#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n9a s LEU 56 N 0.00 0.06 0.50 -2.13 0.20 -1.26 -5.15 118.68 110.91 1n9a s LEU 56 Ca 0.00 -0.17 -0.23 0.00 0.69 0.00 0.00 54.13 54.42 1n9a s LEU 56 Cb 0.00 0.12 -0.07 0.00 -0.43 0.00 0.00 46.19 45.82 1n9a s LEU 56 CO 0.00 -0.31 1.32 -1.20 -0.29 0.00 0.00 176.35 175.87 1n9a n SER 57 N 5.31 2.60 0.24 3.68 7.64 -1.26 -4.89 113.62 126.94 1n9a n SER 57 Ca -0.06 1.02 0.15 0.00 1.01 0.00 0.00 58.87 61.00 1n9a n SER 57 Cb 0.49 -1.55 0.53 0.00 -1.01 0.00 0.00 64.21 62.68 1n9a n SER 57 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1n9a h LEU 58 N 1.66 0.00 0.00 -3.43 3.38 -2.00 -2.88 115.31 112.03 1n9a h LEU 58 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1n9a h LEU 58 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1n9a h LEU 58 CO 0.58 0.00 -0.93 0.47 0.09 0.00 0.00 178.44 178.65 1n9a n ASP 59 N -2.96 0.91 -4.73 -0.43 9.92 -1.26 -4.95 116.55 113.06 1n9a n ASP 59 Ca 0.02 -0.87 -0.41 0.00 -0.53 0.00 0.00 54.79 52.99 1n9a n ASP 59 Cb 0.36 0.89 0.01 0.00 -0.64 0.00 0.00 41.12 41.73 1n9a n ASP 59 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 1n9a n SER 60 N -1.51 3.06 0.29 -2.24 2.88 -1.09 -4.84 113.62 110.17 1n9a n SER 60 Ca 0.04 1.16 0.17 0.00 -1.33 0.00 0.00 58.87 58.91 1n9a n SER 60 Cb 0.33 -1.55 0.83 0.00 -0.75 0.00 0.00 64.21 63.08 1n9a n SER 60 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1n9a h PRO 61 N 2.42 0.00 -0.83 -1.46 0.13 -1.93 -2.34 132.00 128.00 1n9a h PRO 61 Ca -0.49 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.06 1n9a h PRO 61 Cb 1.27 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 32.05 1n9a h PRO 61 CO 0.62 0.05 -0.09 0.25 -0.23 0.00 0.00 178.00 178.59 1n9a n THR 62 N -3.25 2.98 -2.84 1.56 -2.24 -1.26 -5.00 114.28 104.23 1n9a n THR 62 Ca -0.01 -3.61 -0.40 0.00 -2.27 0.00 0.00 64.05 57.76 1n9a n THR 62 Cb 0.23 -1.10 -0.05 0.00 -2.10 0.00 0.00 70.33 67.32 1n9a n THR 62 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1n9a s TYR 63 N -3.67 3.82 0.00 4.78 5.04 -0.88 -5.05 117.35 121.38 1n9a s TYR 63 Ca 0.56 1.69 0.08 0.00 -2.44 0.00 0.00 57.07 56.97 1n9a s TYR 63 Cb 0.45 -2.94 -0.02 0.00 0.35 0.00 0.00 41.96 39.80 1n9a s TYR 63 CO 0.02 0.29 -0.24 0.14 -1.34 0.00 0.00 175.55 174.41 1n9a s VAL 64 N -0.27 1.94 0.59 3.14 -7.23 -1.26 -5.06 120.40 112.26 1n9a s VAL 64 Ca 0.42 -1.13 -0.19 0.00 -1.81 0.00 0.00 61.98 59.27 1n9a s VAL 64 Cb -0.23 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.04 1n9a s VAL 64 CO 0.28 0.48 1.13 0.18 -0.31 0.00 0.00 175.10 176.85 1n9a n LEU 65 N 2.27 4.60 -0.03 1.32 4.77 -1.26 -4.87 117.00 123.80 1n9a n LEU 65 Ca -0.16 0.86 0.03 0.00 -0.03 0.00 0.00 56.01 56.71 1n9a n LEU 65 Cb 0.52 -1.47 0.39 0.00 -2.33 0.00 0.00 43.42 40.52 1n9a n LEU 65 CO 0.23 -1.35 1.15 1.88 -1.33 0.00 0.00 177.39 177.97 1n9a h TYR 66 N 0.77 0.58 -0.44 -1.77 -1.99 -1.96 0.14 116.97 112.30 1n9a h TYR 66 Ca -0.49 0.01 -0.05 0.00 2.00 0.00 0.00 58.73 60.19 1n9a h TYR 66 Cb 1.34 -0.19 -0.02 0.00 2.00 0.00 0.00 36.73 39.86 1n9a h TYR 66 CO 0.40 0.39 0.07 0.07 -0.00 0.00 0.00 178.16 179.09 1n9a h ARG 67 N 0.61 0.67 -0.05 4.88 0.11 -1.90 -0.57 114.38 118.14 1n9a h ARG 67 Ca 0.16 -0.13 0.00 0.00 0.10 0.00 0.00 59.98 60.11 1n9a h ARG 67 Cb -0.03 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 30.95 1n9a h ARG 67 CO -0.03 0.63 0.00 -0.25 0.10 0.00 0.00 179.97 180.42 1n9a n ASP 68 N -4.29 0.28 -4.80 0.08 8.00 0.47 -4.84 116.55 111.46 1n9a n ASP 68 Ca 0.03 -1.87 -0.37 0.00 0.71 0.00 0.00 54.79 53.28 1n9a n ASP 68 Cb 0.23 -0.03 -0.06 0.00 -0.02 0.00 0.00 41.12 41.23 1n9a n ASP 68 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1n9a s ARG 69 N -1.94 3.96 0.35 -1.24 0.52 -0.22 -4.92 118.95 115.46 1n9a s ARG 69 Ca 0.10 0.17 0.11 0.00 -0.52 0.00 0.00 55.73 55.58 1n9a s ARG 69 Cb 0.05 -3.30 0.64 0.00 0.52 0.00 0.00 34.95 32.85 1n9a s ARG 69 CO 0.07 0.52 1.79 0.00 0.02 0.00 0.00 175.30 177.70 1n9a h ALA 70 N 5.60 1.31 -0.22 2.13 0.00 -1.88 -2.54 119.26 123.65 1n9a h ALA 70 Ca -0.48 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.08 1n9a h ALA 70 Cb 1.20 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1n9a h ALA 70 CO 0.67 0.50 0.00 -0.85 0.00 0.00 0.00 179.25 179.57 1n9a n GLU 71 N -4.08 1.89 -2.83 0.00 0.00 -1.26 -4.04 120.64 110.31 1n9a n GLU 71 Ca -0.02 -1.33 -0.19 0.00 0.00 0.00 0.00 57.16 55.62 1n9a n GLU 71 Cb 0.42 -1.41 -0.01 0.00 0.00 0.00 0.00 31.44 30.44 1n9a n GLU 71 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 1n9a n TRP 72 N 0.56 1.85 0.00 -1.84 7.02 -0.96 -4.78 117.44 119.29 1n9a n TRP 72 Ca 0.16 -3.39 0.00 0.00 -1.02 0.00 0.00 57.50 53.26 1n9a n TRP 72 Cb 0.38 -0.35 0.00 0.00 -2.42 0.00 0.00 31.31 28.92 1n9a n TRP 72 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1n9a n ALA 73 N -0.08 1.97 0.83 6.99 0.00 -1.24 -4.52 120.51 124.46 1n9a n ALA 73 Ca 0.24 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.81 1n9a n ALA 73 Cb 0.66 0.00 0.53 0.00 0.00 0.00 0.00 19.45 20.64 1n9a n ALA 73 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1n9a n ASP 74 N -1.37 0.21 -4.73 0.00 5.68 -1.26 -4.78 116.55 110.30 1n9a n ASP 74 Ca 0.00 0.52 -0.28 0.00 -0.50 0.00 0.00 54.79 54.53 1n9a n ASP 74 Cb 0.00 -0.58 -0.07 0.00 -1.14 0.00 0.00 41.12 39.33 1n9a n ASP 74 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1n9a s ILE 75 N -3.04 4.19 -0.20 2.12 1.01 -1.26 -5.10 121.20 118.93 1n9a s ILE 75 Ca 0.12 -1.05 -0.05 0.00 0.00 0.00 0.00 60.65 59.66 1n9a s ILE 75 Cb 0.16 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.54 1n9a s ILE 75 CO 0.50 0.01 0.00 -1.81 0.00 0.00 0.00 174.94 173.65 1n9a s ASP 76 N -2.67 4.88 -0.11 3.58 1.11 -1.26 -5.05 116.67 117.14 1n9a s ASP 76 Ca 0.28 -0.18 -0.29 0.00 0.18 0.00 0.00 52.55 52.54 1n9a s ASP 76 Cb -0.11 -1.83 -0.05 0.00 1.07 0.00 0.00 42.92 42.00 1n9a s ASP 76 CO 0.21 0.07 1.72 -2.16 1.18 0.00 0.00 175.17 176.19 1n9a s PRO 77 N 0.95 3.96 -0.41 8.23 0.04 -1.26 -4.78 135.00 141.74 1n9a s PRO 77 Ca 0.02 2.04 -0.25 0.00 0.04 0.00 0.00 61.00 62.84 1n9a s PRO 77 Cb -0.14 -4.05 0.02 0.00 0.04 0.00 0.00 34.50 30.36 1n9a s PRO 77 CO 0.02 -1.12 0.90 0.08 0.04 0.00 0.00 177.00 176.92 1n9a s VAL 78 N 4.84 4.56 0.64 -0.36 1.01 -0.12 -4.92 120.40 126.06 1n9a s VAL 78 Ca 0.77 0.95 -0.12 0.00 0.00 0.00 0.00 61.98 63.58 1n9a s VAL 78 Cb -0.31 -4.35 -0.02 0.00 0.00 0.00 0.00 36.38 31.69 1n9a s VAL 78 CO 0.31 -0.64 1.04 -2.16 0.00 0.00 0.00 175.10 173.65 1n9a s PRO 79 N 3.52 3.33 0.28 2.72 0.04 -1.26 -4.21 135.00 139.42 1n9a s PRO 79 Ca 0.36 0.88 -0.29 0.00 0.04 0.00 0.00 61.00 61.99 1n9a s PRO 79 Cb -0.11 -2.04 -0.10 0.00 0.04 0.00 0.00 34.50 32.29 1n9a s PRO 79 CO 0.21 -0.79 1.16 -1.14 0.04 0.00 0.00 177.00 176.49 1n9a s GLN 80 N -4.97 4.55 -0.62 4.56 0.74 -1.26 -4.99 119.66 117.67 1n9a s GLN 80 Ca 0.57 1.92 -0.06 0.00 0.05 0.00 0.00 55.36 57.83 1n9a s GLN 80 Cb -0.12 -3.17 0.16 0.00 1.10 0.00 0.00 33.01 30.98 1n9a s GLN 80 CO 0.52 0.08 0.47 1.21 -0.55 0.00 0.00 175.29 177.02 1n9a s ASN 81 N -0.66 5.65 0.00 6.67 2.47 -1.26 -4.88 114.94 122.93 1n9a s ASN 81 Ca 0.47 -2.58 0.24 0.00 0.42 0.00 0.00 52.86 51.40 1n9a s ASN 81 Cb -0.34 -1.96 0.69 0.00 -1.45 0.00 0.00 41.25 38.19 1n9a s ASN 81 CO 0.43 -0.49 1.53 0.47 -3.72 0.00 0.00 177.10 175.33 1n9a n ASP 82 N 3.94 2.14 0.00 -4.21 9.92 -1.26 -5.04 116.55 122.04 1n9a n ASP 82 Ca 0.05 -1.75 0.00 0.00 -0.53 0.00 0.00 54.79 52.56 1n9a n ASP 82 Cb 0.41 -0.09 0.00 0.00 -0.64 0.00 0.00 41.12 40.80 1n9a n ASP 82 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1n9a n GLY 83 N 1.24 -1.57 0.41 0.44 0.00 -1.26 -4.29 105.19 100.17 1n9a n GLY 83 Ca 0.17 -1.36 0.14 0.00 0.00 0.00 0.00 46.02 44.98 1n9a n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n9a h PRO 84 N 0.00 0.00 -2.63 1.61 0.13 -2.02 -3.04 132.00 126.05 1n9a h PRO 84 Ca 0.00 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.55 1n9a h PRO 84 Cb 0.00 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 30.74 1n9a h PRO 84 CO 0.00 0.00 -0.84 -1.12 -0.23 0.00 0.00 178.00 175.81 1n9a s SER 85 N -3.49 2.98 0.73 1.44 0.01 -1.26 -5.14 113.70 108.98 1n9a s SER 85 Ca -0.02 -2.29 -0.14 0.00 1.31 0.00 0.00 55.95 54.81 1n9a s SER 85 Cb 0.08 -0.48 0.04 0.00 0.21 0.00 0.00 66.02 65.86 1n9a s SER 85 CO 0.25 -0.30 1.16 -2.84 0.41 0.00 0.00 173.24 171.93 1n9a s PRO 86 N 0.92 2.25 0.06 12.44 0.02 -1.15 -5.09 135.00 144.45 1n9a s PRO 86 Ca 0.19 1.58 0.01 0.00 0.02 0.00 0.00 61.00 62.79 1n9a s PRO 86 Cb -0.22 -1.87 -0.03 0.00 0.02 0.00 0.00 34.50 32.40 1n9a s PRO 86 CO -0.00 -1.71 -0.05 0.14 -0.33 0.00 0.00 177.00 175.05 1n9a s VAL 87 N -2.23 0.38 -0.37 3.83 -7.23 -1.26 -4.86 120.40 108.67 1n9a s VAL 87 Ca 0.70 -1.52 -0.11 0.00 -1.81 0.00 0.00 61.98 59.25 1n9a s VAL 87 Cb -0.25 -1.13 0.01 0.00 0.56 0.00 0.00 36.38 35.58 1n9a s VAL 87 CO 0.46 -0.74 0.21 1.33 -0.31 0.00 0.00 175.10 176.04 1n9a n VAL 88 N 0.64 -0.80 -3.44 1.32 0.24 -1.26 -4.80 118.33 110.22 1n9a n VAL 88 Ca -0.17 -0.17 -0.39 0.00 -2.04 0.00 0.00 64.34 61.57 1n9a n VAL 88 Cb 0.58 -0.68 -0.10 0.00 -1.47 0.00 0.00 33.84 32.18 1n9a n VAL 88 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1n9a s GLN 89 N -5.66 3.97 0.10 7.34 0.74 -1.26 -5.06 119.66 119.83 1n9a s GLN 89 Ca 0.15 -0.08 -0.27 0.00 0.05 0.00 0.00 55.36 55.20 1n9a s GLN 89 Cb -0.08 -3.67 -0.06 0.00 1.10 0.00 0.00 33.01 30.30 1n9a s GLN 89 CO 0.30 -0.27 0.86 0.42 -0.55 0.00 0.00 175.29 176.05 1n9a s ILE 90 N 1.99 4.54 -0.89 -2.34 1.01 -1.26 -4.99 121.20 119.26 1n9a s ILE 90 Ca 0.13 1.86 -0.18 0.00 0.00 0.00 0.00 60.65 62.46 1n9a s ILE 90 Cb -0.16 -4.22 0.15 0.00 0.01 0.00 0.00 42.46 38.24 1n9a s ILE 90 CO 0.10 0.37 1.04 -0.63 0.00 0.00 0.00 174.94 175.82 1n9a s ILE 91 N -0.24 4.91 0.77 2.92 -1.09 -1.26 -5.00 121.20 122.20 1n9a s ILE 91 Ca 0.42 -1.72 -0.11 0.00 -2.23 0.00 0.00 60.65 57.01 1n9a s ILE 91 Cb -0.22 -4.70 0.05 0.00 -1.58 0.00 0.00 42.46 36.00 1n9a s ILE 91 CO 0.27 -1.40 1.09 -0.31 -1.23 0.00 0.00 174.94 173.36 1n9a s TYR 92 N 2.19 2.60 0.68 3.97 4.12 -1.26 -5.02 117.35 124.63 1n9a s TYR 92 Ca 0.29 1.55 -0.11 0.00 0.02 0.00 0.00 57.07 58.82 1n9a s TYR 92 Cb -0.07 -3.04 -0.00 0.00 -1.52 0.00 0.00 41.96 37.33 1n9a s TYR 92 CO -0.09 -1.77 1.06 -1.54 0.02 0.00 0.00 175.55 173.24 1n9a s SER 93 N -3.39 5.59 0.49 2.29 1.04 -1.26 -4.83 113.70 113.62 1n9a s SER 93 Ca 0.61 1.40 0.16 0.00 0.48 0.00 0.00 55.95 58.60 1n9a s SER 93 Cb -0.17 -2.31 1.17 0.00 0.10 0.00 0.00 66.02 64.81 1n9a s SER 93 CO 0.56 -1.28 2.08 -0.08 0.98 0.00 0.00 173.24 175.49 1n9a h GLU 94 N -0.61 0.18 -0.08 4.02 4.57 -1.99 -0.84 114.58 119.82 1n9a h GLU 94 Ca -0.45 -0.01 -0.18 0.00 -1.18 0.00 0.00 59.36 57.54 1n9a h GLU 94 Cb 1.22 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.78 1n9a h GLU 94 CO 0.60 0.12 -0.66 -0.22 -1.18 0.00 0.00 179.01 177.67 1n9a h LYS 95 N 0.18 0.59 -0.15 1.92 3.64 -1.99 -1.26 116.57 119.50 1n9a h LYS 95 Ca 0.12 -0.52 -0.02 0.00 -1.27 0.00 0.00 60.65 58.96 1n9a h LYS 95 Cb 0.26 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1n9a h LYS 95 CO -0.02 1.15 0.01 0.35 -2.27 0.00 0.00 179.45 178.67 1n9a h PHE 96 N 0.21 0.28 -0.95 1.91 3.57 -1.81 -2.46 116.94 117.69 1n9a h PHE 96 Ca -0.06 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.40 1n9a h PHE 96 Cb 1.31 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 39.93 1n9a h PHE 96 CO 0.11 0.46 0.61 0.00 -2.23 0.00 0.00 178.31 177.26 1n9a h ARG 97 N 0.01 1.26 0.34 1.11 3.08 -1.24 -2.57 114.38 116.38 1n9a h ARG 97 Ca 0.04 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 1n9a h ARG 97 Cb 0.34 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1n9a h ARG 97 CO 0.01 0.85 -0.16 0.22 -1.07 0.00 0.00 179.97 179.81 1n9a h ASP 98 N 1.30 -0.39 -0.50 7.04 3.58 -1.06 -0.01 116.42 126.38 1n9a h ASP 98 Ca 0.35 -0.09 0.03 0.00 0.42 0.00 0.00 57.03 57.74 1n9a h ASP 98 Cb -0.12 0.10 -0.04 0.00 1.72 0.00 0.00 39.33 40.99 1n9a h ASP 98 CO -0.07 -0.14 0.28 0.58 -2.88 0.00 0.00 179.24 177.00 1n9a h VAL 99 N -0.62 1.01 -0.13 2.25 2.07 -1.41 -2.73 116.25 116.68 1n9a h VAL 99 Ca -0.05 -0.19 -0.12 0.00 0.82 0.00 0.00 66.70 67.17 1n9a h VAL 99 Cb 0.45 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1n9a h VAL 99 CO 0.08 0.10 -0.44 1.88 0.02 0.00 0.00 177.57 179.21 1n9a h TYR 100 N 0.55 0.36 -0.55 1.57 -1.99 -1.42 0.76 116.97 116.25 1n9a h TYR 100 Ca 0.21 -0.11 -0.03 0.00 2.00 0.00 0.00 58.73 60.81 1n9a h TYR 100 Cb 0.07 -0.08 -0.03 0.00 2.00 0.00 0.00 36.73 38.70 1n9a h TYR 100 CO -0.08 0.70 0.22 -0.44 -0.00 0.00 0.00 178.16 178.55 1n9a h ASP 101 N 0.25 0.72 0.79 3.88 5.19 -0.78 0.92 116.42 127.40 1n9a h ASP 101 Ca 0.02 -0.09 -0.15 0.00 -0.62 0.00 0.00 57.03 56.19 1n9a h ASP 101 Cb 0.88 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 40.18 1n9a h ASP 101 CO 0.07 0.65 -0.72 1.88 -3.12 0.00 0.00 179.24 178.00 1n9a h TYR 102 N 0.78 0.00 -0.15 4.55 0.05 -1.17 -0.26 116.97 120.78 1n9a h TYR 102 Ca 0.19 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.86 1n9a h TYR 102 Cb 0.16 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.90 1n9a h TYR 102 CO 0.01 0.72 -0.31 0.35 -1.05 0.00 0.00 178.16 177.88 1n9a h PHE 103 N 0.00 0.60 -0.96 4.88 3.57 0.44 -2.16 116.94 123.31 1n9a h PHE 103 Ca -0.01 -0.22 0.19 0.00 3.53 0.00 0.00 57.97 61.47 1n9a h PHE 103 Cb 1.31 -0.11 -0.09 0.00 2.79 0.00 0.00 35.95 39.86 1n9a h PHE 103 CO 0.00 0.93 0.61 0.00 -2.23 0.00 0.00 178.31 177.62 1n9a h ARG 104 N 0.09 0.59 0.01 1.11 3.08 -0.89 -0.04 114.38 118.33 1n9a h ARG 104 Ca 0.00 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1n9a h ARG 104 Cb 0.90 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.82 1n9a h ARG 104 CO 0.07 0.39 -0.01 0.00 -1.07 0.00 0.00 179.97 179.36 1n9a h ALA 105 N 1.62 -0.02 -0.70 0.04 0.00 -1.43 0.12 119.26 118.90 1n9a h ALA 105 Ca 0.52 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1n9a h ALA 105 Cb 1.01 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1n9a h ALA 105 CO -0.28 -0.16 0.37 0.28 0.00 0.00 0.00 179.25 179.46 1n9a h VAL 106 N -0.71 1.22 0.25 0.00 2.07 -1.06 0.36 116.25 118.38 1n9a h VAL 106 Ca -0.00 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1n9a h VAL 106 Cb 0.68 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1n9a h VAL 106 CO 0.00 0.25 -0.12 0.25 0.02 0.00 0.00 177.57 177.97 1n9a h LEU 107 N 0.96 -0.29 -1.44 2.57 5.85 -1.09 0.46 115.31 122.33 1n9a h LEU 107 Ca 0.24 -0.17 0.17 0.00 0.84 0.00 0.00 57.88 58.96 1n9a h LEU 107 Cb 0.06 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 1n9a h LEU 107 CO -0.04 0.03 0.57 -0.61 -0.34 0.00 0.00 178.44 178.04 1n9a h GLN 108 N -0.62 0.50 0.00 1.25 4.15 -0.35 0.94 115.11 120.98 1n9a h GLN 108 Ca -0.03 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.35 1n9a h GLN 108 Cb 0.45 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.02 1n9a h GLN 108 CO 0.06 0.33 -0.18 0.00 -1.93 0.00 0.00 178.83 177.10 1n9a h ARG 109 N 0.51 0.00 -4.50 1.69 3.08 -0.04 -3.47 114.38 111.65 1n9a h ARG 109 Ca 0.44 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 60.14 1n9a h ARG 109 Cb 0.93 0.00 0.08 0.00 0.08 0.00 0.00 29.97 31.07 1n9a h ARG 109 CO -0.18 0.01 -0.56 -3.47 -1.07 0.00 0.00 179.97 174.70 1n9a n ASP 110 N -3.03 -5.69 -4.60 7.04 2.03 0.33 -4.88 116.55 107.75 1n9a n ASP 110 Ca 0.03 -0.35 -0.43 0.00 0.52 0.00 0.00 54.79 54.57 1n9a n ASP 110 Cb 0.54 -4.43 -0.02 0.00 -0.72 0.00 0.00 41.12 36.48 1n9a n ASP 110 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 1n9a s GLU 111 N -5.81 3.40 -1.10 -0.67 2.12 0.11 -4.87 118.70 111.88 1n9a s GLU 111 Ca 0.37 1.19 -0.04 0.00 0.36 0.00 0.00 54.97 56.85 1n9a s GLU 111 Cb -0.16 -4.14 0.29 0.00 0.26 0.00 0.00 34.13 30.38 1n9a s GLU 111 CO 0.46 -1.78 1.61 0.54 -0.54 0.00 0.00 175.26 175.55 1n9a n ARG 112 N 8.34 4.59 -4.23 4.30 1.74 -1.26 -4.79 116.66 125.34 1n9a n ARG 112 Ca 0.20 -4.45 -0.23 0.00 -0.77 0.00 0.00 57.85 52.59 1n9a n ARG 112 Cb 0.47 -2.54 -0.07 0.00 -1.02 0.00 0.00 32.46 29.30 1n9a n ARG 112 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1n9a s SER 113 N -1.43 4.50 0.28 0.55 1.04 -1.26 -4.77 113.70 112.60 1n9a s SER 113 Ca 0.34 -0.78 -0.04 0.00 0.48 0.00 0.00 55.95 55.95 1n9a s SER 113 Cb 0.08 -0.72 0.37 0.00 0.10 0.00 0.00 66.02 65.85 1n9a s SER 113 CO 0.05 -0.17 1.94 -0.08 0.98 0.00 0.00 173.24 175.96 1n9a h GLU 114 N 1.74 1.15 -0.10 4.02 4.57 -1.99 0.38 114.58 124.36 1n9a h GLU 114 Ca -0.44 -0.09 -0.12 0.00 -1.18 0.00 0.00 59.36 57.54 1n9a h GLU 114 Cb 1.25 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 29.58 1n9a h GLU 114 CO 0.63 0.79 -0.48 0.07 -1.18 0.00 0.00 179.01 178.84 1n9a h ARG 115 N 1.18 0.25 -0.65 1.92 0.11 -1.97 -1.15 114.38 114.08 1n9a h ARG 115 Ca 0.31 -0.14 -0.08 0.00 0.10 0.00 0.00 59.98 60.17 1n9a h ARG 115 Cb -0.10 0.01 -0.02 0.00 1.11 0.00 0.00 29.97 30.97 1n9a h ARG 115 CO -0.06 0.68 0.09 0.00 0.10 0.00 0.00 179.97 180.78 1n9a h ALA 116 N 1.30 0.86 0.28 0.08 0.00 -1.62 -2.19 119.26 117.97 1n9a h ALA 116 Ca 0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1n9a h ALA 116 Cb 0.92 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1n9a h ALA 116 CO 0.08 0.64 -0.17 0.35 0.00 0.00 0.00 179.25 180.15 1n9a h PHE 117 N 1.00 -0.43 -0.03 0.00 3.57 -0.27 -1.65 116.94 119.12 1n9a h PHE 117 Ca 0.19 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.70 1n9a h PHE 117 Cb 0.46 0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.35 1n9a h PHE 117 CO 0.03 -0.26 0.03 0.87 -2.23 0.00 0.00 178.31 176.75 1n9a h LYS 118 N -0.43 0.00 0.02 1.11 1.57 -1.11 -2.58 116.57 115.15 1n9a h LYS 118 Ca -0.03 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.55 1n9a h LYS 118 Cb 0.35 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 1n9a h LYS 118 CO 0.03 0.00 -0.95 1.25 -0.57 0.00 0.00 179.45 179.22 1n9a h LEU 119 N 0.00 0.11 -1.29 2.94 5.85 -0.66 -3.06 115.31 119.20 1n9a h LEU 119 Ca 0.01 -0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.57 1n9a h LEU 119 Cb 0.07 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1n9a h LEU 119 CO -0.00 0.99 -0.16 0.71 -0.34 0.00 0.00 178.44 179.64 1n9a h THR 120 N 0.03 1.20 -0.46 1.05 1.35 -0.98 -0.73 112.91 114.38 1n9a h THR 120 Ca -0.03 -0.92 0.06 0.00 -0.55 0.00 0.00 66.41 64.97 1n9a h THR 120 Cb 1.64 1.26 -0.05 0.00 -1.73 0.00 0.00 68.15 69.26 1n9a h THR 120 CO 0.13 0.29 0.15 -0.09 -0.25 0.00 0.00 175.52 175.75 1n9a h ARG 121 N 0.26 0.30 -0.21 4.72 1.12 -1.50 0.70 114.38 119.77 1n9a h ARG 121 Ca 0.05 -0.02 -0.18 0.00 -1.11 0.00 0.00 59.98 58.73 1n9a h ARG 121 Cb 0.45 -0.07 -0.00 0.00 -0.01 0.00 0.00 29.97 30.34 1n9a h ARG 121 CO 0.03 0.20 -0.58 -0.44 -3.11 0.00 0.00 179.97 176.07 1n9a h ASP 122 N 0.31 0.75 0.09 -3.80 3.32 -1.38 -1.95 116.42 113.76 1n9a h ASP 122 Ca 0.22 -0.41 -0.07 0.00 0.02 0.00 0.00 57.03 56.79 1n9a h ASP 122 Cb 0.23 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1n9a h ASP 122 CO -0.24 1.16 -0.22 0.00 -1.72 0.00 0.00 179.24 178.23 1n9a h ALA 123 N 0.85 1.39 -0.06 3.45 0.00 -0.20 -1.51 119.26 123.18 1n9a h ALA 123 Ca 0.00 -0.27 -0.21 0.00 0.00 0.00 0.00 54.91 54.43 1n9a h ALA 123 Cb 1.15 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1n9a h ALA 123 CO 0.12 0.42 -0.84 0.82 0.00 0.00 0.00 179.25 179.77 1n9a h ILE 124 N 0.21 1.36 0.00 0.00 2.04 0.48 -2.59 117.51 119.01 1n9a h ILE 124 Ca 0.04 -2.23 -0.10 0.00 1.00 0.00 0.00 64.86 63.57 1n9a h ILE 124 Cb 0.50 2.22 -0.01 0.00 -0.74 0.00 0.00 36.82 38.79 1n9a h ILE 124 CO 0.03 0.68 -0.49 -0.08 0.00 0.00 0.00 178.15 178.29 1n9a h GLU 125 N 0.32 0.00 0.01 2.37 4.81 -0.79 0.23 114.58 121.53 1n9a h GLU 125 Ca -0.06 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.98 1n9a h GLU 125 Cb 1.45 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.81 1n9a h GLU 125 CO 0.15 0.49 -0.90 -0.07 -0.73 0.00 0.00 179.01 177.95 1n9a h LEU 126 N 0.00 0.07 -5.69 1.64 3.38 -1.25 -3.41 115.31 110.06 1n9a h LEU 126 Ca -0.00 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.75 1n9a h LEU 126 Cb 0.99 -0.02 -0.20 0.00 0.09 0.00 0.00 40.66 41.51 1n9a h LEU 126 CO 0.06 0.93 -0.51 0.21 0.09 0.00 0.00 178.44 179.22 1n9a s ASN 127 N -6.81 -1.11 0.67 -0.43 2.47 -0.98 -5.00 114.94 103.74 1n9a s ASN 127 Ca -0.01 -1.31 0.43 0.00 0.42 0.00 0.00 52.86 52.39 1n9a s ASN 127 Cb 0.10 1.70 2.36 0.00 -1.45 0.00 0.00 41.25 43.96 1n9a s ASN 127 CO 0.81 -0.14 2.34 0.00 -3.72 0.00 0.00 177.10 176.40 1n9a h ALA 128 N 6.22 1.05 -0.07 1.71 0.00 -0.78 -1.07 119.26 126.33 1n9a h ALA 128 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1n9a h ALA 128 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1n9a h ALA 128 CO 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.31 1n9a n ALA 129 N -2.08 2.56 -2.70 0.00 0.00 -1.26 -4.69 120.51 112.34 1n9a n ALA 129 Ca -0.03 -0.25 -0.42 0.00 0.00 0.00 0.00 53.44 52.74 1n9a n ALA 129 Cb 0.10 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.34 1n9a n ALA 129 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1n9a s ASN 130 N -1.46 6.29 0.52 0.00 3.84 -0.40 -4.85 114.94 118.88 1n9a s ASN 130 Ca 0.25 -1.03 0.28 0.00 0.21 0.00 0.00 52.86 52.57 1n9a s ASN 130 Cb 0.12 -2.49 1.43 0.00 -0.55 0.00 0.00 41.25 39.76 1n9a s ASN 130 CO 0.20 -1.55 2.05 0.10 -2.79 0.00 0.00 177.10 175.11 1n9a h TYR 131 N 9.68 0.00 -0.26 0.43 -0.00 -1.89 -2.65 116.97 122.28 1n9a h TYR 131 Ca -0.13 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.48 1n9a h TYR 131 Cb 1.05 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.77 1n9a h TYR 131 CO 1.11 0.12 -0.31 1.15 -0.00 0.00 0.00 178.16 180.23 1n9a h THR 132 N 0.00 1.31 -0.50 -0.90 2.02 -1.99 -1.50 112.91 111.35 1n9a h THR 132 Ca -0.00 -1.50 -0.11 0.00 0.77 0.00 0.00 66.41 65.57 1n9a h THR 132 Cb 0.37 1.