb 0.56 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.72 1x81 h TRP 178 CO 0.00 0.72 -0.94 1.28 -3.56 0.00 0.00 178.44 175.94 1x81 n LEU 179 N -3.39 0.37 -2.85 -4.49 4.77 -0.33 -5.01 117.00 106.06 1x81 n LEU 179 Ca 0.00 -0.32 -0.19 0.00 -0.03 0.00 0.00 56.01 55.48 1x81 n LEU 179 Cb 0.78 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.93 1x81 n LEU 179 CO 0.43 0.09 0.17 0.29 -1.33 0.00 0.00 177.39 177.04 1x81 n LYS 180 N -1.52 -5.91 -3.71 3.23 4.76 -0.53 -5.00 118.16 109.48 1x81 n LYS 180 Ca 0.01 0.66 -0.28 0.00 -2.87 0.00 0.00 58.31 55.83 1x81 n LYS 180 Cb 0.24 -5.16 -0.16 0.00 -1.84 0.00 0.00 35.03 28.11 1x81 n LYS 180 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1x81 s ASP 181 N -3.18 3.20 0.00 4.39 2.15 -1.06 -4.95 116.67 117.23 1x81 s ASP 181 Ca 0.43 -1.04 0.22 0.00 0.43 0.00 0.00 52.55 52.59 1x81 s ASP 181 Cb -0.19 -0.62 0.50 0.00 -0.30 0.00 0.00 42.92 42.31 1x81 s ASP 181 CO 0.53 -0.34 1.44 -0.81 -0.17 0.00 0.00 175.17 175.81 1x81 n PRO 182 N 5.03 2.58 -0.32 4.34 -0.04 -1.26 -4.66 135.00 140.66 1x81 n PRO 182 Ca -0.07 -2.41 0.36 0.00 -0.04 0.00 0.00 63.50 61.33 1x81 n PRO 182 Cb 0.46 -1.52 0.71 0.00 -0.04 0.00 0.00 33.50 33.11 1x81 n PRO 182 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1x81 h SER 183 N 4.27 0.00 0.00 3.54 4.64 -1.99 -3.34 113.55 120.67 1x81 h SER 183 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1x81 h SER 183 Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 1x81 h SER 183 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1x81 n GLN 184 N -3.89 0.00 0.00 4.77 6.02 -1.26 -4.89 117.38 118.13 1x81 n GLN 184 Ca 0.26 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.25 1x81 n GLN 184 Cb 1.37 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.63 1x81 n GLN 184 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1x81 n GLU 185 N 0.00 0.00 -0.36 -1.09 -0.58 -1.25 -3.00 120.64 114.35 1x81 n GLU 185 Ca 0.00 0.00 0.26 0.00 -0.42 0.00 0.00 57.16 57.00 1x81 n GLU 185 Cb 0.00 0.00 0.52 0.00 -0.57 0.00 0.00 31.44 31.39 1x81 n GLU 185 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1x81 h LEU 186 N 0.00 0.44 -0.11 -4.62 3.38 -1.90 1.49 115.31 113.98 1x81 h LEU 186 Ca 0.00 0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1x81 h LEU 186 Cb 0.00 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1x81 h LEU 186 CO 0.00 -0.03 -0.10 -0.33 0.09 0.00 0.00 178.44 178.08 1x81 h GLU 187 N 0.33 0.26 0.38 1.13 5.08 -1.89 -1.18 114.58 118.68 1x81 h GLU 187 Ca 0.69 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.90 1x81 h GLU 187 Cb 1.77 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.00 1x81 h GLU 187 CO -0.42 0.66 -0.37 0.35 -1.00 0.00 0.00 179.01 178.23 1x81 h PHE 188 N -0.14 -1.03 -1.05 4.33 3.57 0.12 -0.76 116.94 121.99 1x81 h PHE 188 Ca 0.02 0.01 0.27 0.00 3.53 0.00 0.00 57.97 61.80 1x81 h PHE 188 Cb 0.60 0.40 -0.11 0.00 2.79 0.00 0.00 35.95 39.64 1x81 h PHE 188 CO 0.08 -0.50 0.66 0.82 -2.23 0.00 0.00 178.31 177.14 1x81 h ILE 189 N -0.75 0.49 -0.32 1.41 2.04 0.17 0.54 117.51 121.09 1x81 h ILE 189 Ca -0.05 -0.15 -0.11 0.00 1.00 0.00 0.00 64.86 65.56 1x81 h ILE 189 Cb 0.65 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1x81 h ILE 189 CO -0.04 0.08 -0.24 0.00 0.00 0.00 0.00 178.15 177.95 1x81 h ALA 190 N 1.66 0.99 -0.44 1.87 0.00 -0.59 -1.54 119.26 121.21 1x81 h ALA 190 Ca 0.63 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 1x81 h ALA 190 Cb 1.50 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 1x81 h ALA 190 CO -0.37 0.60 -0.03 0.22 0.00 0.00 0.00 179.25 179.67 1x81 h ASP 191 N 0.55 0.79 -0.06 0.00 3.58 0.15 -1.10 116.42 120.34 1x81 h ASP 191 Ca 0.08 -0.32 -0.00 0.00 0.42 0.00 0.00 57.03 57.20 1x81 h ASP 191 Cb 0.70 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.54 1x81 h ASP 191 CO 0.05 0.93 0.02 0.40 -2.88 0.00 0.00 179.24 177.76 1x81 h ILE 192 N 0.64 1.15 0.00 2.25 1.08 -1.08 -1.73 117.51 119.82 1x81 h ILE 192 Ca 0.12 -0.45 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 1x81 h ILE 192 Cb 0.54 1.34 0.00 0.00 -3.07 0.00 0.00 36.82 35.63 1x81 h ILE 192 CO 0.03 0.13 0.00 0.18 -0.69 0.00 0.00 178.15 177.79 1x81 n LEU 193 N -4.95 0.00 -0.12 1.44 4.77 -0.60 -0.81 117.00 116.73 1x81 n LEU 193 Ca -0.06 0.23 0.13 0.00 -0.03 0.00 0.00 56.01 56.27 1x81 n LEU 193 Cb 0.12 -0.23 0.34 0.00 -2.33 0.00 0.00 43.42 41.31 1x81 n LEU 193 CO 0.34 -0.14 0.58 -3.20 -1.33 0.00 0.00 177.39 173.64 1x81 n ASN 194 N -1.23 0.74 -0.08 -1.43 2.85 -0.42 -2.57 115.26 113.11 1x81 n ASN 194 Ca 0.07 -0.56 -0.09 0.00 -0.11 0.00 0.00 54.58 53.89 1x81 n ASN 194 Cb 0.09 0.16 -0.12 0.00 1.24 0.00 0.00 39.78 41.16 1x81 n ASN 194 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1x81 n GLN 195 N -1.07 1.21 -3.35 1.20 6.02 0.01 -4.87 117.38 116.55 1x81 n GLN 195 Ca 0.09 0.02 -0.11 0.00 -0.01 0.00 0.00 57.00 56.99 1x81 n GLN 195 Cb 0.34 -1.41 -0.08 0.00 1.02 0.00 0.00 30.24 30.11 1x81 n GLN 195 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1x81 s ASP 196 N -5.17 0.54 0.00 1.08 2.15 -1.00 -5.05 116.67 109.22 1x81 s ASP 196 Ca -0.12 -0.13 0.30 0.00 0.43 0.00 0.00 52.55 53.03 1x81 s ASP 196 Cb 0.05 1.00 1.72 0.00 -0.30 0.00 0.00 42.92 45.38 1x81 s ASP 196 CO 0.62 -0.33 2.11 0.00 -0.17 0.00 0.00 175.17 177.40 1x81 n ALA 197 N 5.35 2.67 -1.93 3.66 0.00 -1.06 -3.33 120.51 125.87 1x81 n ALA 197 Ca -0.02 -0.22 -0.11 0.00 0.00 0.00 0.00 53.44 53.09 1x81 n ALA 197 Cb 0.49 -1.45 0.09 0.00 0.00 0.00 0.00 19.45 18.58 1x81 n ALA 197 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1x81 n LYS 198 N -0.84 2.70 -2.59 0.00 5.02 -1.26 -4.83 118.16 116.36 1x81 n LYS 198 Ca 0.22 -3.77 -0.42 0.00 -2.02 0.00 0.00 58.31 52.32 1x81 n LYS 198 Cb 0.13 -1.94 -0.03 0.00 -0.02 0.00 0.00 35.03 33.17 1x81 n LYS 198 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1x81 s ASN 199 N -3.43 6.38 0.14 4.39 3.84 -1.21 -4.94 114.94 120.11 1x81 s ASN 199 Ca 0.45 -0.03 -0.30 0.00 0.21 0.00 0.00 52.86 53.19 1x81 s ASN 199 Cb 0.39 -2.55 -0.05 0.00 -0.55 0.00 0.00 41.25 38.49 1x81 s ASN 199 CO -0.01 -1.54 1.57 0.22 -2.79 0.00 0.00 177.10 174.55 1x81 h TYR 200 N 9.63 -1.41 -0.69 0.43 3.20 -1.93 -2.39 116.97 123.81 1x81 h TYR 200 Ca -0.26 0.07 0.08 0.00 3.14 0.00 0.00 58.73 61.76 1x81 h TYR 200 Cb 1.06 0.66 -0.06 0.00 1.54 0.00 0.00 36.73 39.92 1x81 h TYR 200 CO 1.05 -0.47 0.36 0.45 -1.64 0.00 0.00 178.16 177.91 1x81 h HIS 201 N -0.40 0.65 0.37 -3.82 3.86 -1.92 0.03 115.15 113.92 1x81 h HIS 201 Ca 0.10 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1x81 h HIS 201 Cb 0.61 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.87 1x81 h HIS 201 CO -0.63 0.26 -0.35 0.00 0.86 0.00 0.00 177.93 178.07 1x81 h ALA 202 N 1.40 -0.76 -0.61 2.45 0.00 -1.79 0.39 119.26 120.34 1x81 h ALA 202 Ca 0.33 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.22 1x81 h ALA 202 Cb 0.30 0.50 -0.08 0.00 0.00 0.00 0.00 17.79 18.51 1x81 h ALA 202 CO -0.24 -0.96 0.19 -1.49 0.00 0.00 0.00 179.25 176.75 1x81 h TRP 203 N -0.74 0.33 -0.10 0.00 -0.00 -0.94 0.31 115.95 114.81 1x81 h TRP 203 Ca -0.03 0.03 0.00 0.00 -0.00 0.00 0.00 58.89 58.90 1x81 h TRP 203 Cb 0.66 -0.05 -0.00 0.00 -0.00 0.00 0.00 29.16 29.76 1x81 h TRP 203 CO -0.20 0.05 0.07 0.37 -0.00 0.00 0.00 178.44 178.73 1x81 h GLN 204 N 0.35 0.13 0.00 0.49 4.15 -0.34 0.98 115.11 120.87 1x81 h GLN 204 Ca 0.31 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.71 1x81 h GLN 204 Cb 0.42 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.08 1x81 h GLN 204 CO -0.34 0.09 -0.06 1.25 -1.93 0.00 0.00 178.83 177.84 1x81 h HIS 205 N 0.13 0.00 0.08 3.99 2.76 0.43 -1.99 115.15 120.56 1x81 h HIS 205 Ca 0.04 0.00 -0.26 0.00 -2.20 0.00 0.00 60.37 57.94 1x81 h HIS 205 Cb -0.01 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 1x81 h HIS 205 CO -0.07 0.06 -1.27 -0.09 -1.30 0.00 0.00 177.93 175.26 1x81 h ARG 206 N 0.00 0.18 -0.06 5.26 2.43 0.92 -2.43 114.38 120.66 1x81 h ARG 206 Ca -0.00 -0.30 -0.15 0.00 -0.81 0.00 0.00 59.98 58.72 1x81 h ARG 206 Cb 0.38 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1x81 h ARG 206 CO 0.01 1.09 -0.62 1.96 -1.51 0.00 0.00 179.97 180.89 1x81 h GLN 207 N 0.05 0.24 0.90 0.20 4.20 -0.44 -2.26 115.11 117.99 1x81 h GLN 207 Ca -0.13 -0.17 -0.04 0.00 0.06 0.00 0.00 58.65 58.36 1x81 h GLN 207 Cb 1.93 0.03 0.01 0.00 0.30 0.00 0.00 27.48 29.75 1x81 h GLN 207 CO 0.17 0.78 -0.43 2.35 -0.67 0.00 0.00 178.83 181.03 1x81 h TRP 208 N 0.17 -1.12 -0.75 2.96 7.01 -1.39 0.01 115.95 122.84 1x81 h TRP 208 Ca -0.01 -0.03 0.14 0.00 2.11 0.00 0.00 58.89 61.11 1x81 h TRP 208 Cb 1.14 0.37 -0.05 0.00 -2.10 0.00 0.00 29.16 28.52 1x81 h TRP 208 CO 0.02 -0.69 0.50 0.28 -2.79 0.00 0.00 178.44 175.76 1x81 h VAL 209 N -1.30 0.81 0.00 2.65 2.07 -1.43 -0.03 116.25 119.02 1x81 h VAL 209 Ca -0.12 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 1x81 h VAL 209 Cb 0.93 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1x81 h VAL 209 CO 0.20 0.08 -0.00 0.40 0.02 0.00 0.00 177.57 178.27 1x81 h ILE 210 N 0.43 1.52 0.74 4.57 2.04 -1.16 -2.66 117.51 123.00 1x81 h ILE 210 Ca 0.37 -1.56 -0.04 0.00 1.00 0.00 0.00 64.86 64.63 1x81 h ILE 210 Cb 0.82 2.58 0.01 0.00 -0.74 0.00 0.00 36.82 39.48 1x81 h ILE 210 CO -0.12 0.40 -0.36 1.56 0.00 0.00 0.00 178.15 179.64 1x81 h GLN 211 N -0.67 -0.96 -0.78 2.37 4.20 -0.64 0.27 115.11 118.89 1x81 h GLN 211 Ca -0.00 0.07 0.13 0.00 0.06 0.00 0.00 58.65 58.91 1x81 h GLN 211 Cb 0.66 0.22 -0.05 0.00 0.30 0.00 0.00 27.48 28.61 1x81 h GLN 211 CO 0.00 -0.62 0.51 0.93 -0.67 0.00 0.00 178.83 178.98 1x81 h GLU 212 N -1.09 0.52 -0.20 1.46 4.39 -1.15 -2.50 114.58 116.01 1x81 h GLU 212 Ca -0.10 -0.03 -0.07 0.00 0.34 0.00 0.00 59.36 59.50 1x81 h GLU 212 Cb 0.78 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.28 1x81 h GLU 212 CO 0.17 0.34 -0.12 1.19 -1.16 0.00 0.00 179.01 179.44 1x81 n PHE 213 N -4.50 0.64 -4.31 4.33 3.01 -1.00 -4.98 117.46 110.65 1x81 n PHE 213 Ca 0.14 -1.28 -0.39 0.00 1.01 0.00 0.00 57.45 56.93 1x81 n PHE 213 Cb 0.47 -0.34 -0.07 0.00 -0.01 0.00 0.00 39.48 39.53 1x81 n PHE 213 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1x81 n ARG 214 N -1.04 -0.74 -0.98 -1.08 5.12 -0.02 -4.80 116.66 113.11 1x81 n ARG 214 Ca 0.24 0.13 -0.20 0.00 -1.93 0.00 0.00 57.85 56.09 1x81 n ARG 214 Cb 0.86 -4.32 0.04 0.00 -1.16 0.00 0.00 32.46 27.89 1x81 n ARG 214 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1x81 n LEU 215 N -3.81 6.69 0.00 0.55 4.77 -0.58 -4.74 117.00 119.88 1x81 n LEU 215 Ca 0.09 -3.49 0.00 0.00 -0.03 0.00 0.00 56.01 52.59 1x81 n LEU 215 Cb 0.42 -1.05 0.00 0.00 -2.33 0.00 0.00 43.42 40.47 1x81 n LEU 215 CO 0.89 1.28 0.23 0.79 -1.33 0.00 0.00 177.39 179.25 1x81 n TRP 216 N 0.14 0.00 0.00 -1.77 7.02 -1.26 -4.56 117.44 117.01 1x81 n TRP 216 Ca 0.36 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.84 1x81 n TRP 216 Cb 0.59 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.48 1x81 n TRP 216 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1x81 n ASP 217 N -0.47 0.00 -1.14 -0.99 9.92 -1.26 -0.46 116.55 122.15 1x81 n ASP 217 Ca 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.25 1x81 n ASP 217 Cb 0.00 0.00 0.11 0.00 -0.64 0.00 0.00 41.12 40.59 1x81 n ASP 217 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1x81 n ASN 218 N 0.99 2.86 -0.03 -2.24 3.02 -1.26 -4.20 115.26 114.39 1x81 n ASN 218 Ca 0.00 -2.40 -0.19 0.00 -0.03 0.00 0.00 54.58 51.96 1x81 n ASN 218 Cb 0.00 -0.58 -0.13 0.00 -0.61 0.00 0.00 39.78 38.45 1x81 n ASN 218 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1x81 h GLU 219 N 1.02 0.14 0.00 3.52 4.57 -1.04 -2.26 114.58 120.54 1x81 h GLU 219 Ca 0.08 -0.24 -0.00 0.00 -1.18 0.00 0.00 59.36 58.01 1x81 h GLU 219 Cb 1.23 0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.91 1x81 h GLU 219 CO 0.24 1.12 -0.00 1.25 -1.18 0.00 0.00 179.01 180.44 1x81 h LEU 220 N -0.64 0.00 -0.17 1.64 5.85 -1.82 0.15 115.31 120.32 1x81 h LEU 220 Ca -0.20 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.43 1x81 h LEU 220 Cb 1.44 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.47 1x81 h LEU 220 CO 0.01 0.00 -0.26 -0.61 -0.34 0.00 0.00 178.44 177.24 1x81 h GLN 221 N 0.00 0.48 -0.43 1.25 4.15 -1.80 -2.32 115.11 116.44 1x81 h GLN 221 Ca -0.00 -0.29 -0.06 0.00 0.77 0.00 0.00 58.65 59.07 1x81 h GLN 221 Cb 0.01 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 1x81 h GLN 221 CO 0.00 0.88 0.03 -0.92 -1.93 0.00 0.00 178.83 176.89 1x81 h TYR 222 N 0.12 0.80 -0.23 3.99 3.20 -0.52 -2.99 116.97 121.34 1x81 h TYR 222 Ca 0.02 -0.13 0.04 0.00 3.14 0.00 0.00 58.73 61.79 1x81 h TYR 222 Cb 0.84 -0.21 -0.07 0.00 1.54 0.00 0.00 36.73 38.83 1x81 h TYR 222 CO 0.09 0.79 -0.52 0.28 -1.64 0.00 0.00 178.16 177.16 1x81 h VAL 223 N 0.59 0.00 -0.89 1.81 2.07 -0.67 -1.01 116.25 118.15 1x81 h VAL 223 Ca 0.13 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.85 1x81 h VAL 223 Cb 0.45 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.16 1x81 h VAL 223 CO 0.02 0.00 0.59 0.44 0.02 0.00 0.00 177.57 178.64 1x81 h ASP 224 N -0.48 0.34 0.71 0.57 3.32 -1.37 -0.43 116.42 119.08 1x81 h ASP 224 Ca 0.05 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1x81 h ASP 224 Cb 0.61 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 40.14 1x81 h ASP 224 CO -0.48 0.14 -0.34 -0.61 -1.72 0.00 0.00 179.24 176.23 1x81 h GLN 225 N 0.34 -0.91 -0.87 3.56 4.15 -1.07 -2.82 115.11 117.49 1x81 h GLN 225 Ca 0.46 0.06 0.09 0.00 0.77 0.00 0.00 58.65 60.03 1x81 h GLN 225 Cb 