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.43 1n9a h THR 132 CO 0.02 0.47 -0.14 0.58 0.37 0.00 0.00 175.52 176.82 1n9a h VAL 133 N 0.40 1.27 0.00 3.16 2.07 -1.93 -1.85 116.25 119.36 1n9a h VAL 133 Ca 0.03 -1.28 -0.03 0.00 0.82 0.00 0.00 66.70 66.25 1n9a h VAL 133 Cb 0.89 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 1n9a h VAL 133 CO 0.08 0.45 -0.13 -0.50 0.02 0.00 0.00 177.57 177.48 1n9a h TRP 134 N 0.84 0.00 0.17 1.57 4.06 -1.29 -0.95 115.95 120.35 1n9a h TRP 134 Ca 0.13 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.07 1n9a h TRP 134 Cb 0.69 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.85 1n9a h TRP 134 CO 0.04 0.13 -0.08 1.25 -3.56 0.00 0.00 178.44 176.23 1n9a h HIS 135 N 0.00 -0.21 -0.52 0.49 2.76 -0.67 -2.89 115.15 114.12 1n9a h HIS 135 Ca -0.00 -0.00 0.10 0.00 -2.20 0.00 0.00 60.37 58.27 1n9a h HIS 135 Cb 0.24 0.07 -0.03 0.00 1.55 0.00 0.00 27.41 29.24 1n9a h HIS 135 CO 0.00 0.22 0.36 0.35 -1.30 0.00 0.00 177.93 177.56 1n9a h PHE 136 N -0.86 0.27 -0.10 5.26 3.57 -1.18 0.83 116.94 124.73 1n9a h PHE 136 Ca -0.02 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.39 1n9a h PHE 136 Cb 0.52 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 1n9a h PHE 136 CO 0.08 0.13 -0.38 -0.09 -2.23 0.00 0.00 178.31 175.82 1n9a h ARG 137 N 0.26 0.21 -0.05 1.11 2.43 -1.15 -1.33 114.38 115.85 1n9a h ARG 137 Ca 0.24 -0.09 -0.17 0.00 -0.81 0.00 0.00 59.98 59.16 1n9a h ARG 137 Cb 0.62 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1n9a h ARG 137 CO -0.05 0.57 -0.69 0.00 -1.51 0.00 0.00 179.97 178.29 1n9a h ARG 138 N 0.18 0.26 -0.32 0.20 3.08 -0.64 -0.46 114.38 116.68 1n9a h ARG 138 Ca 0.02 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 1n9a h ARG 138 Cb 0.76 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.84 1n9a h ARG 138 CO 0.06 0.85 0.16 0.28 -1.07 0.00 0.00 179.97 180.24 1n9a h VAL 139 N 0.18 1.15 -0.31 2.04 2.07 -1.02 -1.81 116.25 118.55 1n9a h VAL 139 Ca -0.02 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.02 1n9a h VAL 139 Cb 1.24 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1n9a h VAL 139 CO 0.11 0.16 -0.02 -0.07 0.02 0.00 0.00 177.57 177.76 1n9a h LEU 140 N 0.38 0.45 -0.89 2.57 3.38 -1.03 0.12 115.31 120.29 1n9a h LEU 140 Ca 0.11 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1n9a h LEU 140 Cb 0.11 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1n9a h LEU 140 CO -0.01 0.53 0.58 -0.07 0.09 0.00 0.00 178.44 179.56 1n9a h LEU 141 N 0.46 1.03 0.07 1.67 3.38 -0.28 0.22 115.31 121.86 1n9a h LEU 141 Ca 0.10 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1n9a h LEU 141 Cb 0.34 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1n9a h LEU 141 CO 0.01 0.76 -0.03 0.03 0.09 0.00 0.00 178.44 179.30 1n9a h ARG 142 N 1.21 -0.08 0.08 1.13 3.08 -0.81 -0.88 114.38 118.10 1n9a h ARG 142 Ca 0.32 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.38 1n9a h ARG 142 Cb -0.12 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 29.95 1n9a h ARG 142 CO -0.07 0.45 -0.08 1.03 -1.07 0.00 0.00 179.97 180.24 1n9a h SER 143 N -0.92 -0.21 0.02 7.04 0.87 -0.74 -1.54 113.55 118.07 1n9a h SER 143 Ca -0.01 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1n9a h SER 143 Cb 0.58 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 1n9a h SER 143 CO 0.01 -0.10 0.00 0.18 -0.53 0.00 0.00 176.83 176.39 1n9a n LEU 144 N -2.74 0.00 -3.40 2.23 4.77 0.06 -4.84 117.00 113.08 1n9a n LEU 144 Ca -0.02 0.16 -0.15 0.00 -0.03 0.00 0.00 56.01 55.98 1n9a n LEU 144 Cb 0.07 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1n9a n LEU 144 CO 0.04 -0.15 0.01 0.00 -1.33 0.00 0.00 177.39 175.96 1n9a n GLN 145 N -1.16 -1.57 -3.30 3.23 1.13 -0.58 -4.95 117.38 110.18 1n9a n GLN 145 Ca 0.01 1.23 -0.30 0.00 -1.94 0.00 0.00 57.00 56.01 1n9a n GLN 145 Cb 0.01 -3.93 -0.04 0.00 0.11 0.00 0.00 30.24 26.40 1n9a n GLN 145 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1n9a s LYS 146 N -3.75 3.69 -0.35 -1.09 -0.14 -0.35 -5.00 119.74 112.75 1n9a s LYS 146 Ca 0.06 0.12 -0.28 0.00 -1.36 0.00 0.00 55.97 54.50 1n9a s LYS 146 Cb -0.01 -2.62 -0.01 0.00 -1.68 0.00 0.00 37.83 33.51 1n9a s LYS 146 CO 0.83 0.21 1.74 0.34 -0.76 0.00 0.00 175.35 177.70 1n9a s ASP 147 N -2.97 5.95 0.26 2.83 -1.08 -1.26 -4.87 116.67 115.53 1n9a s ASP 147 Ca 0.46 1.21 0.01 0.00 -0.52 0.00 0.00 52.55 53.70 1n9a s ASP 147 Cb -0.11 -2.53 0.35 0.00 -1.46 0.00 0.00 42.92 39.18 1n9a s ASP 147 CO 0.28 -1.68 1.70 -0.07 0.52 0.00 0.00 175.17 175.93 1n9a h LEU 148 N 13.49 0.57 -1.24 -1.34 3.38 -1.94 -2.58 115.31 125.64 1n9a h LEU 148 Ca -0.33 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.43 1n9a h LEU 148 Cb 1.16 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1n9a h LEU 148 CO 1.04 0.80 0.27 -0.61 0.09 0.00 0.00 178.44 180.03 1n9a h GLN 149 N 0.51 0.79 -0.62 1.13 5.75 -1.99 0.75 115.11 121.43 1n9a h GLN 149 Ca 0.08 -0.10 -0.06 0.00 -0.15 0.00 0.00 58.65 58.42 1n9a h GLN 149 Cb 0.67 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 29.04 1n9a h GLN 149 CO 0.05 0.62 0.16 1.49 -2.65 0.00 0.00 178.83 178.50 1n9a h GLU 150 N 0.80 0.96 0.00 1.69 4.81 -1.91 -2.17 114.58 118.76 1n9a h GLU 150 Ca 0.20 -0.21 -0.12 0.00 -0.13 0.00 0.00 59.36 59.10 1n9a h GLU 150 Cb 0.09 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 1n9a h GLU 150 CO -0.03 0.85 -0.56 1.49 -0.73 0.00 0.00 179.01 180.03 1n9a h GLU 151 N 0.92 0.00 -0.73 1.92 4.57 -0.21 -2.74 114.58 118.31 1n9a h GLU 151 Ca 0.20 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.36 1n9a h GLU 151 Cb 0.32 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 1n9a h GLU 151 CO -0.00 0.56 0.37 0.52 -1.18 0.00 0.00 179.01 179.28 1n9a h MET 152 N 0.00 1.03 -0.53 1.92 2.86 0.95 -1.34 114.93 119.82 1n9a h MET 152 Ca -0.01 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.43 1n9a h MET 152 Cb 1.11 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.56 1n9a h MET 152 CO 0.07 0.78 0.04 -0.91 1.06 0.00 0.00 176.91 177.95 1n9a h ASN 153 N 1.03 0.88 0.56 1.22 2.35 -1.16 -0.88 115.58 119.58 1n9a h ASN 153 Ca 0.25 -0.29 -0.02 0.00 -0.55 0.00 0.00 56.30 55.69 1n9a h ASN 153 Cb 0.08 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.21 1n9a h ASN 153 CO -0.04 0.95 -0.34 0.22 -1.65 0.00 0.00 177.43 176.58 1n9a h TYR 154 N 0.79 -0.90 -0.45 1.19 3.20 -1.17 -1.70 116.97 117.92 1n9a h TYR 154 Ca 0.16 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.15 1n9a h TYR 154 Cb 0.47 0.32 -0.02 0.00 1.54 0.00 0.00 36.73 39.05 1n9a h TYR 154 CO 0.03 -0.51 0.38 0.97 -1.64 0.00 0.00 178.16 177.40 1n9a h ILE 155 N -0.84 0.57 -0.30 1.81 6.09 -1.27 -0.44 117.51 123.13 1n9a h ILE 155 Ca -0.08 0.00 -0.04 0.00 -1.37 0.00 0.00 64.86 63.37 1n9a h ILE 155 Cb 0.67 0.72 -0.01 0.00 0.47 0.00 0.00 36.82 38.67 1n9a h ILE 155 CO 0.08 0.00 0.03 0.74 -3.07 0.00 0.00 178.15 175.93 1n9a h THR 156 N 0.00 1.24 -0.38 2.19 2.02 -0.52 -1.16 112.91 116.30 1n9a h THR 156 Ca 0.21 -0.86 -0.11 0.00 0.77 0.00 0.00 66.41 66.42 1n9a h THR 156 Cb 0.98 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 1n9a h THR 156 CO -0.00 0.28 -0.20 0.00 0.37 0.00 0.00 175.52 175.97 1n9a h ALA 157 N 0.86 0.54 -0.80 6.16 0.00 -0.24 -2.55 119.26 123.24 1n9a h ALA 157 Ca 0.09 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1n9a h ALA 157 Cb 0.38 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1n9a h ALA 157 CO 0.01 0.50 0.32 0.82 0.00 0.00 0.00 179.25 180.90 1n9a h ILE 158 N 0.62 1.26 -0.37 0.00 1.08 -1.18 -2.13 117.51 116.79 1n9a h ILE 158 Ca 0.08 -0.82 -0.11 0.00 -0.39 0.00 0.00 64.86 63.63 1n9a h ILE 158 Cb 0.76 0.31 -0.01 0.00 -3.07 0.00 0.00 36.82 34.80 1n9a h ILE 158 CO 0.06 0.34 -0.21 0.40 -0.69 0.00 0.00 178.15 178.05 1n9a h ILE 159 N 1.16 1.27 -0.35 -0.67 2.04 -1.21 -0.24 117.51 119.50 1n9a h ILE 159 Ca 0.27 -1.29 0.02 0.00 1.00 0.00 0.00 64.86 64.86 1n9a h ILE 159 Cb 0.21 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 1n9a h ILE 159 CO -0.02 0.43 0.23 -0.33 0.00 0.00 0.00 178.15 178.46 1n9a h GLU 160 N 0.62 0.38 0.17 2.37 4.39 -0.96 -0.21 114.58 121.35 1n9a h GLU 160 Ca 0.09 -0.02 -0.30 0.00 0.34 0.00 0.00 59.36 59.47 1n9a h GLU 160 Cb 0.69 -0.09 0.02 0.00 -0.10 0.00 0.00 28.75 29.28 1n9a h GLU 160 CO 0.05 0.25 -1.33 0.93 -1.16 0.00 0.00 179.01 177.75 1n9a h GLU 161 N 0.39 0.43 -2.11 2.33 5.08 -0.80 -3.40 114.58 116.51 1n9a h GLU 161 Ca 0.14 -0.70 -0.57 0.00 -1.00 0.00 0.00 59.36 57.22 1n9a h GLU 161 Cb 0.08 0.26 -0.40 0.00 0.50 0.00 0.00 28.75 29.19 1n9a h GLU 161 CO -0.03 1.33 -0.95 1.04 -1.00 0.00 0.00 179.01 179.40 1n9a n GLN 162 N -3.65 1.20 0.00 2.33 1.13 -0.17 -4.96 117.38 113.26 1n9a n GLN 162 Ca -0.12 -3.65 0.07 0.00 -1.94 0.00 0.00 57.00 51.36 1n9a n GLN 162 Cb 1.04 -1.56 0.42 0.00 0.11 0.00 0.00 30.24 30.26 1n9a n GLN 162 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 1n9a n PRO 163 N 1.36 0.53 -0.04 -1.09 -0.04 -0.13 -2.35 135.00 133.24 1n9a n PRO 163 Ca 0.24 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.75 1n9a n PRO 163 Cb 0.49 -1.41 0.07 0.00 -0.04 0.00 0.00 33.50 32.61 1n9a n PRO 163 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1n9a n LYS 164 N -0.91 2.04 -3.29 0.54 5.02 -1.26 -4.74 118.16 115.56 1n9a