1.23 0.21 -0.06 0.00 0.21 0.00 0.00 27.48 29.06 1x81 h GLN 225 CO -0.15 -0.61 0.56 -0.07 -1.93 0.00 0.00 178.83 176.63 1x81 h LEU 226 N -1.04 0.78 -2.46 -2.39 3.38 -0.79 0.79 115.31 113.57 1x81 h LEU 226 Ca -0.10 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1x81 h LEU 226 Cb 0.73 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 1x81 h LEU 226 CO 0.16 0.46 -0.02 -0.07 0.09 0.00 0.00 178.44 179.06 1x81 h LEU 227 N 0.86 0.00 0.02 1.67 3.38 -1.02 -2.07 115.31 118.16 1x81 h LEU 227 Ca 0.40 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.33 1x81 h LEU 227 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1x81 h LEU 227 CO -0.17 0.02 -0.16 0.11 0.09 0.00 0.00 178.44 178.33 1x81 h LYS 228 N 0.00 0.07 -0.28 1.13 1.57 -0.59 -1.99 116.57 116.47 1x81 h LYS 228 Ca -0.00 -0.11 0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1x81 h LYS 228 Cb 0.08 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1x81 h LYS 228 CO 0.00 1.01 0.46 0.93 -0.57 0.00 0.00 179.45 181.28 1x81 h GLU 229 N -0.81 0.00 -0.03 3.15 5.08 -0.93 -3.36 114.58 117.67 1x81 h GLU 229 Ca -0.03 0.00 0.25 0.00 -1.00 0.00 0.00 59.36 58.58 1x81 h GLU 229 Cb 1.08 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.16 1x81 h GLU 229 CO 0.03 0.00 0.06 0.34 -1.00 0.00 0.00 179.01 178.44 1x81 s ASP 230 N -4.82 -0.05 0.35 1.42 -1.08 -0.89 -5.02 116.67 106.58 1x81 s ASP 230 Ca -0.04 -0.00 0.26 0.00 -0.52 0.00 0.00 52.55 52.25 1x81 s ASP 230 Cb 0.12 0.78 1.21 0.00 -1.46 0.00 0.00 42.92 43.57 1x81 s ASP 230 CO 0.43 -0.01 1.79 1.62 0.52 0.00 0.00 175.17 179.53 1x81 h VAL 231 N 3.80 0.00 -0.00 1.11 3.04 -1.52 -1.90 116.25 120.78 1x81 h VAL 231 Ca -0.10 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 65.39 1x81 h VAL 231 Cb 1.19 0.93 0.00 0.00 -2.01 0.00 0.00 31.29 31.40 1x81 h VAL 231 CO -0.16 0.00 -0.04 0.54 -1.01 0.00 0.00 177.57 176.91 1x81 n ARG 232 N -2.44 0.64 -1.88 4.17 1.74 -1.26 -4.74 116.66 112.88 1x81 n ARG 232 Ca 0.01 -0.09 -0.24 0.00 -0.77 0.00 0.00 57.85 56.75 1x81 n ARG 232 Cb 0.18 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.07 1x81 n ARG 232 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1x81 s ASN 233 N -2.42 4.75 0.60 0.55 3.84 -0.72 -4.79 114.94 116.75 1x81 s ASN 233 Ca 0.32 -0.31 0.39 0.00 0.21 0.00 0.00 52.86 53.48 1x81 s ASN 233 Cb 0.21 -2.55 2.12 0.00 -0.55 0.00 0.00 41.25 40.48 1x81 s ASN 233 CO 0.45 -3.06 2.19 -1.13 -2.79 0.00 0.00 177.10 172.76 1x81 h ASN 234 N 12.35 0.00 0.76 -4.21 -1.24 -1.90 -1.55 115.58 119.78 1x81 h ASN 234 Ca 0.03 0.00 -0.18 0.00 0.71 0.00 0.00 56.30 56.86 1x81 h ASN 234 Cb 1.03 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.06 1x81 h ASN 234 CO 1.15 0.00 -0.84 0.28 -1.29 0.00 0.00 177.43 176.73 1x81 h SER 235 N 0.00 0.07 1.35 1.15 0.02 -1.89 -3.07 113.55 111.18 1x81 h SER 235 Ca 0.00 -0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 60.82 1x81 h SER 235 Cb 0.07 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 1x81 h SER 235 CO 0.00 0.88 -0.35 0.58 -1.14 0.00 0.00 176.83 176.79 1x81 h VAL 236 N 0.03 0.67 0.00 2.27 2.07 -1.60 0.26 116.25 119.95 1x81 h VAL 236 Ca -0.02 -1.71 0.00 0.00 0.82 0.00 0.00 66.70 65.79 1x81 h VAL 236 Cb 1.47 2.15 0.00 0.00 -1.52 0.00 0.00 31.29 33.39 1x81 h VAL 236 CO 0.11 0.35 0.00 -0.50 0.02 0.00 0.00 177.57 177.55 1x81 h TRP 237 N 0.00 0.00 0.00 1.57 4.06 -1.51 -0.98 115.95 119.09 1x81 h TRP 237 Ca -0.00 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.93 1x81 h TRP 237 Cb 1.12 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.28 1x81 h TRP 237 CO 0.00 0.00 -0.32 -0.97 -3.56 0.00 0.00 178.44 173.59 1x81 h ASN 238 N 0.00 0.00 -1.16 -3.49 -1.24 -1.34 -3.19 115.58 105.17 1x81 h ASN 238 Ca 0.00 -0.11 0.36 0.00 0.71 0.00 0.00 56.30 57.26 1x81 h ASN 238 Cb 0.73 0.00 -0.12 0.00 0.73 0.00 0.00 38.32 39.66 1x81 h ASN 238 CO 0.00 0.72 0.73 -0.61 -1.29 0.00 0.00 177.43 176.98 1x81 h GLN 239 N -1.00 0.22 -0.35 6.67 5.75 -0.96 0.58 115.11 126.03 1x81 h GLN 239 Ca -0.03 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.44 1x81 h GLN 239 Cb 0.39 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 1x81 h GLN 239 CO -0.02 0.14 0.13 -0.09 -2.65 0.00 0.00 178.83 176.34 1x81 h ARG 240 N 0.22 0.53 0.00 1.69 2.43 -1.29 -1.51 114.38 116.45 1x81 h ARG 240 Ca 0.74 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.81 1x81 h ARG 240 Cb 2.06 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 31.53 1x81 h ARG 240 CO -0.44 0.53 0.00 1.25 -1.51 0.00 0.00 179.97 179.80 1x81 h HIS 241 N 0.41 0.00 -0.04 2.20 2.76 0.11 -1.69 115.15 118.90 1x81 h HIS 241 Ca 0.11 0.00 -0.19 0.00 -2.20 0.00 0.00 60.37 58.09 1x81 h HIS 241 Cb 0.21 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.18 1x81 h HIS 241 CO 0.00 0.00 -0.73 0.35 -1.30 0.00 0.00 177.93 176.25 1x81 h PHE 242 N 0.00 0.81 -0.06 5.26 3.57 -0.38 -2.52 116.94 123.61 1x81 h PHE 242 Ca 0.00 -0.41 -0.18 0.00 3.53 0.00 0.00 57.97 60.91 1x81 h PHE 242 Cb 0.45 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1x81 h PHE 242 CO 0.00 1.23 -0.73 0.28 -2.23 0.00 0.00 178.31 176.86 1x81 h VAL 243 N 0.16 1.40 0.05 1.41 2.07 -0.84 -3.28 116.25 117.22 1x81 h VAL 243 Ca -0.08 -2.19 -0.00 0.00 0.82 0.00 0.00 66.70 65.25 1x81 h VAL 243 Cb 1.40 2.15 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 1x81 h VAL 243 CO 0.15 0.65 -0.03 0.40 0.02 0.00 0.00 177.57 178.76 1x81 h ILE 244 N 0.23 0.66 0.00 4.57 2.04 -1.39 -2.80 117.51 120.82 1x81 h ILE 244 Ca -0.03 -1.39 0.00 0.00 1.00 0.00 0.00 64.86 64.44 1x81 h ILE 244 Cb 1.31 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.61 1x81 h ILE 244 CO 0.12 0.21 0.01 -1.54 0.00 0.00 0.00 178.15 176.95 1x81 n SER 245 N -4.78 0.09 -0.00 1.72 3.41 -0.95 -0.47 113.62 112.64 1x81 n SER 245 Ca -0.05 0.54 0.06 0.00 -0.26 0.00 0.00 58.87 59.16 1x81 n SER 245 Cb 0.20 -0.55 -0.07 0.00 -0.26 0.00 0.00 64.21 63.53 1x81 n SER 245 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1x81 n ASN 246 N -1.61 0.72 -0.09 4.04 4.13 -1.23 -3.83 115.26 117.38 1x81 n ASN 246 Ca -0.00 -0.73 -0.13 0.00 1.68 0.00 0.00 54.58 55.40 1x81 n ASN 246 Cb 0.01 1.05 -0.09 0.00 -1.54 0.00 0.00 39.78 39.22 1x81 n ASN 246 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1x81 n THR 247 N -1.36 1.07 -1.12 3.41 -2.24 -0.44 -4.84 114.28 108.76 1x81 n THR 247 Ca 0.02 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1x81 n THR 247 Cb 0.21 -1.15 0.00 0.00 -2.10 0.00 0.00 70.33 67.29 1x81 n THR 247 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1x81 n THR 248 N -3.03 0.00 -1.30 4.28 -2.24 -0.13 -5.09 114.28 106.77 1x81 n THR 248 Ca -0.33 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 61.63 1x81 n THR 248 Cb 0.85 1.69 -0.04 0.00 -2.10 0.00 0.00 70.33 