n LYS 164 Ca 0.11 -2.04 -0.39 0.00 -2.02 0.00 0.00 58.31 53.97 1n9a n LYS 164 Cb 0.05 -1.25 -0.06 0.00 -0.02 0.00 0.00 35.03 33.75 1n9a n LYS 164 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1n9a s ASN 165 N -1.96 6.99 0.13 4.39 3.84 -0.99 -4.99 114.94 122.34 1n9a s ASN 165 Ca 0.17 1.17 -0.04 0.00 0.21 0.00 0.00 52.86 54.36 1n9a s ASN 165 Cb 0.14 -2.34 -0.09 0.00 -0.55 0.00 0.00 41.25 38.41 1n9a s ASN 165 CO 0.02 0.23 1.30 1.88 -2.79 0.00 0.00 177.10 177.74 1n9a h TYR 166 N 4.94 0.61 -0.25 0.43 -1.99 -1.94 -3.34 116.97 115.43 1n9a h TYR 166 Ca -0.48 -0.33 -0.15 0.00 2.00 0.00 0.00 58.73 59.76 1n9a h TYR 166 Cb 1.21 -0.07 -0.01 0.00 2.00 0.00 0.00 36.73 39.86 1n9a h TYR 166 CO 0.67 1.15 -0.46 1.96 -0.00 0.00 0.00 178.16 181.49 1n9a h GLN 167 N 0.23 0.66 -0.55 4.88 7.50 -1.94 -2.96 115.11 122.93 1n9a h GLN 167 Ca -0.08 -0.37 -0.11 0.00 0.50 0.00 0.00 58.65 58.59 1n9a h GLN 167 Cb 1.58 0.02 -0.02 0.00 0.05 0.00 0.00 27.48 29.11 1n9a h GLN 167 CO 0.16 0.98 -0.10 -0.39 -1.50 0.00 0.00 178.83 177.99 1n9a h VAL 168 N 0.53 1.27 -0.37 -0.54 -1.51 -1.87 0.43 116.25 114.18 1n9a h VAL 168 Ca 0.03 -1.26 -0.13 0.00 -1.23 0.00 0.00 66.70 64.11 1n9a h VAL 168 Cb 1.00 0.94 -0.01 0.00 -2.13 0.00 0.00 31.29 31.10 1n9a h VAL 168 CO 0.09 0.45 -0.27 -0.50 -1.23 0.00 0.00 177.57 176.12 1n9a h TRP 169 N 0.93 0.99 -0.35 5.19 4.06 -1.67 -2.22 115.95 122.87 1n9a h TRP 169 Ca 0.14 -0.27 -0.10 0.00 2.06 0.00 0.00 58.89 60.73 1n9a h TRP 169 Cb 0.67 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 28.60 1n9a h TRP 169 CO 0.05 1.05 -0.18 1.25 -3.56 0.00 0.00 178.44 177.05 1n9a h HIS 170 N 0.64 0.73 -0.61 0.49 2.76 -1.36 -1.22 115.15 116.57 1n9a h HIS 170 Ca 0.07 -0.14 -0.08 0.00 -2.20 0.00 0.00 60.37 58.01 1n9a h HIS 170 Cb 0.84 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.59 1n9a h HIS 170 CO 0.06 0.79 0.06 1.25 -1.30 0.00 0.00 177.93 178.79 1n9a h HIS 171 N 0.59 1.13 -0.75 5.26 -0.00 -0.80 -1.61 115.15 118.97 1n9a h HIS 171 Ca 0.09 -0.17 -0.06 0.00 -0.00 0.00 0.00 60.37 60.23 1n9a h HIS 171 Cb 0.64 -0.30 -0.03 0.00 -0.00 0.00 0.00 27.41 27.71 1n9a h HIS 171 CO 0.03 0.98 0.23 -0.09 -0.00 0.00 0.00 177.93 179.08 1n9a h ARG 172 N 0.95 1.17 -0.41 5.26 2.43 -0.99 -1.97 114.38 120.81 1n9a h ARG 172 Ca 0.18 -0.25 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 1n9a h ARG 172 Cb 0.49 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1n9a h ARG 172 CO 0.02 0.99 -0.00 -0.09 -1.51 0.00 0.00 179.97 179.38 1n9a h ARG 173 N 1.12 0.67 -0.48 0.20 2.43 -0.91 -1.59 114.38 115.82 1n9a h ARG 173 Ca 0.24 -0.16 -0.08 0.00 -0.81 0.00 0.00 59.98 59.17 1n9a h ARG 173 Cb 0.31 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1n9a h ARG 173 CO -0.01 0.68 -0.02 0.28 -1.51 0.00 0.00 179.97 179.40 1n9a h VAL 174 N 0.63 1.26 -0.23 0.20 2.07 -0.77 -1.95 116.25 117.47 1n9a h VAL 174 Ca 0.13 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 1n9a h VAL 174 Cb 0.40 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1n9a h VAL 174 CO 0.01 0.38 0.11 -0.07 0.02 0.00 0.00 177.57 178.03 1n9a h LEU 175 N 0.72 0.29 -1.57 2.57 3.38 -0.97 0.28 115.31 120.02 1n9a h LEU 175 Ca 0.13 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.02 1n9a h LEU 175 Cb 0.54 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1n9a h LEU 175 CO 0.03 0.32 0.33 0.58 0.09 0.00 0.00 178.44 179.79 1n9a h VAL 176 N 0.24 1.06 -0.15 1.22 2.07 -1.22 0.26 116.25 119.73 1n9a h VAL 176 Ca 0.08 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.30 1n9a h VAL 176 Cb 0.10 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1n9a h VAL 176 CO -0.01 0.10 -0.31 -0.33 0.02 0.00 0.00 177.57 177.05 1n9a h GLU 177 N 0.57 0.48 -0.71 1.57 5.08 -0.87 0.62 114.58 121.32 1n9a h GLU 177 Ca 0.20 -0.31 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1n9a h GLU 177 Cb 0.08 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 1n9a h GLU 177 CO -0.05 0.91 0.45 -1.49 -1.00 0.00 0.00 179.01 177.83 1n9a h TRP 178 N 0.10 0.83 0.00 4.33 6.55 0.29 -2.39 115.95 125.67 1n9a h TRP 178 Ca 0.01 0.02 -0.00 0.00 0.95 0.00 0.00 58.89 59.86 1n9a h TRP 178 Cb 0.90 -0.27 -0.00 0.00 -0.86 0.00 0.00 29.16 28.93 1n9a h TRP 178 CO 0.10 0.47 -0.37 -0.07 -1.05 0.00 0.00 178.44 177.52 1n9a h LEU 179 N 0.87 0.00 0.50 -4.49 3.38 -0.50 -3.47 115.31 111.60 1n9a h LEU 179 Ca 0.29 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.85 1n9a h LEU 179 Cb 0.02 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.81 1n9a h LEU 179 CO -0.11 0.01 -0.62 0.29 0.09 0.00 0.00 178.44 178.10 1n9a n LYS 180 N -2.95 -5.15 -3.90 1.13 4.01 0.21 -4.96 118.16 106.55 1n9a n LYS 180 Ca 0.02 0.80 -0.31 0.00 -0.51 0.00 0.00 58.31 58.32 1n9a n LYS 180 Cb 0.54 -5.67 -0.15 0.00 -0.51 0.00 0.00 35.03 29.25 1n9a n LYS 180 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1n9a s ASP 181 N -2.84 4.44 0.00 4.39 2.15 -1.04 -4.96 116.67 118.81 1n9a s ASP 181 Ca 0.39 -1.92 0.20 0.00 0.43 0.00 0.00 52.55 51.65 1n9a s ASP 181 Cb -0.18 -1.31 0.55 0.00 -0.30 0.00 0.00 42.92 41.68 1n9a s ASP 181 CO 0.48 -0.39 1.46 -0.81 -0.17 0.00 0.00 175.17 175.75 1n9a n PRO 182 N 4.50 2.45 0.33 4.34 -0.04 -1.26 -4.60 135.00 140.72 1n9a n PRO 182 Ca 0.01 -2.25 0.22 0.00 -0.04 0.00 0.00 63.50 61.44 1n9a n PRO 182 Cb 0.42 -1.49 1.18 0.00 -0.04 0.00 0.00 33.50 33.58 1n9a n PRO 182 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1n9a h SER 183 N 3.69 0.00 0.00 3.54 4.64 -1.99 -2.89 113.55 120.54 1n9a h SER 183 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1n9a h SER 183 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1n9a h SER 183 CO 0.00 0.00 -1.27 0.00 -0.87 0.00 0.00 176.83 174.69 1n9a n GLN 184 N -3.06 1.18 0.19 4.77 6.02 -1.26 -4.80 117.38 120.42 1n9a n GLN 184 Ca -0.03 -0.08 -0.17 0.00 -0.01 0.00 0.00 57.00 56.71 1n9a n GLN 184 Cb 0.08 -1.29 -0.10 0.00 1.02 0.00 0.00 30.24 29.96 1n9a n GLN 184 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1n9a h GLU 185 N 0.00 -0.82 -0.04 -1.09 4.39 -1.83 -1.79 114.58 113.40 1n9a h GLU 185 Ca 0.00 0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.74 1n9a h GLU 185 Cb 0.54 0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.38 1n9a h GLU 185 CO 0.00 -0.55 -0.04 -0.07 -1.16 0.00 0.00 179.01 177.19 1n9a h LEU 186 N -0.85 0.05 -0.21 1.33 3.38 -1.87 0.15 115.31 117.29 1n9a h LEU 186 Ca -0.03 -0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.72 1n9a h LEU 186 Cb 0.80 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1n9a h LEU 186 CO -0.20 0.10 -0.91 -0.08 0.09 0.00 0.00 178.44 177.44 1n9a h GLU 187 N 0.05 0.42 -0.01 1.13 4.81 -1.86 -1.83 114.58 117.29 1n9a h GLU 187 Ca 0.01 -0.43 -0.01 0.00 -0.13 0.00 0.00 59.36 58.81 1n9a h GLU 187 Cb 0.10 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1n9a h GLU 187 CO 0.01 1.09 -0.03 0.35 -0.73 0.00 0.00 179.01 179.70 1n9a h PHE 188 N 0.24 0.05 0.01 0.92 3.57 -0.50 -2.76 116.94 118.48 1n9a h PHE 188 Ca -0.07 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.44 1n9a h PHE 188 Cb 1.53 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 40.22 1n9a h PHE 188 CO 0.06 0.62 -0.25 0.82 -2.23 0.00 0.00 178.31 177.32 1n9a h ILE 189 N -0.53 0.43 -0.53 1.41 2.04 -1.07 0.86 117.51 120.12 1n9a h ILE 189 Ca 0.00 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.01 1n9a h ILE 189 Cb 0.61 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1n9a h ILE 189 CO 0.01 0.00 0.46 0.00 0.00 0.00 0.00 178.15 178.62 1n9a h ALA 190 N 0.43 2.35 -0.00 1.87 0.00 -1.38 0.42 119.26 122.94 1n9a h ALA 190 Ca 0.06 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.73 1n9a h ALA 190 Cb 0.47 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1n9a h ALA 190 CO -0.21 -0.73 -0.94 0.22 0.00 0.00 0.00 179.25 177.59 1n9a h ASP 191 N 0.00 0.52 -0.19 0.00 3.58 -0.55 -2.07 116.42 117.71 1n9a h ASP 191 Ca 0.25 -0.41 -0.11 0.00 0.42 0.00 0.00 57.03 57.18 1n9a h ASP 191 Cb 1.17 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 42.06 1n9a h ASP 191 CO -0.00 1.21 -0.30 0.40 -2.88 0.00 0.00 179.24 177.67 1n9a h ILE 192 N 0.22 1.34 0.00 2.25 1.08 0.42 -2.48 117.51 120.35 1n9a h ILE 192 Ca -0.08 -1.52 0.00 0.00 -0.39 0.00 0.00 64.86 62.87 1n9a h ILE 192 Cb 1.57 1.87 0.00 0.00 -3.07 0.00 0.00 36.82 37.19 1n9a h ILE 192 CO 0.16 0.46 0.00 0.18 -0.69 0.00 0.00 178.15 178.27 1n9a n LEU 193 N -4.35 0.00 0.04 1.44 4.77 0.11 -0.88 117.00 118.13 1n9a n LEU 193 Ca -0.06 0.23 0.02 0.00 -0.03 0.00 0.00 56.01 56.17 1n9a n LEU 193 Cb 0.47 -0.23 -0.07 0.00 -2.33 0.00 0.00 43.42 41.27 1n9a n LEU 193 CO 0.43 -0.14 -0.26 -3.20 -1.33 0.00 0.00 177.39 172.90 1n9a n ASN 194 N -1.23 0.85 0.01 -1.43 4.05 -0.78 -2.35 115.26 114.38 1n9a n ASN 194 Ca 0.06 0.36 -0.04 0.00 0.45 0.00 0.00 54.58 55.42 1n9a n ASN 194 Cb 0.08 0.23 -0.11 0.00 1.23 0.00 0.00 39.78 41.21 1n9a n ASN 194 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1n9a n GLN 195 N -2.85 0.63 -3.27 1.20 6.02 -0.06 -4.73 117.38 114.31 1n9a n GLN 195 Ca -0.08 0.25 -0.06 0.00 -0.01 0.00 0.00 57.00 57.09 1n9a n GLN 195 Cb 0.80 -1.80 -0.04 0.00 1.02 0.00 0.00 30.24 30.22 1n9a n GLN 195 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1n9a s ASP 196 N -5.89 -0.41 0.00 1.08 -1.08 -0.54 -5.02 116.67 104.81 1n9a s ASP 196 Ca -0.04 -1.10 0.00 0.00 -0.52 0.00 0.00 52.55 50.89 1n9a s ASP 196 Cb 0.08 1.38 0.00 0.00 -1.46 0.00 0.00 42.92 42.92 1n9a s ASP 196 CO 0.82 -0.21 0.32 0.00 0.52 0.00 0.00 175.17 176.62 1n9a n ALA 197 N 4.36 1.16 -1.89 3.66 0.00 -0.99 -1.95 120.51 124.86 1n9a n ALA 197 Ca 0.11 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.58 1n9a n ALA 197 Cb 0.52 -0.78 0.04 0.00 0.00 0.00 0.00 19.45 19.24 1n9a n ALA 197 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1n9a n LYS 198 N -0.80 0.35 -1.72 0.00 5.02 -1.26 -4.84 118.16 114.89 1n9a n LYS 198 Ca 0.00 -1.63 -0.42 0.00 -2.02 0.00 0.00 58.31 54.24 1n9a n LYS 198 Cb 0.00 -0.67 -0.03 0.00 -0.02 0.00 0.00 35.03 34.31 1n9a n LYS 198 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1n9a s ASN 199 N -1.68 6.42 0.19 4.39 3.84 -0.82 -4.83 114.94 122.44 1n9a s ASN 199 Ca 0.15 2.55 -0.10 0.00 0.21 0.00 0.00 52.86 55.67 1n9a s ASN 199 Cb 0.15 -2.53 0.12 0.00 -0.55 0.00 0.00 41.25 38.44 1n9a s ASN 199 CO -0.03 -1.09 1.76 0.22 -2.79 0.00 0.00 177.10 175.16 1n9a h TYR 