70.73 1x81 n THR 248 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x81 n GLY 249 N 0.00 -1.69 0.21 3.38 0.00 0.38 -4.49 105.19 102.99 1x81 n GLY 249 Ca 0.00 -1.02 0.03 0.00 0.00 0.00 0.00 46.02 45.03 1x81 n GLY 249 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1x81 n TYR 250 N -3.86 0.00 0.02 1.61 4.01 -1.26 -4.53 117.16 113.14 1x81 n TYR 250 Ca 0.01 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.78 1x81 n TYR 250 Cb 0.65 0.00 0.41 0.00 -0.31 0.00 0.00 39.34 40.09 1x81 n TYR 250 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1x81 h SER 251 N 1.04 0.44 -1.79 7.72 0.87 -1.99 -3.37 113.55 116.48 1x81 h SER 251 Ca 0.00 -0.03 -0.61 0.00 -1.23 0.00 0.00 61.79 59.92 1x81 h SER 251 Cb 0.23 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1x81 h SER 251 CO 0.00 0.37 1.39 -0.67 -0.53 0.00 0.00 176.83 177.39 1x81 n ASP 252 N -4.43 3.08 -0.21 6.23 -0.08 -1.26 -4.88 116.55 115.01 1x81 n ASP 252 Ca 0.02 0.45 0.21 0.00 -1.51 0.00 0.00 54.79 53.96 1x81 n ASP 252 Cb 0.10 -1.45 0.57 0.00 2.34 0.00 0.00 41.12 42.69 1x81 n ASP 252 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 1x81 h ARG 253 N 13.02 0.28 -0.08 -0.67 2.47 -1.98 -1.58 114.38 125.83 1x81 h ARG 253 Ca -0.39 -0.02 -0.11 0.00 -1.26 0.00 0.00 59.98 58.20 1x81 h ARG 253 Cb 1.27 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 29.53 1x81 h ARG 253 CO 0.97 0.18 -0.37 0.00 0.56 0.00 0.00 179.97 181.31 1x81 h ALA 254 N 1.61 0.16 0.17 0.04 0.00 -1.93 -2.42 119.26 116.88 1x81 h ALA 254 Ca 0.44 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1x81 h ALA 254 Cb 1.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1x81 h ALA 254 CO -0.12 0.25 -0.08 0.28 0.00 0.00 0.00 179.25 179.57 1x81 h VAL 255 N -0.07 0.95 -0.45 0.00 2.07 -1.74 0.24 116.25 117.25 1x81 h VAL 255 Ca -0.02 -0.63 0.11 0.00 0.82 0.00 0.00 66.70 66.98 1x81 h VAL 255 Cb 1.02 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 1x81 h VAL 255 CO 0.08 0.14 0.32 0.25 0.02 0.00 0.00 177.57 178.38 1x81 h LEU 256 N -0.54 0.10 -0.06 2.57 6.46 -1.43 0.36 115.31 122.77 1x81 h LEU 256 Ca -0.02 0.00 -0.20 0.00 -0.12 0.00 0.00 57.88 57.54 1x81 h LEU 256 Cb 0.41 -0.02 0.01 0.00 -0.73 0.00 0.00 40.66 40.34 1x81 h LEU 256 CO 0.04 0.06 -0.74 -0.08 -0.62 0.00 0.00 178.44 177.10 1x81 h GLU 257 N 0.11 0.60 -0.46 1.25 4.81 -0.97 -2.52 114.58 117.39 1x81 h GLU 257 Ca 0.21 -0.57 0.03 0.00 -0.13 0.00 0.00 59.36 58.90 1x81 h GLU 257 Cb 0.70 0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.19 1x81 h GLU 257 CO -0.02 1.19 0.26 -0.09 -0.73 0.00 0.00 179.01 179.61 1x81 h ARG 258 N 0.22 0.50 -0.44 1.92 2.43 0.14 -2.54 114.38 116.61 1x81 h ARG 258 Ca -0.08 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.02 1x81 h ARG 258 Cb 1.40 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.82 1x81 h ARG 258 CO 0.15 0.33 0.12 0.93 -1.51 0.00 0.00 179.97 179.99 1x81 h GLU 259 N 0.52 0.69 -0.44 0.20 4.39 -1.12 -2.65 114.58 116.17 1x81 h GLU 259 Ca 0.19 -0.16 -0.05 0.00 0.34 0.00 0.00 59.36 59.69 1x81 h GLU 259 Cb 0.05 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 1x81 h GLU 259 CO -0.11 0.68 0.07 0.28 -1.16 0.00 0.00 179.01 178.78 1x81 h VAL 260 N 0.57 1.21 -0.17 3.13 2.07 -1.27 0.33 116.25 122.11 1x81 h VAL 260 Ca 0.14 -0.77 -0.05 0.00 0.82 0.00 0.00 66.70 66.83 1x81 h VAL 260 Cb 0.29 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1x81 h VAL 260 CO -0.00 0.28 -0.09 -0.61 0.02 0.00 0.00 177.57 177.16 1x81 h GLN 261 N 0.65 0.36 0.12 1.57 5.75 -1.39 0.18 115.11 122.35 1x81 h GLN 261 Ca 0.14 -0.16 -0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1x81 h GLN 261 Cb 0.30 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.84 1x81 h GLN 261 CO 0.00 0.68 -0.07 -0.92 -2.65 0.00 0.00 178.83 175.87 1x81 h TYR 262 N 0.03 -0.19 -0.41 3.99 5.03 -1.25 0.73 116.97 124.90 1x81 h TYR 262 Ca 0.04 -0.00 0.04 0.00 2.58 0.00 0.00 58.73 61.39 1x81 h TYR 262 Cb 0.58 0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.91 1x81 h TYR 262 CO 0.07 -0.12 0.28 1.15 -1.32 0.00 0.00 178.16 178.22 1x81 h THR 263 N -0.19 0.99 0.12 1.81 2.02 -0.28 0.14 112.91 117.52 1x81 h THR 263 Ca -0.01 -0.13 -0.21 0.00 0.77 0.00 0.00 66.41 66.83 1x81 h THR 263 Cb 0.16 0.58 0.02 0.00 -1.74 0.00 0.00 68.15 67.17 1x81 h THR 263 CO 0.01 0.07 -0.90 -0.07 0.37 0.00 0.00 175.52 175.00 1x81 h LEU 264 N 0.38 0.58 0.00 2.58 3.38 0.26 -2.18 115.31 120.32 1x81 h LEU 264 Ca 0.17 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.25 1x81 h LEU 264 Cb 0.22 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1x81 h LEU 264 CO -0.04 1.42 0.00 -0.62 0.09 0.00 0.00 178.44 179.29 1x81 n GLU 265 N -4.06 0.14 -0.03 1.13 -0.58 0.25 -1.96 120.64 115.54 1x81 n GLU 265 Ca -0.13 0.12 -0.12 0.00 -0.42 0.00 0.00 57.16 56.60 1x81 n GLU 265 Cb 0.84 -1.50 -0.14 0.00 -0.57 0.00 0.00 31.44 30.07 1x81 n GLU 265 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 1x81 n MET 266 N -1.40 0.67 0.31 3.49 1.56 0.44 -3.43 117.12 118.76 1x81 n MET 266 Ca 0.07 0.24 -0.15 0.00 -0.27 0.00 0.00 57.70 57.59 1x81 n MET 266 Cb 0.21 -1.73 -0.08 0.00 2.15 0.00 0.00 33.22 33.77 1x81 n MET 266 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 1x81 h ILE 267 N 0.02 0.30 -1.09 1.12 2.04 -0.74 -2.73 117.51 116.43 1x81 h ILE 267 Ca -0.37 -0.31 0.31 0.00 1.00 0.00 0.00 64.86 65.50 1x81 h ILE 267 Cb 2.05 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 38.47 1x81 h ILE 267 CO 0.07 0.04 0.78 0.11 0.00 0.00 0.00 178.15 179.14 1x81 h LYS 268 N -1.01 0.03 -0.02 2.37 1.57 -1.55 0.15 116.57 118.11 1x81 h LYS 268 Ca -0.08 -0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.63 1x81 h LYS 268 Cb 0.66 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1x81 h LYS 268 CO 0.13 0.02 -0.25 -0.07 -0.57 0.00 0.00 179.45 178.72 1x81 h LEU 269 N 0.04 0.26 -6.46 2.94 3.38 -1.55 -3.40 115.31 110.52 1x81 h LEU 269 Ca 0.53 -0.72 -0.59 0.00 0.09 0.00 0.00 57.88 57.19 1x81 h LEU 269 Cb 2.03 -0.08 -0.39 0.00 0.09 0.00 0.00 40.66 42.31 1x81 h LEU 269 CO -0.03 0.94 -0.88 0.52 0.09 0.00 0.00 178.44 179.08 1x81 n VAL 270 N -4.51 -0.23 -0.26 1.22 0.31 -0.35 -5.01 118.33 109.50 1x81 n VAL 270 Ca -0.09 -3.97 0.29 0.00 -0.01 0.00 0.00 64.34 60.56 1x81 n VAL 270 Cb 0.48 -1.85 0.68 0.00 -0.91 0.00 0.00 33.84 32.24 1x81 n VAL 270 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1x81 h PRO 271 N 5.21 0.10 -0.67 5.55 0.11 -0.99 -2.40 132.00 138.91 1x81 h PRO 271 Ca 0.21 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1x81 h PRO 271 Cb 0.85 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1x81 h PRO 271 CO 0.50 0.07 0.00 0.72 -0.21 0.00 0.00 178.00 179.07 1x81 n HIS 272 N -4.32 1.35 -2.76 0.65 8.25 -1.26 -4.88 115.22 112.25 1x81 n HIS 272 Ca 0.22 -0.56 -0.42 0.00 -0.26 0.00 0.00 57.72 56.70 1x81 n HIS 272 Cb 1.04 -0.19 -0.03 0.00 1.12 0.00 0.00 29.99 31.92 1x81 n HIS 272 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1x81 s ASN 273 N -0.90 6.91 0.00 0.41 2.47 -0.91 -4.94 114.94 117.99 1x81 s ASN 273 Ca 0.49 1.08 0.30 0.00 0.42 0.00 0.00 52.86 55.15 1x81 s ASN 273 Cb 0.31 -2.49 1.39 0.00 -1.45 0.00 0.00 41.25 39.00 1x81 s ASN 273 CO 0.26 -0.67 1.99 1.21 -3.72 0.00 0.00 177.10 176.17 1x81 n GLU 274 N 6.36 0.25 0.21 0.43 2.13 -1.26 -4.07 120.64 124.68 1x81 n GLU 274 Ca 0.09 -0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.81 1x81 n GLU 274 Cb 0.47 -1.50 -0.04 0.00 0.27 0.00 0.00 31.44 30.64 1x81 n GLU 274 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 1x81 h SER 275 N 0.01 -0.51 0.00 4.31 0.02 -1.90 -2.71 113.55 112.77 1x81 h SER 275 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1x81 h SER 275 Cb 0.38 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1x81 h SER 275 CO 0.00 -0.12 0.03 0.00 -1.14 0.00 0.00 176.83 175.60 1x81 n ALA 276 N -2.68 1.10 -0.13 3.77 0.00 -1.26 -1.72 120.51 119.60 1x81 n ALA 276 Ca -0.07 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.09 1x81 n ALA 276 Cb 0.24 -0.81 -0.09 0.00 0.00 0.00 0.00 19.45 18.78 1x81 n ALA 276 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1x81 n TRP 277 N -1.04 0.00 0.28 0.00 7.02 -1.19 -3.71 117.44 118.80 1x81 n TRP 277 Ca 0.00 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.61 1x81 n TRP 277 Cb 0.03 -0.94 0.81 0.00 -2.42 0.00 0.00 31.31 28.79 1x81 n TRP 277 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 1x81 h ASN 278 N -0.89 0.00 -0.00 -0.99 4.21 -1.00 -0.23 115.58 116.68 1x81 h ASN 278 Ca -0.66 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 56.84 1x81 h ASN 278 Cb 1.60 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.80 1x81 h ASN 278 CO -0.39 0.02 -0.04 0.22 -1.29 0.00 0.00 177.43 175.96 1x81 h TYR 279 N 0.00 0.04 0.00 1.19 3.20 -1.61 -0.79 116.97 118.99 1x81 h TYR 279 Ca -0.00 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1x81 h TYR 279 Cb 0.05 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.31 1x81 h TYR 279 CO 0.00 0.78 0.00 -0.11 -1.64 0.00 0.00 178.16 177.19 1x81 n LEU 280 N -4.69 0.00 -0.01 2.82 7.94 -0.94 -2.03 117.00 120.09 1x81 n LEU 280 Ca -0.09 0.49 0.09 0.00 -1.11 0.00 0.00 56.01 55.39 1x81 n LEU 280 Cb 0.39 -0.49 -0.14 0.00 0.53 0.00 0.00 43.42 43.71 1x81 n LEU 280 CO 0.35 -0.24 -0.58 1.17 -1.11 0.00 0.00 177.39 176.98 1x81 n LYS 281 N -1.49 0.65 -0.01 1.96 4.81 -0.14 -4.27 118.16 119.66 1x81 n LYS 281 Ca 0.04 -0.14 0.10 0.00 -0.87 0.00 0.00 58.31 57.44 1x81 n LYS 281 Cb 0.17 -1.44 -0.16 0.00 0.02 0.00 0.00 35.03 33.63 1x81 n LYS 281 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x81 n GLY 282 N 1.42 -0.94 0.04 3.14 0.00 -0.31 -2.83 105.19 105.71 1x81 n GLY 282 Ca -0.02 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.61 1x81 n GLY 282 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1x81 n ILE 283 N -2.14 0.21 -0.09 -0.61 -5.35 -0.86 -4.18 119.36 106.34 1x81 n ILE 283 Ca -0.03 -0.27 -0.14 0.00 -0.27 0.00 0.00 62.75 62.04 1x81 n ILE 283 Cb 0.51 0.13 -0.14 0.00 -1.74 0.00 0.00 39.64 38.40 1x81 n ILE 283 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1x81 n LEU 284 N -2.03 1.41 0.00 7.28 4.77 -1.26 -4.21 117.00 122.96 1x81 n LEU 284 Ca 0.02 0.01 0.03 0.00 -0.03 0.00 0.00 56.01 56.04 1x81 n LEU 284 Cb 0.45 -0.19 0.16 0.00 -2.33 0.00 0.00 43.42 41.51 1x81 n LEU 284 CO 0.40 0.68 0.38 0.00 -1.33 0.00 0.00 177.39 177.52 1x81 n GLN 285 N -3.03 0.45 0.00 3.23 10.64 -1.13 -2.92 117.38 124.62 1x81 n GLN 285 Ca -0.36 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.81 1x81 n GLN 285 Cb 1.08 -1.19 0.00 0.00 -0.86 0.00 0.00 30.24 29.27 1x81 n GLN 285 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1x81 n ASP 286 N -0.69 0.00 0.20 2.61 8.00 -1.26 -3.96 116.55 121.44 1x81 n ASP 286 Ca 0.04 0.67 0.14 0.00 0.71 0.00 0.00 54.79 56.35 1x81 n ASP 286 Cb 0.02 -0.42 0.45 0.00 -0.02 0.00 0.00 41.12 41.15 1x81 n ASP 286 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1x81 h ARG 287 N 0.00 0.00 0.00 -1.24 -0.00 -1.84 -3.47 114.38 107.83 1x81 h ARG 287 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1x81 h ARG 287 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.97 1x81 h ARG 287 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.97 180.38 1x81 n GLY 288 N 0.57 3.43 0.25 0.04 0.00 -1.15 -4.80 105.19 103.54 1x81 n GLY 288 Ca 0.03 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.39 1x81 n GLY 288 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1x81 h LEU 289 N 0.00 0.00 -0.91 0.99 5.85 -1.80 -0.75 115.31 118.69 1x81 h LEU 289 Ca 0.00 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 1x81 h LEU 289 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1x81 h LEU 289 CO 0.00 0.07 -0.47 -1.28 -0.34 0.00 0.00 178.44 176.43 1x81 h SER 290 N 0.00 0.18 0.11 1.25 0.87 -1.86 -3.21 113.55 110.89 1x81 h SER 290 Ca -0.00 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1x81 h SER 290 Cb 0.14 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1x81 h SER 290 CO 0.01 0.63 0.00 0.54 -0.53 0.00 0.00 176.83 177.48 1x81 n ARG 291 N -3.98 0.16 -3.95 2.24 1.74 -0.29 -4.30 116.66 108.28 1x81 n ARG 291 Ca -0.02 0.15 -0.31 0.00 -0.77 0.00 0.00 57.85 56.90 1x81 n ARG 291 Cb 0.51 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.31 1x81 n ARG 291 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1x81 s TYR 292 N -2.40 3.38 0.00 -1.55 1.51 -1.21 -5.01 117.35 112.06 1x81 s TYR 292 Ca 0.09 -3.08 0.00 0.00 -1.01 0.00 0.00 57.07 53.07 1x81 s TYR 292 Cb 0.05 -2.89 0.00 0.00 -0.11 0.00 0.00 41.96 39.02 1x81 s TYR 292 CO 0.11 -0.81 0.71 -0.35 -1.11 0.00 0.00 175.55 174.09 1x81 n PRO 293 N 3.50 0.00 0.22 -1.71 -0.04 -1.26 -2.70 135.00 133.01 1x81 n PRO 293 Ca 0.05 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.91 1x81 n PRO 293 Cb 0.36 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 1x81 n PRO 293 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1x81 n ASN 294 N -1.39 0.00 0.23 3.54 4.13 -1.26 -1.35 115.26 119.17 1x81 n ASN 294 Ca 0.00 0.34 -0.10 0.00 1.68 0.00 0.00 54.58 56.50 1x81 n ASN 294 Cb 0.00 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.19 1x81 n ASN 294 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 1x81 h LEU 295 N 0.00 -0.55 -0.55 3.41 5.85 -1.92 -3.11 115.31 118.44 1x81 h LEU 295 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1x81 h LEU 295 Cb 1.37 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.55 1x81 h LEU 295 CO 0.00 -0.14 0.72 0.25 -0.34 0.00 0.00 178.44 178.93 1x81 h LEU 296 N -1.17 0.00 0.00 2.25 5.85 -1.37 -2.12 115.31 118.76 1x81 h LEU 296 Ca -0.07 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1x81 h LEU 296 Cb 0.50 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.53 1x81 h LEU 296 CO 0.11 0.00 -0.67 0.59 -0.34 0.00 0.00 178.44 178.13 1x81 n ASN 297 N -2.38 1.84 -0.32 1.25 3.02 -1.22 -3.93 115.26 113.51 1x81 n ASN 297 Ca -0.01 0.56 0.19 0.00 -0.03 0.00 0.00 54.58 55.30 1x81 n ASN 297 Cb 0.73 -0.85 0.38 0.00 -0.61 0.00 0.00 39.78 39.44 1x81 n ASN 297 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1x81 h GLN 298 N -1.00 0.19 -0.36 3.52 4.20 -1.32 1.24 115.11 121.57 1x81 h GLN 298 Ca -0.02 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1x81 h GLN 298 Cb 0.66 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1x81 h GLN 298 CO -0.01 0.13 0.07 -0.07 -0.67 0.00 0.00 178.83 178.27 1x81 h LEU 299 N 0.20 0.49 0.00 1.46 3.38 -1.69 0.22 115.31 119.37 1x81 h LEU 299 Ca 0.65 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.55 1x81 h LEU 299 Cb 1.44 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1x81 h LEU 299 CO -0.69 0.51 0.00 0.18 0.09 0.00 0.00 178.44 178.54 1x81 n LEU 300 N -4.32 0.00 -0.10 1.67 4.77 0.42 -2.11 117.00 117.32 1x81 n LEU 300 Ca 0.02 0.43 -0.20 0.00 -0.03 0.00 0.00 56.01 56.22 1x81 n LEU 300 Cb 0.20 -0.43 -0.11 0.00 -2.33 0.00 0.00 43.42 40.76 1x81 n LEU 300 CO 0.38 -0.10 -0.46 0.44 -1.33 0.00 0.00 177.39 176.31 1x81 h ASP 301 N 0.00 0.00 -0.14 -1.43 5.19 0.51 -3.33 116.42 117.22 1x81 h ASP 301 Ca 0.00 -0.49 0.04 0.00 -0.62 0.00 0.00 57.03 55.96 1x81 h ASP 301 Cb 0.32 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.83 1x81 h ASP 301 CO 0.00 1.41 0.14 -0.07 -3.12 0.00 0.00 179.24 177.60 1x81 h LEU 302 N -1.00 0.00 -0.11 1.55 3.38 -1.10 -3.34 115.31 114.69 1x81 h LEU 302 Ca -0.31 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.69 1x81 h LEU 302 Cb 1.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 1x81 h LEU 302 CO -0.19 0.00 -0.02 1.67 0.09 0.00 0.00 178.44 180.00 1x81 n GLN 303 N -3.97 -0.01 0.00 1.13 -0.06 -0.90 -1.16 117.38 112.41 1x81 n GLN 303 Ca 0.00 0.17 0.00 0.00 -2.00 0.00 0.00 57.00 55.18 1x81 n GLN 303 Cb 0.25 -0.26 0.00 0.00 -4.06 0.00 0.00 30.24 26.17 1x81 n GLN 303 CO 0.00 0.00 0.00 -2.30 -0.20 0.00 0.00 177.06 174.56 1x81 n PRO 304 N -4.06 0.00 0.00 3.69 -0.02 -1.26 -2.96 135.00 130.40 1x81 n PRO 304 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1x81 n PRO 304 Cb 0.07 -0.35 0.00 0.00 -0.02 0.00 0.00 33.50 33.20 1x81 n PRO 304 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1x81 n SER 305 N -0.23 0.07 -0.07 2.55 3.41 -1.20 -2.24 113.62 115.92 1x81 n SER 305 Ca 0.00 -0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.19 1x81 n SER 305 Cb 0.00 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1x81 n SER 305 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1x81 n HIS 306 N -0.21 0.00 -0.54 7.33 8.25 -0.31 -5.05 115.22 124.69 1x81 n HIS 306 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.17 1x81 n HIS 306 Cb 0.02 0.05 0.24 0.00 1.12 0.00 0.00 29.99 31.42 1x81 n HIS 306 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1x81 s SER 307 N -0.09 1.18 0.00 0.41 0.15 -0.95 -4.82 113.70 109.58 1x81 s SER 307 Ca 0.00 1.65 0.00 0.00 0.70 0.00 0.00 55.95 58.30 1x81 s SER 307 Cb 0.00 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 61.94 1x81 s SER 307 CO 0.00 -4.10 0.00 -1.54 1.20 0.00 0.00 173.24 168.80 1x81 n SER 308 N -4.86 0.00 0.00 5.45 3.41 -1.26 -4.87 113.62 111.48 1x81 n SER 308 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1x81 n SER 308 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1x81 n SER 308 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1x81 n PRO 309 N -0.92 0.00 0.11 4.33 -0.04 -1.26 -0.14 135.00 137.08 1x81 n PRO 309 Ca 0.00 0.10 0.12 0.00 -0.04 0.00 0.00 63.50 63.68 1x81 n PRO 309 Cb 0.00 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.15 1x81 n PRO 309 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1x81 h TYR 310 N 0.00 0.00 0.00 0.54 0.05 -1.92 -0.27 116.97 115.36 1x81 h TYR 310 Ca 0.00 0.00 -0.21 0.00 0.05 0.00 0.00 58.73 58.57 1x81 h TYR 310 Cb 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.71 1x81 h TYR 310 CO 0.00 0.00 -1.53 -0.11 -1.05 0.00 0.00 178.16 175.47 1x81 n LEU 311 N -2.44 1.91 0.04 3.88 0.00 0.80 -3.50 117.00 117.69 1x81 n LEU 311 Ca 0.03 0.40 0.11 0.00 0.00 0.00 0.00 56.01 56.55 1x81 n LEU 311 Cb 0.48 -0.83 0.56 0.00 0.00 0.00 0.00 43.42 43.62 1x81 n LEU 311 CO 0.35 0.10 1.15 0.40 0.00 0.00 0.00 177.39 179.39 1x81 h ILE 312 N -1.00 0.94 -0.03 1.96 1.08 -1.55 -0.76 117.51 118.14 1x81 h ILE 312 Ca -0.32 -0.09 -0.04 0.00 -0.39 0.00 0.00 64.86 64.02 1x81 h ILE 312 Cb 1.20 0.66 0.00 0.00 -3.07 0.00 0.00 36.82 35.61 1x81 h ILE 312 CO -0.19 0.05 -0.15 0.00 -0.69 0.00 0.00 178.15 177.17 1x81 h ALA 313 N 1.79 0.05 -0.51 1.87 0.00 -1.24 -3.04 119.26 118.19 1x81 h ALA 313 Ca 0.17 -0.39 0.10 0.00 0.00 0.00 0.00 54.91 54.80 1x81 h ALA 313 Cb 0.36 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.06 1x81 h ALA 313 CO -0.03 -0.01 -0.08 0.35 0.00 0.00 0.00 179.25 179.48 1x81 h PHE 314 N -0.46 -0.17 -0.85 0.00 3.04 -1.23 0.30 116.94 117.57 1x81 h PHE 314 Ca -0.01 0.04 0.03 0.00 3.98 0.00 0.00 57.97 62.01 1x81 h PHE 314 Cb 0.82 0.16 -0.05 0.00 2.56 0.00 0.00 35.95 39.44 1x81 h PHE 314 CO 0.15 -0.18 0.56 -0.07 -2.02 0.00 0.00 178.31 176.75 1x81 h LEU 315 N 0.04 0.92 -0.43 0.59 3.38 -1.27 0.13 115.31 118.67 1x81 h LEU 315 Ca 0.25 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 1x81 h LEU 315 Cb 0.39 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1x81 h LEU 315 CO -0.49 0.63 0.19 0.58 0.09 0.00 0.00 178.44 179.44 1x81 h VAL 316 N 1.06 1.19 -0.87 1.22 2.07 -0.87 0.49 116.25 120.55 1x81 h VAL 316 Ca 0.33 -0.57 0.07 0.00 0.82 0.00 0.00 66.70 67.35 1x81 h VAL 316 Cb 0.01 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 30.49 1x81 h VAL 316 CO -0.10 0.21 0.54 0.44 0.02 0.00 0.00 177.57 178.68 1x81 h ASP 317 N 0.55 0.83 0.26 0.57 3.32 0.25 -1.31 116.42 120.90 1x81 h ASP 317 Ca 0.14 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1x81 h ASP 317 Cb 0.16 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1x81 h ASP 317 CO -0.01 0.53 -0.13 0.40 -1.72 0.00 0.00 179.24 178.30 1x81 h ILE 318 N 0.97 0.78 -0.74 0.35 2.04 -0.10 -2.85 117.51 117.97 1x81 h ILE 318 Ca 0.38 -0.37 0.14 0.00 1.00 0.00 0.00 64.86 66.02 1x81 h ILE 318 Cb 0.20 0.99 -0.10 0.00 -0.74 0.00 0.00 36.82 37.18 1x81 h ILE 318 CO -0.18 0.08 0.27 1.88 0.00 0.00 0.00 178.15 180.20 1x81 h TYR 319 N -0.55 0.46 -0.58 1.37 0.05 -0.41 -1.40 116.97 115.91 1x81 h TYR 319 Ca -0.04 0.04 0.07 0.00 0.05 0.00 0.00 58.73 58.85 1x81 h TYR 319 Cb 0.40 -0.09 -0.06 0.00 1.01 0.00 0.00 36.73 37.99 1x81 h TYR 319 CO -0.01 0.04 0.27 1.49 -1.05 0.00 0.00 178.16 178.90 1x81 h GLU 320 N 0.41 0.48 -0.32 4.88 4.81 -1.16 -1.47 114.58 122.21 1x81 h GLU 320 Ca 0.41 -0.03 -0.18 0.00 -0.13 0.00 0.00 59.36 59.43 1x81 h GLU 320 Cb 0.63 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.90 1x81 h GLU 320 CO -0.42 0.32 -0.49 0.22 -0.73 0.00 0.00 179.01 177.92 1x81 h ASP 321 N 0.50 0.99 -0.19 1.04 -0.00 -1.10 -2.43 116.42 115.22 1x81 h ASP 321 Ca 0.27 -0.51 0.05 0.00 -0.00 0.00 0.00 57.03 56.85 1x81 h ASP 321 Cb 0.24 -0.28 -0.06 0.00 -0.00 0.00 0.00 39.33 39.23 1x81 h ASP 321 CO -0.22 1.30 -0.21 0.24 -0.00 0.00 0.00 179.24 180.35 1x81 h MET 322 N 0.70 -0.23 -0.80 0.28 2.86 -0.66 0.22 114.93 117.29 1x81 h MET 322 Ca 0.03 0.02 0.07 0.00 -2.06 0.00 0.00 59.70 57.76 1x81 h MET 322 Cb 1.09 0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.75 1x81 h MET 322 CO 0.11 -0.15 0.53 -0.07 1.06 0.00 0.00 176.91 178.38 1x81 h LEU 323 N -0.24 0.74 -1.81 1.22 3.38 -1.29 -0.13 115.31 117.19 1x81 h LEU 323 Ca 0.12 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1x81 h LEU 323 Cb 0.42 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1x81 h LEU 323 CO -0.33 0.47 -0.13 -0.33 0.09 0.00 0.00 178.44 178.21 1x81 h GLU 324 N 0.84 0.00 -0.83 1.13 4.39 -0.12 -2.41 114.58 117.57 1x81 h GLU 324 Ca 0.35 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.49 1x81 h GLU 324 Cb 0.30 0.00 -0.32 0.00 -0.10 0.00 0.00 28.75 28.63 1x81 h GLU 324 CO -0.13 0.13 0.12 0.09 -1.16 0.00 0.00 179.01 178.06 1x81 n ASN 325 N -3.59 5.79 -2.95 1.42 5.03 -0.07 -4.97 115.26 115.92 1x81 n ASN 325 Ca -0.02 -3.77 -0.15 0.00 0.87 0.00 0.00 54.58 51.52 1x81 n ASN 325 Cb 0.26 -0.69 0.01 0.00 -1.02 0.00 0.00 39.78 38.33 1x81 n ASN 325 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1x81 n GLN 326 N -0.88 -0.86 -1.05 3.52 1.13 -0.91 -4.97 117.38 113.36 1x81 n GLN 326 Ca 0.52 0.48 -0.11 0.00 -1.94 0.00 0.00 57.00 55.95 1x81 n GLN 326 Cb 0.88 -1.12 0.07 0.00 0.11 0.00 0.00 30.24 30.18 1x81 n GLN 326 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1x81 s ASP 328 N -2.85 6.14 -1.64 0.00 1.01 -1.26 -4.21 116.67 113.87 1x81 s ASP 328 Ca 0.29 0.11 0.00 0.00 0.71 0.00 0.00 52.55 53.66 1x81 s ASP 328 Cb -0.01 -1.66 0.00 0.00 1.01 0.00 0.00 42.92 42.26 1x81 s ASP 328 CO 0.20 -0.32 0.00 0.59 0.21 0.00 0.00 175.17 175.85 1x81 n ASN 329 N -1.66 -5.02 0.00 0.27 3.02 -1.26 -4.77 115.26 105.85 1x81 n ASN 329 Ca -0.04 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 1x81 n ASN 329 Cb 0.57 -4.06 0.00 0.00 -0.61 0.00 0.00 39.78 35.69 1x81 n ASN 329 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1x81 n LYS 330 N -2.56 0.00 -0.26 3.52 4.81 -1.26 0.89 118.16 123.30 1x81 n LYS 330 Ca -0.18 0.25 0.03 0.00 -0.87 0.00 0.00 58.31 57.54 1x81 n LYS 330 Cb 0.60 -0.40 0.16 0.00 0.02 0.00 0.00 35.03 35.42 1x81 n LYS 330 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1x81 h GLU 331 N 0.00 0.53 -0.81 1.64 3.07 -1.90 0.35 114.58 117.46 1x81 h GLU 331 Ca 0.00 -0.03 0.10 0.00 -0.50 0.00 0.00 59.36 58.93 1x81 h GLU 331 Cb 0.00 -0.12 -0.08 0.00 -0.84 0.00 0.00 28.75 27.71 1x81 h GLU 331 CO 0.00 0.35 0.45 0.22 -1.40 0.00 0.00 179.01 178.63 1x81 h ASP 332 N 0.55 0.63 -0.07 1.42 3.58 0.15 -1.71 116.42 120.96 1x81 h ASP 332 Ca 0.39 0.06 -0.22 0.00 0.42 0.00 0.00 57.03 57.67 1x81 h ASP 332 Cb 0.49 -0.06 0.01 0.00 1.72 0.00 0.00 39.33 41.50 1x81 h ASP 332 CO -0.33 0.35 -0.82 0.40 -2.88 0.00 0.00 179.24 175.96 1x81 h ILE 333 N 0.74 1.31 0.00 2.25 1.08 -0.03 -2.28 117.51 120.58 1x81 h ILE 333 Ca 0.40 -2.07 0.00 0.00 -0.39 0.00 0.00 64.86 62.80 1x81 h ILE 333 Cb 0.40 2.25 0.00 0.00 -3.07 0.00 0.00 36.82 36.41 1x81 h ILE 333 CO -0.27 0.64 0.05 -0.11 -0.69 0.00 0.00 178.15 177.77 1x81 n LEU 334 N -3.99 0.00 -0.09 1.44 7.94 0.02 -0.63 117.00 121.70 1x81 n LEU 334 Ca -0.09 0.39 -0.12 0.00 -1.11 0.00 0.00 56.01 55.08 1x81 n LEU 334 Cb 0.77 -0.39 -0.09 0.00 0.53 0.00 0.00 43.42 44.24 1x81 n LEU 334 CO 0.52 -0.39 -1.08 0.59 -1.11 0.00 0.00 177.39 175.92 1x81 n ASN 335 N -1.39 2.32 0.27 1.96 3.02 -0.85 -3.56 115.26 117.04 1x81 n ASN 335 Ca 0.00 -0.08 0.17 0.00 -0.03 0.00 0.00 54.58 54.64 1x81 n ASN 335 Cb 0.05 -0.05 0.89 0.00 -0.61 0.00 0.00 39.78 40.05 1x81 n ASN 335 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1x81 h LYS 336 N 0.00 0.00 0.00 3.52 1.57 -0.28 0.11 116.57 121.50 1x81 h LYS 336 Ca -0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1x81 h LYS 336 Cb 1.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.00 1x81 h LYS 336 CO -0.05 0.00 -0.50 0.00 -0.57 0.00 0.00 179.45 178.33 1x81 n ALA 337 N -1.91 0.44 0.29 3.86 0.00 -0.64 -3.54 120.51 119.02 1x81 n ALA 337 Ca -0.02 -0.41 0.18 0.00 0.00 0.00 0.00 53.44 53.19 1x81 n ALA 337 Cb 0.14 0.02 0.98 0.00 0.00 0.00 0.00 19.45 20.59 1x81 n ALA 337 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1x81 h LEU 338 N -0.99 0.00 -0.07 0.00 3.38 -1.53 0.54 115.31 116.63 1x81 h LEU 338 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1x81 h LEU 338 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1x81 h LEU 338 CO 0.00 0.00 -0.24 -0.08 0.09 0.00 0.00 178.44 178.21 1x81 h GLU 339 N 0.00 0.29 0.00 1.13 4.81 -0.96 -3.09 114.58 116.76 1x81 h GLU 339 Ca 0.02 -0.22 -0.07 0.00 -0.13 0.00 0.00 59.36 58.97 1x81 h GLU 339 Cb 0.23 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1x81 h GLU 339 CO -0.00 0.84 -0.35 -0.07 -0.73 0.00 0.00 179.01 178.70 1x81 h LEU 340 N -0.20 0.00 -1.22 1.64 3.38 -0.83 -2.61 115.31 115.48 1x81 h LEU 340 Ca -0.01 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1x81 h LEU 340 Cb 0.86 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 1x81 h LEU 340 CO 0.05 0.35 -0.15 0.00 0.09 0.00 0.00 178.44 178.78 1x81 h GLU 342 N 0.33 0.35 -0.69 0.00 4.39 -1.39 0.08 114.58 117.64 1x81 h GLU 342 Ca 0.06 -0.59 0.18 0.00 0.34 0.00 0.00 59.36 59.35 1x81 h GLU 342 Cb 0.47 0.22 -0.04 0.00 -0.10 0.00 0.00 28.75 29.30 1x81 h GLU 342 CO 0.03 1.28 0.48 0.82 -1.16 0.00 0.00 179.01 180.46 1x81 h ILE 343 N -0.26 0.71 0.00 3.13 2.04 -1.50 0.32 117.51 121.96 1x81 h ILE 343 Ca -0.18 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1x81 h ILE 343 Cb 1.77 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 1x81 h ILE 343 CO 0.17 0.03 -0.09 -0.07 0.00 0.00 0.00 178.15 178.19 1x81 h LEU 344 N 0.15 0.00 -1.56 1.44 3.38 -1.59 0.85 115.31 117.98 1x81 h LEU 344 Ca 0.34 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.42 1x81 h LEU 344 Cb 1.11 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.82 1x81 h LEU 344 CO -0.05 0.39 0.46 0.00 0.09 0.00 0.00 178.44 179.33 1x81 h ALA 345 N -1.30 2.00 -0.00 1.53 0.00 -0.82 0.10 119.26 120.77 1x81 h ALA 