200 N 10.71 1.06 -0.71 0.43 3.20 -1.92 -2.20 116.97 127.53 1n9a h TYR 200 Ca -0.47 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.27 1n9a h TYR 200 Cb 1.23 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 39.15 1n9a h TYR 200 CO 0.95 0.81 0.27 0.45 -1.64 0.00 0.00 178.16 179.00 1n9a h HIS 201 N 0.99 1.09 -0.50 -3.82 3.86 -1.88 -1.03 115.15 113.86 1n9a h HIS 201 Ca 0.23 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.32 1n9a h HIS 201 Cb 0.20 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 28.32 1n9a h HIS 201 CO 0.01 0.85 0.20 0.00 0.86 0.00 0.00 177.93 179.85 1n9a h ALA 202 N 1.13 0.65 -0.38 2.45 0.00 -1.79 0.20 119.26 121.52 1n9a h ALA 202 Ca 0.23 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 1n9a h ALA 202 Cb 0.23 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1n9a h ALA 202 CO -0.02 0.27 -0.28 -1.49 0.00 0.00 0.00 179.25 177.73 1n9a h TRP 203 N 0.67 0.95 -0.40 0.00 4.06 -1.18 -0.61 115.95 119.44 1n9a h TRP 203 Ca 0.17 -0.24 -0.10 0.00 2.06 0.00 0.00 58.89 60.78 1n9a h TRP 203 Cb 0.20 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 28.14 1n9a h TRP 203 CO 0.01 1.00 -0.14 0.37 -3.56 0.00 0.00 178.44 176.12 1n9a h GLN 204 N 0.70 0.80 -0.62 0.49 4.15 -0.92 -0.37 115.11 119.34 1n9a h GLN 204 Ca 0.08 -0.32 -0.09 0.00 0.77 0.00 0.00 58.65 59.09 1n9a h GLN 204 Cb 0.82 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.45 1n9a h GLN 204 CO 0.07 0.95 0.04 1.25 -1.93 0.00 0.00 178.83 179.20 1n9a h HIS 205 N 0.61 1.15 -0.23 3.99 2.76 -0.53 -2.57 115.15 120.34 1n9a h HIS 205 Ca 0.10 -0.18 0.03 0.00 -2.20 0.00 0.00 60.37 58.11 1n9a h HIS 205 Cb 0.67 -0.30 -0.03 0.00 1.55 0.00 0.00 27.41 29.30 1n9a h HIS 205 CO 0.05 1.00 0.07 -0.09 -1.30 0.00 0.00 177.93 177.66 1n9a h ARG 206 N 0.97 0.16 -0.04 5.26 2.43 -0.71 -1.65 114.38 120.80 1n9a h ARG 206 Ca 0.18 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.35 1n9a h ARG 206 Cb 0.51 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1n9a h ARG 206 CO 0.02 0.11 0.03 1.96 -1.51 0.00 0.00 179.97 180.58 1n9a h GLN 207 N 0.16 0.00 -0.09 0.20 4.20 -0.90 -1.70 115.11 116.99 1n9a h GLN 207 Ca 0.10 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.72 1n9a h GLN 207 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1n9a h GLN 207 CO -0.12 0.00 -0.29 2.35 -0.67 0.00 0.00 178.83 180.10 1n9a h TRP 208 N 0.00 0.47 -0.90 2.96 7.01 -0.95 -1.08 115.95 123.46 1n9a h TRP 208 Ca 0.02 -0.19 0.00 0.00 2.11 0.00 0.00 58.89 60.83 1n9a h TRP 208 Cb 0.08 -0.08 -0.04 0.00 -2.10 0.00 0.00 29.16 27.02 1n9a h TRP 208 CO 0.00 0.91 0.58 0.28 -2.79 0.00 0.00 178.44 177.42 1n9a h VAL 209 N -0.11 1.24 -0.10 2.65 2.07 -0.68 -0.40 116.25 120.91 1n9a h VAL 209 Ca -0.01 -0.46 -0.03 0.00 0.82 0.00 0.00 66.70 67.02 1n9a h VAL 209 Cb 0.92 -0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1n9a h VAL 209 CO 0.06 0.23 -0.05 0.40 0.02 0.00 0.00 177.57 178.23 1n9a h ILE 210 N 1.22 1.33 0.49 4.57 2.04 -1.37 -2.13 117.51 123.67 1n9a h ILE 210 Ca 0.33 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.07 1n9a h ILE 210 Cb -0.11 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1n9a h ILE 210 CO -0.07 0.31 -0.24 -0.61 0.00 0.00 0.00 178.15 177.55 1n9a h GLN 211 N -0.15 -0.63 -0.34 2.37 4.15 -1.00 0.17 115.11 119.68 1n9a h GLN 211 Ca 0.02 0.04 0.07 0.00 0.77 0.00 0.00 58.65 59.56 1n9a h GLN 211 Cb 0.52 0.14 -0.07 0.00 0.21 0.00 0.00 27.48 28.28 1n9a h GLN 211 CO 0.02 -0.42 -0.14 0.93 -1.93 0.00 0.00 178.83 177.29 1n9a h GLU 212 N -0.70 -0.07 -0.35 1.69 4.39 -1.20 -2.28 114.58 116.07 1n9a h GLU 212 Ca -0.07 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1n9a h GLU 212 Cb 0.50 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 1n9a h GLU 212 CO 0.11 -0.05 0.00 1.19 -1.16 0.00 0.00 179.01 179.10 1n9a n PHE 213 N -5.32 0.46 -3.86 4.33 3.01 -0.80 -4.95 117.46 110.33 1n9a n PHE 213 Ca 0.01 -0.23 -0.26 0.00 1.01 0.00 0.00 57.45 57.98 1n9a n PHE 213 Cb 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.70 1n9a n PHE 213 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1n9a n ARG 214 N 0.73 -3.18 -2.26 -1.08 1.74 0.41 -4.89 116.66 108.14 1n9a n ARG 214 Ca 0.16 0.45 -0.39 0.00 -0.77 0.00 0.00 57.85 57.30 1n9a n ARG 214 Cb 0.39 -4.55 0.03 0.00 -1.02 0.00 0.00 32.46 27.30 1n9a n ARG 214 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1n9a n LEU 215 N -4.34 7.14 0.11 0.55 4.77 -0.19 -4.79 117.00 120.24 1n9a n LEU 215 Ca -0.27 -5.10 -0.01 0.00 -0.03 0.00 0.00 56.01 50.60 1n9a n LEU 215 Cb 0.67 -1.04 -0.01 0.00 -2.33 0.00 0.00 43.42 40.70 1n9a n LEU 215 CO 0.72 1.92 0.35 -0.50 -1.33 0.00 0.00 177.39 178.56 1n9a h TRP 216 N 3.40 0.00 -0.80 -1.77 4.06 -1.90 -3.42 115.95 115.51 1n9a h TRP 216 Ca 0.52 0.00 0.19 0.00 2.06 0.00 0.00 58.89 61.66 1n9a h TRP 216 Cb 0.21 0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 28.24 1n9a h TRP 216 CO 1.20 0.69 0.17 -0.44 -3.56 0.00 0.00 178.44 176.49 1n9a h ASP 217 N 0.00 -0.06 -0.49 -3.49 3.45 -1.99 -2.87 116.42 110.97 1n9a h ASP 217 Ca -0.01 0.18 0.00 0.00 0.43 0.00 0.00 57.03 57.63 1n9a h ASP 217 Cb 1.51 0.25 0.00 0.00 -0.56 0.00 0.00 39.33 40.53 1n9a h ASP 217 CO 0.09 -0.11 0.00 0.59 -1.57 0.00 0.00 179.24 178.24 1n9a n ASN 218 N -5.22 3.45 0.12 6.45 4.13 -1.26 -4.61 115.26 118.32 1n9a n ASN 218 Ca 0.17 -2.10 -0.03 0.00 1.68 0.00 0.00 54.58 54.31 1n9a n ASN 218 Cb 0.55 -0.36 0.12 0.00 -1.54 0.00 0.00 39.78 38.55 1n9a n ASN 218 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1n9a h GLU 219 N 2.88 0.01 -0.01 3.52 4.57 -1.77 -2.83 114.58 120.95 1n9a h GLU 219 Ca 0.00 -0.01 -0.11 0.00 -1.18 0.00 0.00 59.36 58.06 1n9a h GLU 219 Cb 0.91 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.49 1n9a h GLU 219 CO 0.03 0.69 -0.52 1.25 -1.18 0.00 0.00 179.01 179.28 1n9a h LEU 220 N 0.01 0.02 -0.97 1.64 5.85 -1.81 -0.87 115.31 119.16 1n9a h LEU 220 Ca -0.01 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.60 1n9a h LEU 220 Cb 1.21 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 1n9a h LEU 220 CO 0.09 0.54 -0.37 1.56 -0.34 0.00 0.00 178.44 179.92 1n9a h GLN 221 N 0.01 0.28 -0.13 1.25 7.50 -1.84 -1.70 115.11 120.49 1n9a h GLN 221 Ca -0.00 -0.12 -0.06 0.00 0.50 0.00 0.00 58.65 58.97 1n9a h GLN 221 Cb 0.93 -0.01 -0.00 0.00 0.05 0.00 0.00 27.48 28.45 1n9a h GLN 221 CO 0.07 0.61 -0.15 -0.92 -1.50 0.00 0.00 178.83 176.94 1n9a h TYR 222 N 0.24 0.39 -0.58 2.96 3.20 -1.16 -2.36 116.97 119.66 1n9a h TYR 222 Ca 0.03 -0.12 0.04 0.00 3.14 0.00 0.00 58.73 61.81 1n9a h TYR 222 Cb 0.76 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.91 1n9a h TYR 222 CO 0.01 0.74 0.34 0.28 -1.64 0.00 0.00 178.16 177.90 1n9a h VAL 223 N -0.07 1.02 -0.69 1.81 2.07 -1.03 -0.45 116.25 118.90 1n9a h VAL 223 Ca 0.02 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 1n9a h VAL 223 Cb 0.69 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 1n9a h VAL 223 CO 0.04 0.12 0.32 0.44 0.02 0.00 0.00 177.57 178.51 1n9a h ASP 224 N 0.66 0.90 0.51 0.57 3.32 -1.29 0.13 116.42 121.21 1n9a h ASP 224 Ca 0.24 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1n9a h ASP 224 Cb 0.08 -0.23 0.01 0.00 0.22 0.00 0.00 39.33 39.40 1n9a h ASP 224 CO -0.13 0.77 -0.25 -0.61 -1.72 0.00 0.00 179.24 177.30 1n9a h GLN 225 N 0.98 -0.66 -0.05 3.56 4.15 -0.68 -1.78 115.11 120.64 1n9a h GLN 225 Ca 0.24 0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.67 1n9a h GLN 225 Cb 0.12 0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 1n9a h GLN 225 CO -0.03 -0.40 -0.12 -0.07 -1.93 0.00 0.00 178.83 176.28 1n9a h LEU 226 N -0.78 0.06 -1.00 -2.39 3.38 -0.90 -0.53 115.31 113.16 1n9a h LEU 226 Ca -0.07 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1n9a h LEU 226 Cb 0.57 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1n9a h LEU 226 CO 0.12 0.19 0.00 -0.07 0.09 0.00 0.00 178.44 178.77 1n9a h LEU 227 N 0.07 0.00 -0.03 1.67 3.38 -0.45 -1.41 115.31 118.54 1n9a h LEU 227 Ca 0.01 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.75 1n9a h LEU 227 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1n9a h LEU 227 CO 0.02 0.00 -1.06 0.50 0.09 0.00 0.00 178.44 177.99 1n9a h LYS 228 N 0.00 0.14 -0.17 1.13 3.64 -0.22 -2.80 116.57 118.29 1n9a h LYS 228 Ca 0.00 -0.22 -0.22 0.00 -1.27 0.00 0.00 60.65 58.94 1n9a h LYS 228 Cb 0.62 0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.52 1n9a h LYS 228 CO 0.00 1.06 -0.75 0.93 -2.27 0.00 0.00 179.45 178.43 1n9a h GLU 229 N 0.05 0.81 -1.45 1.90 5.08 -0.83 -3.42 114.58 116.72 1n9a h GLU 229 Ca -0.06 -0.64 -0.18 0.00 -1.00 0.00 0.00 59.36 57.47 1n9a h GLU 229 Cb 1.78 0.13 -0.25 0.00 0.50 0.00 0.00 28.75 30.90 1n9a h GLU 229 CO 0.16 1.25 -0.54 0.34 -1.00 0.00 0.00 179.01 179.22 1n9a s ASP 230 N -7.09 -0.28 0.11 1.42 -1.08 -0.61 -4.99 116.67 104.15 1n9a s ASP 230 Ca -0.10 -0.90 0.10 0.00 -0.52 0.00 0.00 52.55 51.13 1n9a s ASP 230 Cb 0.09 1.34 0.49 0.00 -1.46 0.00 0.00 42.92 43.37 1n9a s ASP 230 CO 0.90 -0.25 1.30 0.55 0.52 0.00 0.00 175.17 178.20 1n9a n VAL 231 N 4.62 1.50 0.21 1.11 3.14 -1.06 -0.44 118.33 127.42 1n9a n VAL 231 Ca 0.09 0.51 0.08 0.00 -2.96 0.00 0.00 64.34 62.06 1n9a n VAL 231 Cb 0.51 -1.47 0.24 0.00 -1.06 0.00 0.00 33.84 32.06 1n9a n VAL 231 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1n9a n ARG 232 N -1.77 2.48 -2.62 1.45 1.74 -1.26 -4.77 116.66 111.91 1n9a n ARG 232 Ca 0.00 -1.95 -0.42 0.00 -0.77 0.00 0.00 57.85 54.72 1n9a n ARG 232 Cb 0.05 -1.52 -0.03 0.00 -1.02 0.00 0.00 32.46 29.95 1n9a n ARG 232 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1n9a s ASN 233 N -0.92 6.54 0.57 0.55 3.84 0.41 -4.85 114.94 121.09 1n9a s ASN 233 Ca 0.36 -1.61 0.30 0.00 0.21 0.00 0.00 52.86 52.12 1n9a s ASN 233 Cb 0.20 -2.54 1.45 0.00 -0.55 0.00 0.00 41.25 39.81 1n9a s ASN 233 CO 0.22 -1.42 1.85 -1.13 -2.79 0.00 0.00 177.10 173.84 1n9a h ASN 234 N 9.51 0.00 -0.02 -4.21 -1.24 -1.88 0.12 115.58 117.86 1n9a h ASN 234 Ca 0.21 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 57.13 1n9a h ASN 234 Cb 1.00 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.04 1n9a h ASN 234 CO 1.38 0.00 -0.24 0.28 -1.29 0.00 0.00 177.43 177.56 1n9a h SER 235 N 0.00 0.42 0.17 1.15 0.02 -1.89 -0.49 113.55 112.93 1n9a h SER 235 Ca 0.32 -0.14 -0.28 0.00 -0.84 0.00 0.00 61.79 60.85 1n9a h SER 235 Cb 1.51 -0.11 