345 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1x81 h ALA 345 Cb 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1x81 h ALA 345 CO 0.00 -0.16 -0.76 1.63 0.00 0.00 0.00 179.25 179.96 1x81 n LYS 346 N -4.48 1.00 0.07 0.00 5.02 0.11 -4.38 118.16 115.51 1x81 n LYS 346 Ca 0.12 -0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.18 1x81 n LYS 346 Cb 0.42 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 1x81 n LYS 346 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1x81 n GLU 347 N -1.10 0.00 0.05 1.97 0.00 -0.70 -4.91 120.64 115.95 1x81 n GLU 347 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.34 1x81 n GLU 347 Cb 0.32 0.00 0.46 0.00 0.00 0.00 0.00 31.44 32.22 1x81 n GLU 347 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1x81 n LYS 348 N -2.86 0.14 -2.75 5.31 4.76 0.29 -4.41 118.16 118.64 1x81 n LYS 348 Ca 0.00 0.10 -0.09 0.00 -2.87 0.00 0.00 58.31 55.45 1x81 n LYS 348 Cb 0.00 -1.65 0.06 0.00 -1.84 0.00 0.00 35.03 31.61 1x81 n LYS 348 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1x81 n ASP 349 N -1.88 -2.60 -0.13 4.39 2.03 0.33 -4.63 116.55 114.06 1x81 n ASP 349 Ca 0.06 -3.46 -0.11 0.00 0.52 0.00 0.00 54.79 51.79 1x81 n ASP 349 Cb 0.39 1.82 0.01 0.00 -0.72 0.00 0.00 41.12 42.62 1x81 n ASP 349 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1x81 h THR 350 N 2.97 1.27 -0.89 5.18 2.02 -1.74 -3.01 112.91 118.71 1x81 h THR 350 Ca -0.12 -1.45 0.26 0.00 0.77 0.00 0.00 66.41 65.86 1x81 h THR 350 Cb 1.06 1.25 -0.04 0.00 -1.74 0.00 0.00 68.15 68.68 1x81 h THR 350 CO 0.25 0.49 0.65 -0.29 0.37 0.00 0.00 175.52 177.00 1x81 h ILE 351 N 0.79 0.53 -0.63 3.11 6.09 -1.90 0.52 117.51 126.01 1x81 h ILE 351 Ca 0.09 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.58 1x81 h ILE 351 Cb 0.86 0.54 0.00 0.00 0.47 0.00 0.00 36.82 38.70 1x81 h ILE 351 CO 0.08 0.00 0.00 -1.14 -3.07 0.00 0.00 178.15 174.02 1x81 n ARG 352 N -4.22 4.09 -0.13 2.19 0.63 -1.14 -4.67 116.66 113.41 1x81 n ARG 352 Ca 0.18 -2.96 -0.05 0.00 -0.92 0.00 0.00 57.85 54.10 1x81 n ARG 352 Cb 0.97 -2.01 0.01 0.00 0.45 0.00 0.00 32.46 31.88 1x81 n ARG 352 CO 0.00 0.00 0.00 1.57 -2.51 0.00 0.00 177.63 176.69 1x81 h LYS 353 N 4.10 -0.12 -0.49 -0.14 2.10 0.01 -0.24 116.57 121.79 1x81 h LYS 353 Ca 0.00 0.01 0.14 0.00 -2.00 0.00 0.00 60.65 58.80 1x81 h LYS 353 Cb 1.61 0.03 -0.02 0.00 -0.90 0.00 0.00 32.23 32.95 1x81 h LYS 353 CO 0.31 -0.08 0.43 1.49 -2.00 0.00 0.00 179.45 179.60 1x81 h GLU 354 N -0.13 0.00 0.07 0.07 4.57 -1.83 -2.37 114.58 114.96 1x81 h GLU 354 Ca 0.20 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.18 1x81 h GLU 354 Cb 0.45 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 1x81 h GLU 354 CO -0.51 0.00 -1.06 -0.92 -1.18 0.00 0.00 179.01 175.34 1x81 h TYR 355 N 0.00 0.26 0.00 0.92 3.20 -1.44 -3.25 116.97 116.66 1x81 h TYR 355 Ca 0.23 -0.19 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1x81 h TYR 355 Cb 1.08 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.34 1x81 h TYR 355 CO 0.00 1.42 0.00 0.91 -1.64 0.00 0.00 178.16 178.85 1x81 n TRP 356 N -4.19 0.00 -0.07 -3.82 5.03 -0.61 -1.07 117.44 112.72 1x81 n TRP 356 Ca -0.23 0.00 -0.16 0.00 3.03 0.00 0.00 57.50 60.14 1x81 n TRP 356 Cb 0.76 -0.27 -0.14 0.00 -1.03 0.00 0.00 31.31 30.64 1x81 n TRP 356 CO 0.00 0.00 0.00 0.54 -0.03 0.00 0.00 177.69 178.20 1x81 n ARG 357 N -1.27 0.69 -0.17 -0.99 5.12 -0.93 -2.99 116.66 116.11 1x81 n ARG 357 Ca 0.04 0.18 -0.08 0.00 -1.93 0.00 0.00 57.85 56.07 1x81 n ARG 357 Cb 0.07 -1.62 0.01 0.00 -1.16 0.00 0.00 32.46 29.76 1x81 n ARG 357 CO 0.00 0.00 0.00 -0.92 -1.93 0.00 0.00 177.63 174.78 1x81 h TYR 358 N 0.02 0.70 0.21 -1.55 3.20 -1.13 0.33 116.97 118.75 1x81 h TYR 358 Ca -0.48 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.38 1x81 h TYR 358 Cb 2.02 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 40.04 1x81 h TYR 358 CO 0.04 0.53 -0.29 0.82 -1.64 0.00 0.00 178.16 177.61 1x81 h ILE 359 N 0.66 0.37 0.15 1.81 1.08 -1.47 0.76 117.51 120.87 1x81 h ILE 359 Ca 0.17 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.65 1x81 h ILE 359 Cb 0.08 0.37 -0.05 0.00 -3.07 0.00 0.00 36.82 34.16 1x81 h ILE 359 CO -0.03 0.00 -0.53 1.23 -0.69 0.00 0.00 178.15 178.13 1x81 h GLY 360 N -0.56 -1.17 0.92 5.37 0.00 -1.30 -0.19 103.07 106.14 1x81 h GLY 360 Ca 0.01 0.64 0.03 0.00 0.00 0.00 0.00 47.33 48.01 1x81 h GLY 360 CO -0.12 -0.27 0.62 3.21 0.00 0.00 0.00 176.54 179.98 1x81 h ARG 361 N -0.78 1.18 -0.65 4.80 3.08 -0.17 -1.98 114.38 119.86 1x81 h ARG 361 Ca -0.01 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.02 1x81 h ARG 361 Cb 0.77 -0.27 -0.05 0.00 0.08 0.00 0.00 29.97 30.51 1x81 h ARG 361 CO -0.27 0.78 0.38 1.03 -1.07 0.00 0.00 179.97 180.82 1x81 h SER 362 N 1.22 0.58 -0.01 7.04 0.87 0.11 -0.43 113.55 122.92 1x81 h SER 362 Ca 0.36 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.94 1x81 h SER 362 Cb -0.05 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 61.81 1x81 h SER 362 CO -0.10 0.39 0.00 -0.07 -0.53 0.00 0.00 176.83 176.52 1x81 h LEU 363 N 0.71 0.01 0.01 2.23 3.38 -0.67 -2.50 115.31 118.49 1x81 h LEU 363 Ca 0.28 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1x81 h LEU 363 Cb 0.13 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1x81 h LEU 363 CO -0.15 0.22 -0.00 1.56 0.09 0.00 0.00 178.44 180.15 1x81 h GLN 364 N -0.19 -0.01 0.00 1.13 4.20 -1.16 0.14 115.11 119.22 1x81 h GLN 364 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1x81 h GLN 364 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1x81 h GLN 364 CO -0.00 0.06 0.00 1.03 -0.67 0.00 0.00 178.83 179.25 1x81 h SER 365 N -0.08 0.00 0.00 1.46 0.87 -1.11 -3.11 113.55 111.57 1x81 h SER 365 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1x81 h SER 365 Cb 0.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1x81 h SER 365 CO 0.00 0.00 0.00 2.29 -0.53 0.00 0.00 176.83 178.59 1x81 n LYS 366 N -2.90 2.39 -1.91 2.24 2.85 -0.88 -4.81 118.16 115.13 1x81 n LYS 366 Ca -0.02 -1.33 -0.02 0.00 -1.05 0.00 0.00 58.31 55.89 1x81 n LYS 366 Cb 0.11 -0.97 0.03 0.00 -0.65 0.00 0.00 35.03 33.55 1x81 n LYS 366 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1x81 n HIS 367 N -0.42 -0.40 -3.15 5.58 8.25 0.44 -5.03 115.22 120.50 1x81 n HIS 367 Ca 0.00 -1.14 0.05 0.00 -0.26 0.00 0.00 57.72 56.37 1x81 n HIS 367 Cb 0.23 0.56 -0.01 0.00 1.12 0.00 0.00 29.99 31.89 1x81 n HIS 367 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1x81 s SER 368 N -1.72 -0.68 0.00 0.41 1.04 -1.18 -4.89 113.70 106.68 1x81 s SER 368 Ca 0.14 0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.92 1x81 s SER 368 Cb 0.26 1.54 0.00 0.00 0.10 0.00 0.00 66.02 67.92 1x81 s SER 368 CO -0.08 -0.13 0.00 -1.14 0.98 0.00 0.00 173.24 172.88