0.02 0.00 0.14 0.00 0.00 62.40 63.96 1n9a h SER 235 CO -0.00 0.67 -1.15 0.58 -1.14 0.00 0.00 176.83 175.78 1n9a h VAL 236 N 0.38 1.32 -0.76 2.27 2.07 -1.09 -0.03 116.25 120.40 1n9a h VAL 236 Ca 0.06 -2.45 -0.04 0.00 0.82 0.00 0.00 66.70 65.09 1n9a h VAL 236 Cb 0.63 2.59 -0.03 0.00 -1.52 0.00 0.00 31.29 32.96 1n9a h VAL 236 CO 0.05 0.74 0.31 -0.50 0.02 0.00 0.00 177.57 178.19 1n9a h TRP 237 N 0.28 1.14 -0.51 1.57 4.06 -1.21 0.11 115.95 121.39 1n9a h TRP 237 Ca -0.15 -0.08 -0.06 0.00 2.06 0.00 0.00 58.89 60.66 1n9a h TRP 237 Cb 1.82 -0.34 -0.02 0.00 -1.00 0.00 0.00 29.16 29.61 1n9a h TRP 237 CO 0.10 0.86 0.11 -0.97 -3.56 0.00 0.00 178.44 174.98 1n9a h ASN 238 N 1.09 0.80 -0.47 -3.49 -1.24 -1.05 -2.57 115.58 108.65 1n9a h ASN 238 Ca 0.25 -0.25 -0.01 0.00 0.71 0.00 0.00 56.30 57.01 1n9a h ASN 238 Cb 0.20 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 39.01 1n9a h ASN 238 CO -0.02 0.84 0.26 -0.61 -1.29 0.00 0.00 177.43 176.60 1n9a h GLN 239 N 0.72 0.68 -0.27 6.67 5.75 -0.23 0.70 115.11 129.13 1n9a h GLN 239 Ca 0.16 -0.07 -0.08 0.00 -0.15 0.00 0.00 58.65 58.51 1n9a h GLN 239 Cb 0.36 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.76 1n9a h GLN 239 CO 0.01 0.52 -0.16 -0.09 -2.65 0.00 0.00 178.83 176.45 1n9a h ARG 240 N 0.69 0.47 -0.02 1.69 2.43 -0.52 0.11 114.38 119.22 1n9a h ARG 240 Ca 0.18 -0.14 -0.23 0.00 -0.81 0.00 0.00 59.98 58.98 1n9a h ARG 240 Cb 0.04 -0.05 0.02 0.00 -0.42 0.00 0.00 29.97 29.57 1n9a h ARG 240 CO -0.03 0.62 -0.87 1.25 -1.51 0.00 0.00 179.97 179.43 1n9a h HIS 241 N 0.43 0.91 -0.25 2.20 2.76 -0.89 -1.36 115.15 118.96 1n9a h HIS 241 Ca 0.08 -0.48 0.04 0.00 -2.20 0.00 0.00 60.37 57.80 1n9a h HIS 241 Cb 0.53 -0.11 -0.04 0.00 1.55 0.00 0.00 27.41 29.34 1n9a h HIS 241 CO 0.02 1.31 -0.00 0.35 -1.30 0.00 0.00 177.93 178.31 1n9a h PHE 242 N 0.26 -0.01 0.67 5.26 3.57 -0.49 -0.75 116.94 125.44 1n9a h PHE 242 Ca -0.10 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.38 1n9a h PHE 242 Cb 1.54 0.04 0.01 0.00 2.79 0.00 0.00 35.95 40.33 1n9a h PHE 242 CO 0.11 -0.04 -0.32 0.28 -2.23 0.00 0.00 178.31 176.12 1n9a h VAL 243 N 0.08 0.17 0.01 1.41 2.07 -0.78 -2.69 116.25 116.51 1n9a h VAL 243 Ca 0.12 -0.29 0.02 0.00 0.82 0.00 0.00 66.70 67.37 1n9a h VAL 243 Cb 0.15 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 1n9a h VAL 243 CO -0.20 0.02 -0.10 0.40 0.02 0.00 0.00 177.57 177.72 1n9a h ILE 244 N -1.14 0.76 0.00 4.57 2.04 -1.23 -0.91 117.51 121.60 1n9a h ILE 244 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1n9a h ILE 244 Cb 0.72 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1n9a h ILE 244 CO 0.15 0.00 0.00 -1.54 0.00 0.00 0.00 178.15 176.76 1n9a n SER 245 N -5.22 0.50 -0.02 1.72 3.41 -0.29 -0.10 113.62 113.62 1n9a n SER 245 Ca -0.06 0.72 0.07 0.00 -0.26 0.00 0.00 58.87 59.34 1n9a n SER 245 Cb 0.14 -0.79 -0.08 0.00 -0.26 0.00 0.00 64.21 63.23 1n9a n SER 245 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1n9a n ASN 246 N -2.16 0.75 -0.01 4.04 4.13 -0.71 -4.42 115.26 116.88 1n9a n ASN 246 Ca -0.01 -0.87 -0.01 0.00 1.68 0.00 0.00 54.58 55.37 1n9a n ASN 246 Cb 0.06 0.97 -0.00 0.00 -1.54 0.00 0.00 39.78 39.26 1n9a n ASN 246 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1n9a n THR 247 N -1.28 0.26 -0.09 3.41 -2.24 -0.43 -4.92 114.28 109.00 1n9a n THR 247 Ca 0.03 0.30 -0.10 0.00 -2.27 0.00 0.00 64.05 62.02 1n9a n THR 247 Cb 0.24 -1.46 -0.12 0.00 -2.10 0.00 0.00 70.33 66.88 1n9a n THR 247 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1n9a n THR 248 N -2.80 1.17 0.00 4.28 -2.24 -0.55 -5.09 114.28 109.05 1n9a n THR 248 Ca -0.02 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 1n9a n THR 248 Cb 0.06 -0.72 0.00 0.00 -2.10 0.00 0.00 70.33 67.57 1n9a n THR 248 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n9a n GLY 249 N 2.09 -0.45 1.04 3.38 0.00 0.85 -4.68 105.19 107.43 1n9a n GLY 249 Ca -0.30 -1.74 0.09 0.00 0.00 0.00 0.00 46.02 44.07 1n9a n GLY 249 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1n9a n TYR 250 N -0.45 0.78 0.07 1.61 4.02 -1.26 -4.34 117.16 117.59 1n9a n TYR 250 Ca 0.00 -0.52 -0.11 0.00 -0.01 0.00 0.00 57.90 57.27 1n9a n TYR 250 Cb 0.00 -0.04 -0.02 0.00 -0.02 0.00 0.00 39.34 39.26 1n9a n TYR 250 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1n9a h SER 251 N 3.21 0.40 -2.18 7.72 4.64 -1.98 -3.39 113.55 121.97 1n9a h SER 251 Ca 0.00 -0.31 -0.58 0.00 -0.47 0.00 0.00 61.79 60.43 1n9a h SER 251 Cb 0.92 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1n9a h SER 251 CO 0.02 1.11 1.41 -0.62 -0.87 0.00 0.00 176.83 177.87 1n9a s ASP 252 N -7.00 5.71 0.32 4.97 -1.08 -1.26 -4.86 116.67 113.47 1n9a s ASP 252 Ca -0.04 1.92 0.08 0.00 -0.52 0.00 0.00 52.55 53.98 1n9a s ASP 252 Cb 0.10 -2.52 0.91 0.00 -1.46 0.00 0.00 42.92 39.95 1n9a s ASP 252 CO 0.85 -1.76 1.61 0.03 0.52 0.00 0.00 175.17 176.42 1n9a h ARG 253 N 13.88 0.11 -0.40 4.34 3.08 -1.97 0.37 114.38 133.79 1n9a h ARG 253 Ca -0.41 -0.01 -0.08 0.00 0.07 0.00 0.00 59.98 59.55 1n9a h ARG 253 Cb 1.22 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 1n9a h ARG 253 CO 0.97 0.07 -0.06 0.00 -1.07 0.00 0.00 179.97 179.87 1n9a h ALA 254 N 1.90 0.54 0.16 0.04 0.00 -1.96 -0.07 119.26 119.87 1n9a h ALA 254 Ca 0.65 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 1n9a h ALA 254 Cb 1.47 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1n9a h ALA 254 CO -0.76 0.38 -0.08 0.28 0.00 0.00 0.00 179.25 179.07 1n9a h VAL 255 N 0.56 0.95 -0.29 0.00 2.07 -1.14 0.62 116.25 119.02 1n9a h VAL 255 Ca 0.10 -0.52 0.07 0.00 0.82 0.00 0.00 66.70 67.17 1n9a h VAL 255 Cb 0.57 1.27 -0.07 0.00 -1.52 0.00 0.00 31.29 31.54 1n9a h VAL 255 CO 0.03 0.12 -0.21 0.25 0.02 0.00 0.00 177.57 177.79 1n9a h LEU 256 N -0.46 -0.67 -0.24 2.57 5.85 -0.33 0.92 115.31 122.94 1n9a h LEU 256 Ca -0.02 0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.87 1n9a h LEU 256 Cb 0.36 0.34 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 1n9a h LEU 256 CO 0.04 -0.24 0.04 -0.08 -0.34 0.00 0.00 178.44 177.85 1n9a h GLU 257 N -0.18 0.13 -0.66 1.25 4.57 -0.93 -0.35 114.58 118.40 1n9a h GLU 257 Ca 0.15 -0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.40 1n9a h GLU 257 Cb 0.42 -0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 28.92 1n9a h GLU 257 CO -0.40 0.08 0.34 -0.09 -1.18 0.00 0.00 179.01 177.76 1n9a h ARG 258 N 0.13 0.59 0.67 1.92 2.43 -0.10 -0.27 114.38 119.76 1n9a h ARG 258 Ca 0.11 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1n9a h ARG 258 Cb 0.11 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1n9a h ARG 258 CO -0.15 0.39 -0.32 0.93 -1.51 0.00 0.00 179.97 179.31 1n9a h GLU 259 N 0.61 -0.87 -0.87 0.20 4.39 -0.26 -1.45 114.58 116.33 1n9a h GLU 259 Ca 0.31 0.06 0.10 0.00 0.34 0.00 0.00 59.36 60.17 1n9a h GLU 259 Cb 0.27 0.20 -0.06 0.00 -0.10 0.00 0.00 28.75 29.06 1n9a h GLU 259 CO -0.23 -0.55 0.56 0.28 -1.16 0.00 0.00 179.01 177.92 1n9a h VAL 260 N -1.04 0.97 0.51 3.13 2.07 -0.91 0.20 116.25 121.18 1n9a h VAL 260 Ca -0.09 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 1n9a h VAL 260 Cb 0.72 0.04 0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1n9a h VAL 260 CO 0.15 0.16 -0.25 -0.61 0.02 0.00 0.00 177.57 177.04 1n9a h GLN 261 N 0.85 -0.66 -0.86 1.57 5.75 -0.97 0.37 115.11 121.16 1n9a h GLN 261 Ca 0.40 0.05 0.07 0.00 -0.15 0.00 0.00 58.65 59.01 1n9a h GLN 261 Cb 0.41 0.15 -0.06 0.00 1.07 0.00 0.00 27.48 29.05 1n9a h GLN 261 CO -0.17 -0.41 0.53 -0.92 -2.65 0.00 0.00 178.83 175.21 1n9a h TYR 262 N -0.76 0.98 -0.13 3.99 3.20 -0.66 -0.31 116.97 123.28 1n9a h TYR 262 Ca -0.07 0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.63 1n9a h TYR 262 Cb 0.56 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.52 1n9a h TYR 262 CO -0.02 0.48 -0.71 1.15 -1.64 0.00 0.00 178.16 177.42 1n9a h THR 263 N 0.95 1.33 0.00 1.81 2.02 -0.47 -1.48 112.91 117.07 1n9a h THR 263 Ca 0.38 -2.02 -0.05 0.00 0.77 0.00 0.00 66.41 65.50 1n9a h THR 263 Cb 0.21 2.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 1n9a h THR 263 CO -0.19 0.62 -0.23 -0.07 0.37 0.00 0.00 175.52 176.02 1n9a h LEU 264 N 0.40 0.00 0.69 2.58 3.38 0.32 -1.67 115.31 121.02 1n9a h LEU 264 Ca -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1n9a h LEU 264 Cb 1.30 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.06 1n9a h LEU 264 CO 0.13 0.23 -0.33 -0.33 0.09 0.00 0.00 178.44 178.24 1n9a h GLU 265 N 0.00 -0.89 -0.15 1.13 3.07 -0.66 0.88 114.58 117.95 1n9a h GLU 265 Ca -0.00 0.06 0.04 0.00 -0.50 0.00 0.00 59.36 58.96 1n9a h GLU 265 Cb 0.49 0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.60 1n9a h GLU 265 CO 0.03 -0.58 0.28 0.52 -1.40 0.00 0.00 179.01 177.86 1n9a h MET 266 N -1.21 0.00 0.04 2.33 2.86 -1.03 -0.21 114.93 117.71 1n9a h MET 266 Ca -0.09 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.44 1n9a h MET 266 Cb 0.73 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.39 1n9a h MET 266 CO 0.16 0.00 -0.52 0.82 1.06 0.00 0.00 176.91 178.43 1n9a h ILE 267 N 0.00 1.52 -0.30 -1.22 2.04 -1.11 -1.89 117.51 116.55 1n9a h ILE 267 Ca 0.07 -2.37 -0.39 0.00 1.00 0.00 0.00 64.86 63.18 1n9a h ILE 267 Cb 0.62 3.10 -0.08 0.00 -0.74 0.00 0.00 36.82 39.73 1n9a h ILE 267 CO -0.00 0.60 0.79 0.29 0.00 0.00 0.00 178.15 179.83 1n9a n LYS 268 N -4.41 2.61 0.00 2.37 5.02 0.29 -0.60 118.16 123.43 1n9a n LYS 268 Ca -0.16 -1.69 0.00 0.00 -2.02 0.00 0.00 58.31 54.44 1n9a n LYS 268 Cb 0.63 -2.23 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 1n9a n LYS 268 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1n9a n LEU 269 N 2.32 0.00 -3.16 -0.35 0.00 -0.99 -4.88 117.00 109.93 1n9a n LEU 269 Ca 0.53 0.00 -0.20 0.00 0.00 0.00 0.00 56.01 56.34 1n9a n LEU 269 Cb 0.66 0.23 -0.04 0.00 0.00 0.00 0.00 43.42 44.28 1n9a n LEU 269 CO 0.35 -0.25 -0.18 0.52 0.00 0.00 0.00 177.39 177.82 1n9a n VAL 270 N -2.00 0.26 -0.15 1.96 0.31 -0.71 -5.00 118.33 112.99 1n9a n VAL 270 Ca 0.00 -4.68 0.25 0.00 -0.01 0.00 0.00 64.34 59.90 1n9a n VAL 270 Cb 0.00 -0.59 0.42 0.00 -0.91 0.00 0.00 33.84 32.76 1n9a n VAL 270 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1n9a h PRO 271 N 3.10 0.00 -0.55 5.55 0.13 -1.06 0.33 132.00 139.51 1n9a h PRO 271 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1n9a h PRO 271 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1n9a h PRO 271 CO 0.54 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.03 1n9a n HIS 272 N -3.21 0.72 -2.72 1.56 8.25 -1.26 -4.74 115.22 113.82 1n9a n HIS 272 Ca 0.20 -0.38 -0.43 0.00 -0.26 0.00 0.00 57.72 56.86 1n9a n HIS 272 Cb 1.43 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 32.51 1n9a n HIS 272 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1n9a s ASN 273 N -1.23 6.63 0.28 0.41 2.47 0.12 -4.94 114.94 118.68 1n9a s ASN 273 Ca 0.43 0.44 0.03 0.00 0.42 0.00 0.00 52.86 54.17 1n9a s ASN 273 Cb 0.24 -2.50 0.43 0.00 -1.45 0.00 0.00 41.25 37.96 1n9a s ASN 273 CO 0.32 -1.06 1.73 -0.08 -3.72 0.00 0.00 177.10 174.29 1n9a h GLU 274 N 8.90 0.48 -0.31 0.43 4.81 -1.88 -3.30 114.58 123.71 1n9a h GLU 274 Ca -0.23 -0.17 0.05 0.00 -0.13 0.00 0.00 59.36 58.88 1n9a h GLU 274 Cb 1.07 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.37 1n9a h GLU 274 CO 1.05 0.68 -0.00 0.77 -0.73 0.00 0.00 179.01 180.78 1n9a h SER 275 N 0.43 -0.13 -0.64 1.04 0.02 -1.91 -0.53 113.55 111.83 1n9a h SER 275 Ca 0.07 0.07 0.06 0.00 -0.84 0.00 0.00 61.79 61.15 1n9a h SER 275 Cb 0.64 0.13 -0.04 0.00 0.14 0.00 0.00 62.40 63.27 1n9a h SER 275 CO 0.05 -0.03 0.42 0.00 -1.14 0.00 0.00 176.83 176.13 1n9a h ALA 276 N 1.27 1.79 -0.21 3.77 0.00 -1.86 0.60 119.26 124.61 1n9a h ALA 276 Ca 0.15 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1n9a h ALA 276 Cb 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1n9a h ALA 276 CO -0.26 0.11 -0.24 -1.49 0.00 0.00 0.00 179.25 177.37 1n9a h TRP 277 N 0.63 0.66 0.00 0.00 4.06 -1.38 -0.93 115.95 118.99 1n9a h TRP 277 Ca 0.28 -0.21 -0.02 0.00 2.06 0.00 0.00 58.89 61.00 1n9a h TRP 277 Cb 0.28 -0.13 -0.00 0.00 -1.00 0.00 0.00 29.16 28.30 1n9a h TRP 277 CO -0.00 0.90 -0.10 -0.91 -3.56 0.00 0.00 178.44 174.77 1n9a h ASN 278 N 0.22 0.00 0.03 -3.49 2.35 -0.43 -1.34 115.58 112.92 1n9a h ASN 278 Ca 0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1n9a h ASN 278 Cb 0.80 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.17 1n9a h ASN 278 CO 0.06 0.10 -0.01 0.22 -1.65 0.00 0.00 177.43 176.14 1n9a h TYR 279 N 0.00 -0.04 -0.97 1.19 3.20 -0.73 -1.17 116.97 118.46 1n9a h TYR 279 Ca -0.00 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 61.96 1n9a h TYR 279 Cb 0.59 0.01 -0.07 0.00 1.54 0.00 0.00 36.73 38.80 1n9a h TYR 279 CO 0.00 0.58 0.62 1.25 -1.64 0.00 0.00 178.16 178.97 1n9a h LEU 280 N -0.96 0.94 -0.32 2.82 5.85 -1.10 0.17 115.31 122.71 1n9a h LEU 280 Ca -0.00 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.64 1n9a h LEU 280 Cb 0.63 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1n9a h LEU 280 CO 0.01 0.56 -0.21 0.50 -0.34 0.00 0.00 178.44 178.95 1n9a h LYS 281 N 1.04 0.71 -0.78 1.25 3.64 -1.33 -2.87 116.57 118.24 1n9a h LYS 281 Ca 0.45 -0.34 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1n9a h LYS 281 Cb 0.33 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.11 1n9a h LYS 281 CO -0.20 0.94 0.44 0.78 -2.27 0.00 0.00 179.45 179.15 1n9a h GLY 282 N 0.48 1.15 2.00 5.01 0.00 0.33 0.32 103.07 112.36 1n9a h GLY 282 Ca 0.07 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 1n9a h GLY 282 CO 0.06 0.49 -0.16 0.16 0.00 0.00 0.00 176.54 177.08 1n9a h ILE 283 N 1.07 0.30 0.00 2.60 3.07 -0.78 -3.37 117.51 120.41 1n9a h ILE 283 Ca 0.28 -1.26 -0.40 0.00 1.55 0.00 0.00 64.86 65.02 1n9a h ILE 283 Cb 0.01 2.01 -0.07 0.00 -0.27 0.00 0.00 36.82 38.50 1n9a h ILE 283 CO -0.05 0.16 -2.48 0.18 -1.05 0.00 0.00 178.15 174.91 1n9a n LEU 284 N -3.17 2.85 0.00 0.16 4.77 -1.09 -4.39 117.00 116.13 1n9a n LEU 284 Ca 0.02 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1n9a n LEU 284 Cb 0.54 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 1n9a n LEU 284 CO 0.35 0.89 0.47 0.00 -1.33 0.00 0.00 177.39 177.77 1n9a n GLN 285 N -3.38 0.00 -2.85 3.23 10.64 0.11 -1.93 117.38 123.19 1n9a n GLN 285 Ca -0.47 0.32 -0.38 0.00 -1.83 0.00 0.00 57.00 54.64 1n9a n GLN 285 Cb 0.98 -1.64 -0.00 0.00 -0.86 0.00 0.00 30.24 28.71 1n9a n GLN 285 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1n9a n ASP 286 N -1.31 6.29 0.00 2.61 2.03 -1.26 -3.91 116.55 121.00 1n9a n ASP 286 Ca 0.00 -3.61 0.00 0.00 0.52 0.00 0.00 54.79 51.70 1n9a n ASP 286 Cb 0.14 -1.03 0.00 0.00 -0.72 0.00 0.00 41.12 39.51 1n9a n ASP 286 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1n9a n ARG 287 N 0.30 0.00 0.00 -0.67 0.00 -0.81 -5.08 116.66 110.40 1n9a n ARG 287 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.23 1n9a n ARG 287 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.77 1n9a n ARG 287 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1n9a n GLY 288 N 0.00 1.42 0.23 5.14 0.00 -1.06 -4.70 105.19 106.21 1n9a n GLY 288 Ca 0.00 -1.07 0.01 0.00 0.00 0.00 0.00 46.02 44.96 1n9a n GLY 288 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1n9a h LEU 289 N 0.00 0.28 0.00 0.99 4.07 -1.87 -2.14 115.31 116.64 1n9a h LEU 289 Ca 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.89 1n9a h LEU 289 Cb 0.00 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.67 1n9a h LEU 289 CO 0.00 0.49 0.00 -1.54 -1.08 0.00 0.00 178.44 176.31 1n9a n SER 290 N -4.20 0.00 -0.63 -0.43 3.41 -1.26 -1.69 113.62 108.82 1n9a n SER 290 Ca -0.01 0.01 0.09 0.00 -0.26 0.00 0.00 58.87 58.70 1n9a n SER 290 Cb 0.33 -0.27 0.29 0.00 -0.26 0.00 0.00 64.21 64.29 1n9a n SER 290 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1n9a n ARG 291 N -1.27 1.81 -3.82 4.33 1.74 -0.81 -4.42 116.66 114.22 1n9a n ARG 291 Ca 0.09 -1.24 -0.29 0.00 -0.77 0.00 0.00 57.85 55.64 1n9a n ARG 291 Cb 0.13 -1.36 -0.13 0.00 -1.02 0.00 0.00 32.46 30.09 1n9a n ARG 291 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1n9a s TYR 292 N -1.66 2.69 0.11 -1.55 1.51 -0.68 -5.00 117.35 112.77 1n9a s TYR 292 Ca 0.30 -2.88 -0.22 0.00 -1.01 0.00 0.00 57.07 53.25 1n9a s TYR 292 Cb 0.16 -2.35 -0.07 0.00 -0.11 0.00 0.00 41.96 39.58 1n9a s TYR 292 CO 0.23 -0.73 1.70 -1.00 -1.11 0.00 0.00 175.55 174.64 1n9a h PRO 293 N 6.35 -0.10 -0.53 -1.71 0.13 -1.81 -2.39 132.00 131.94 1n9a h PRO 293 Ca 0.00 0.01 0.12 0.00 -0.87 0.00 0.00 66.00 65.26 1n9a h PRO 293 Cb 0.88 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.01 1n9a h PRO 293 CO 0.60 -0.06 0.37 -0.91 -0.23 0.00 0.00 178.00 177.76 1n9a h ASN 294 N -0.10 0.15 0.00 1.44 4.21 -1.96 -3.19 115.58 116.14 1n9a h ASN 294 Ca 0.06 0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.57 1n9a h ASN 294 Cb 0.18 -0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.35 1n9a h ASN 294 CO -0.13 0.09 0.00 -0.11 -1.29 0.00 0.00 177.43 175.99 1n9a n LEU 295 N -4.43 0.00 -0.39 1.61 7.94 -0.90 -1.59 117.00 119.23 1n9a n LEU 295 Ca 0.09 0.97 0.32 0.00 -1.11 0.00 0.00 56.01 56.28 1n9a n LEU 295 Cb 0.48 -0.47 0.59 0.00 0.53 0.00 0.00 43.42 44.55 1n9a n LEU 295 CO 0.35 -0.47 1.19 0.25 -1.11 0.00 0.00 177.39 177.60 1n9a h LEU 296 N 0.00 0.33 0.11 -1.96 5.85 -1.71 -1.89 115.31 116.05 1n9a h LEU 296 Ca 0.00 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1n9a h LEU 296 Cb 0.00 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1n9a h LEU 296 CO 0.00 -0.17 -0.05 0.78 -0.34 0.00 0.00 178.44 178.65 1n9a h ASN 297 N 0.16 -0.13 -0.91 1.25 2.35 -1.44 -1.14 115.58 115.72 1n9a h ASN 297 Ca 0.78 0.00 0.26 0.00 -0.55 0.00 0.00 56.30 56.80 1n9a h ASN 297 Cb 2.24 0.03 -0.15 0.00 0.05 0.00 0.00 38.32 40.49 1n9a h ASN 297 CO -0.49 -0.06 0.30 1.56 -1.65 0.00 0.00 177.43 177.09 1n9a h GLN 298 N -0.21 0.21 -0.46 0.81 1.08 -0.92 0.73 115.11 116.34 1n9a h GLN 298 Ca -0.02 -0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.08 1n9a h GLN 298 Cb 0.12 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.48 1n9a h GLN 298 CO 0.03 0.14 -0.09 -0.07 -0.95 0.00 0.00 178.83 177.89 1n9a h LEU 299 N 0.21 0.81 -1.53 1.46 3.38 -1.42 -2.00 115.31 116.23 1n9a h LEU 299 Ca 0.60 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 58.28 1n9a h LEU 299 Cb 1.26 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1n9a h LEU 299 CO -0.67 0.93 -0.24 0.25 0.09 0.00 0.00 178.44 178.80 1n9a h LEU 300 N 0.75 0.00 -0.84 1.67 5.85 0.16 -1.91 115.31 121.00 1n9a h LEU 300 Ca 0.13 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 1n9a h LEU 300 Cb 0.58 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1n9a h LEU 300 CO 0.04 0.24 -0.33 0.44 -0.34 0.00 0.00 178.44 178.48 1n9a h ASP 301 N 0.00 0.49 0.20 1.25 3.32 0.07 -2.64 116.42 119.11 1n9a h ASP 301 Ca -0.00 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1n9a h ASP 301 Cb 0.52 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1n9a h ASP 301 CO 0.03 0.79 0.00 0.18 -1.72 0.00 0.00 179.24 178.53 1n9a n LEU 302 N -4.07 0.00 -0.25 1.55 4.77 -0.72 -4.21 117.00 114.07 1n9a n LEU 302 Ca -0.01 0.13 0.05 0.00 -0.03 0.00 0.00 56.01 56.15 1n9a n LEU 302 Cb 0.46 -0.13 0.16 0.00 -2.33 0.00 0.00 43.42 41.57 1n9a n LEU 302 CO 0.43 -0.03 0.84 1.56 -1.33 0.00 0.00 177.39 178.86 1n9a h GLN 303 N 0.00 0.12 0.00 3.23 1.08 -1.48 0.34 115.11 118.41 1n9a h GLN 303 Ca 0.00 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1n9a h GLN 303 Cb 0.10 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 1n9a h GLN 303 CO 0.00 0.08 -1.62 -0.35 -0.95 0.00 0.00 178.83 175.99 1n9a n PRO 304 N -5.31 0.66 0.02 1.46 -0.04 -1.26 -4.11 135.00 126.42 1n9a n PRO 304 Ca 0.13 -0.13 0.06 0.00 -0.04 0.00 0.00 63.50 63.52 1n9a n PRO 304 Cb 0.46 -1.43 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 1n9a n PRO 304 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1n9a n SER 305 N -1.98 0.43 -2.74 3.54 7.64 -1.05 -4.66 113.62 114.81 1n9a n SER 305 Ca -0.02 0.18 -0.03 0.00 1.01 0.00 0.00 58.87 60.01 1n9a n SER 305 Cb 0.44 1.02 0.09 0.00 -1.01 0.00 0.00 64.21 64.75 1n9a n SER 305 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1n9a n HIS 306 N -2.58 -0.47 -3.03 1.43 8.25 0.12 -5.07 115.22 113.86 1n9a n HIS 306 Ca -0.08 -2.04 -0.39 0.00 -0.26 0.00 0.00 57.72 54.95 1n9a n HIS 306 Cb 0.71 0.65 -0.06 0.00 1.12 0.00 0.00 29.99 32.41 1n9a n HIS 306 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1n9a s SER 307 N -2.39 7.29 0.22 0.41 0.15 -1.01 -4.82 113.70 113.54 1n9a s SER 307 Ca 0.20 1.57 -0.18 0.00 0.70 0.00 0.00 55.95 58.24 1n9a s SER 307 Cb 0.40 -2.47 0.02 0.00 -1.71 0.00 0.00 66.02 62.26 1n9a s SER 307 CO -0.07 0.17 0.57 -0.94 1.20 0.00 0.00 173.24 174.17 1n9a s SER 308 N -1.27 -0.25 0.00 5.45 1.04 -1.26 -4.94 113.70 112.46 1n9a s SER 308 Ca 0.37 -0.55 0.08 0.00 0.48 0.00 0.00 55.95 56.33 1n9a s SER 308 Cb -0.21 0.62 0.47 0.00 0.10 0.00 0.00 66.02 67.00 1n9a s SER 308 CO 0.24 -1.14 0.92 -0.81 0.98 0.00 0.00 173.24 173.44 1n9a n PRO 309 N -0.38 0.25 0.06 4.02 -0.04 -1.26 -1.41 135.00 136.24 1n9a n PRO 309 Ca -0.08 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.25 1n9a n PRO 309 Cb 0.62 -1.49 -0.14 0.00 -0.04 0.00 0.00 33.50 32.45 1n9a n PRO 309 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1n9a h TYR 310 N 0.00 0.28 0.03 0.54 0.99 -1.94 -1.35 116.97 115.52 1n9a h TYR 310 Ca 0.00 -0.21 -0.00 0.00 2.00 0.00 0.00 58.73 60.52 1n9a h TYR 310 Cb 0.00 -0.01 0.00 0.00 1.00 0.00 0.00 36.73 37.72 1n9a h TYR 310 CO 0.00 1.21 -0.01 1.25 -0.00 0.00 0.00 178.16 180.61 1n9a h LEU 311 N 0.04 -0.03 -0.81 3.88 5.85 -1.58 0.69 115.31 123.35 1n9a h LEU 311 Ca -0.16 -0.38 0.03 0.00 0.84 0.00 0.00 57.88 58.21 1n9a h LEU 311 Cb 1.94 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.93 1n9a h LEU 311 CO 0.15 0.37 0.51 0.40 -0.34 0.00 0.00 178.44 179.54 1n9a h ILE 312 N -0.44 1.12 -0.07 4.05 2.04 -1.63 0.17 117.51 122.74 1n9a h ILE 312 Ca -0.00 -0.34 -0.13 0.00 1.00 0.00 0.00 64.86 65.39 1n9a h ILE 312 Cb 0.41 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 1n9a h ILE 312 CO 0.01 0.18 -0.52 0.00 0.00 0.00 0.00 178.15 177.81 1n9a h ALA 313 N 1.34 0.98 -0.23 1.87 0.00 -1.11 -0.79 119.26 121.33 1n9a h ALA 313 Ca 0.32 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 1n9a h ALA 313 Cb 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1n9a h ALA 313 CO -0.12 0.67 -0.23 0.35 0.00 0.00 0.00 179.25 179.92 1n9a h PHE 314 N 0.16 0.67 -0.49 0.00 3.57 -0.21 -2.12 116.94 118.51 1n9a h PHE 314 Ca 0.00 -0.20 0.01 0.00 3.53 0.00 0.00 57.97 61.31 1n9a h PHE 314 Cb 0.98 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.55 1n9a h PHE 314 CO 0.02 0.89 0.32 -0.07 -2.23 0.00 0.00 178.31 177.23 1n9a h LEU 315 N 0.25 0.53 -2.34 0.59 3.38 -0.82 0.28 115.31 117.18 1n9a h LEU 315 Ca 0.04 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.02 1n9a h LEU 315 Cb 0.78 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 1n9a h LEU 315 CO 0.06 0.38 0.10 0.58 0.09 0.00 0.00 178.44 179.65 1n9a h VAL 316 N 0.64 0.50 0.04 1.22 2.07 -1.01 0.11 116.25 119.83 1n9a h VAL 316 Ca 0.19 0.00 -0.25 0.00 0.82 0.00 0.00 66.70 67.46 1n9a h VAL 316 Cb -0.04 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1n9a h VAL 316 CO -0.06 0.00 -1.22 0.44 0.02 0.00 0.00 177.57 176.75 1n9a h ASP 317 N 0.00 0.13 0.43 0.57 3.32 0.14 -2.64 116.42 118.37 1n9a h ASP 317 Ca 0.04 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1n9a h ASP 317 Cb 0.24 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1n9a h ASP 317 CO -0.00 1.13 -0.21 0.40 -1.72 0.00 0.00 179.24 178.84 1n9a h ILE 318 N 0.02 0.19 -0.95 0.35 2.04 1.00 -3.01 117.51 117.15 1n9a h ILE 318 Ca -0.11 -0.60 0.29 0.00 1.00 0.00 0.00 64.86 65.44 1n9a h ILE 318 Cb 1.88 0.29 -0.16 0.00 -0.74 0.00 0.00 36.82 38.09 1n9a h ILE 318 CO 0.14 0.04 0.26 1.88 0.00 0.00 0.00 178.15 180.47 1n9a h TYR 319 N -1.09 0.37 -0.86 1.37 0.99 -0.98 0.81 116.97 117.58 1n9a h TYR 319 Ca -0.06 0.05 0.12 0.00 2.00 0.00 0.00 58.73 60.84 1n9a h TYR 319 Cb 0.51 -0.01 -0.08 0.00 1.00 0.00 0.00 36.73 38.15 1n9a h TYR 319 CO 0.01 -0.34 0.49 0.93 -0.00 0.00 0.00 178.16 179.25 1n9a h GLU 320 N 0.11 0.74 0.00 4.88 5.08 -1.39 -1.38 114.58 122.63 1n9a h GLU 320 Ca 0.65 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.91 1n9a h GLU 320 Cb 1.44 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 1n9a h GLU 320 CO -0.76 0.49 -0.22 0.22 -1.00 0.00 0.00 179.01 177.73 1n9a h ASP 321 N 0.76 0.00 0.69 1.42 3.58 0.72 -0.28 116.42 123.32 1n9a h ASP 321 Ca 0.44 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.89 1n9a h ASP 321 Cb 0.48 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.53 1n9a h ASP 321 CO -0.29 0.22 -0.10 0.23 -2.88 0.00 0.00 179.24 176.42 1n9a n MET 322 N -3.15 0.24 -0.11 0.28 2.81 -0.42 -2.25 117.12 114.51 1n9a n MET 322 Ca 0.03 -0.05 -0.22 0.00 -1.81 0.00 0.00 57.70 55.65 1n9a n MET 322 Cb 0.62 -1.50 -0.12 0.00 -0.71 0.00 0.00 33.22 31.52 1n9a n MET 322 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1n9a n LEU 323 N -1.33 2.54 -0.34 4.03 4.32 -0.61 -2.88 117.00 122.72 1n9a n LEU 323 Ca 0.10 0.09 0.05 0.00 -0.02 0.00 0.00 56.01 56.24 1n9a n LEU 323 Cb 0.30 -0.92 0.23 0.00 -1.62 0.00 0.00 43.42 41.42 1n9a n LEU 323 CO 0.27 0.77 1.25 -0.33 -1.22 0.00 0.00 177.39 178.12 1n9a h GLU 324 N -0.37 1.01 -0.02 3.23 5.08 -1.04 -0.41 114.58 122.06 1n9a h GLU 324 Ca -0.58 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.72 1n9a h GLU 324 Cb 1.79 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.81 1n9a h GLU 324 CO -0.18 0.67 0.00 0.09 -1.00 0.00 0.00 179.01 178.59 1n9a n ASN 325 N -4.55 1.40 -1.95 1.42 5.03 -0.95 -5.04 115.26 110.61 1n9a n ASN 325 Ca 0.17 -1.47 0.00 0.00 0.87 0.00 0.00 54.58 54.15 1n9a n ASN 325 Cb 0.28 -0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.04 1n9a n ASN 325 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1n9a n GLN 326 N 0.09 -5.28 -3.83 3.52 3.00 -0.16 -5.04 117.38 109.67 1n9a n GLN 326 Ca 0.19 3.77 -0.12 0.00 -0.01 0.00 0.00 57.00 60.83 1n9a n GLN 326 Cb 0.34 -4.06 -0.10 0.00 0.00 0.00 0.00 30.24 26.42 1n9a n GLN 326 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1n9a s ASP 328 N -0.97 4.82 0.00 0.00 -1.08 -1.26 -1.21 116.67 116.98 1n9a s ASP 328 Ca -0.11 2.67 0.00 0.00 -0.52 0.00 0.00 52.55 54.60 1n9a s ASP 328 Cb -0.06 -2.62 0.00 0.00 -1.46 0.00 0.00 42.92 38.78 1n9a s ASP 328 CO 0.02 -1.86 0.00 0.59 0.52 0.00 0.00 175.17 174.43 1n9a n ASN 329 N -1.62 -2.51 -0.33 -0.34 3.02 -1.26 -4.88 115.26 107.34 1n9a n ASN 329 Ca 0.14 0.00 0.28 0.00 -0.03 0.00 0.00 54.58 54.97 1n9a n ASN 329 Cb 0.47 -0.85 0.60 0.00 -0.61 0.00 0.00 39.78 39.39 1n9a n ASN 329 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 1n9a h LYS 330 N 1.30 0.22 -0.36 3.52 2.10 -1.55 0.31 116.57 122.11 1n9a h LYS 330 Ca 0.00 -0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 58.62 1n9a h LYS 330 Cb 0.12 -0.05 -0.02 0.00 -0.90 0.00 0.00 32.23 31.39 1n9a h LYS 330 CO 0.00 0.15 0.15 1.49 -2.00 0.00 0.00 179.45 179.24 1n9a h GLU 331 N 0.23 0.54 -0.31 0.07 4.57 -1.90 0.11 114.58 117.90 1n9a h GLU 331 Ca 0.60 -0.10 -0.08 0.00 -1.18 0.00 0.00 59.36 58.60 1n9a h GLU 331 Cb 1.85 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 30.34 1n9a h GLU 331 CO -0.20 0.52 -0.11 0.22 -1.18 0.00 0.00 179.01 178.25 1n9a h ASP 332 N 0.44 0.64 -0.52 1.04 -0.00 -0.90 -2.08 116.42 115.04 1n9a h ASP 332 Ca 0.12 -0.39 0.10 0.00 -0.00 0.00 0.00 57.03 56.87 1n9a h ASP 332 Cb 0.18 -0.18 -0.09 0.00 -0.00 0.00 0.00 39.33 39.24 1n9a h ASP 332 CO -0.01 0.88 -0.04 0.40 -0.00 0.00 0.00 179.24 180.47 1n9a h ILE 333 N 0.39 0.55 -0.17 2.25 2.04 -0.56 0.39 117.51 122.39 1n9a h ILE 333 Ca 0.07 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.89 1n9a h ILE 333 Cb 0.62 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1n9a h ILE 333 CO 0.04 0.01 0.00 0.25 0.00 0.00 0.00 178.15 178.45 1n9a h LEU 334 N 0.07 0.22 -0.05 1.44 5.85 -0.60 -0.02 115.31 122.21 1n9a h LEU 334 Ca 0.26 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 1n9a h LEU 334 Cb 0.40 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1n9a h LEU 334 CO -0.47 0.26 -0.10 0.78 -0.34 0.00 0.00 178.44 178.57 1n9a h ASN 335 N 0.24 0.18 -0.35 1.25 2.35 0.21 -1.69 115.58 117.77 1n9a h ASN 335 Ca 0.06 -0.56 0.03 0.00 -0.55 0.00 0.00 56.30 55.29 1n9a h ASN 335 Cb 0.16 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.45 1n9a h ASN 335 CO 0.00 0.70 0.14 0.50 -1.65 0.00 0.00 177.43 177.13 1n9a h LYS 336 N -0.33 0.30 -0.67 0.81 1.63 -0.08 -1.29 116.57 116.94 1n9a h LYS 336 Ca 0.00 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.77 1n9a h LYS 336 Cb 0.67 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 32.20 1n9a h LYS 336 CO 0.02 0.20 0.34 0.00 -3.45 0.00 0.00 179.45 176.56 1n9a h ALA 337 N 1.21 1.34 0.00 5.00 0.00 -1.01 -1.36 119.26 124.43 1n9a h ALA 337 Ca 0.15 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1n9a h ALA 337 Cb 0.10 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1n9a h ALA 337 CO -0.14 0.53 -0.55 -0.07 0.00 0.00 0.00 179.25 179.02 1n9a h LEU 338 N 0.95 0.00 -0.21 0.00 3.38 -0.85 -1.65 115.31 116.92 1n9a h LEU 338 Ca 0.24 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.05 1n9a h LEU 338 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1n9a h LEU 338 CO -0.03 0.55 -0.48 -0.08 0.09 0.00 0.00 178.44 178.49 1n9a h GLU 339 N 0.00 0.69 -0.63 1.13 4.81 -0.85 -1.34 114.58 118.39 1n9a h GLU 339 Ca -0.01 -0.47 -0.05 0.00 -0.13 0.00 0.00 59.36 58.71 1n9a h GLU 339 Cb 1.27 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.69 1n9a h GLU 339 CO 0.07 1.09 0.19 -0.07 -0.73 0.00 0.00 179.01 179.56 1n9a h LEU 340 N 0.40 0.89 -1.28 1.64 3.38 -1.15 -0.04 115.31 119.15 1n9a h LEU 340 Ca -0.00 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 1n9a h LEU 340 Cb 1.09 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 1n9a h LEU 340 CO 0.10 0.84 -0.06 0.00 0.09 0.00 0.00 178.44 179.41 1n9a h GLU 342 N 0.40 0.22 0.06 0.00 4.39 -0.44 -0.73 114.58 118.47 1n9a h GLU 342 Ca 0.08 -0.30 -0.00 0.00 0.34 0.00 0.00 59.36 59.48 1n9a h GLU 342 Cb 0.36 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1n9a h GLU 342 CO 0.02 1.08 -0.03 0.82 -1.16 0.00 0.00 179.01 179.74 1n9a h ILE 343 N 0.09 1.15 -0.34 3.13 2.04 -0.65 0.84 117.51 123.78 1n9a h ILE 343 Ca -0.08 -0.72 0.01 0.00 1.00 0.00 0.00 64.86 65.07 1n9a h ILE 343 Cb 1.73 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 39.42 1n9a h ILE 343 CO 0.16 0.18 0.21 -0.07 0.00 0.00 0.00 178.15 178.64 1n9a h LEU 344 N -0.40 0.36 -0.70 1.44 3.38 -1.22 1.38 115.31 119.55 1n9a h LEU 344 Ca -0.01 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1n9a h LEU 344 Cb 0.36 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1n9a h LEU 344 CO 0.01 0.26 -0.11 0.00 0.09 0.00 0.00 178.44 178.69 1n9a h ALA 345 N 1.13 0.89 0.02 1.53 0.00 -0.97 0.82 119.26 122.68 1n9a h ALA 345 Ca 0.13 -0.34 -0.38 0.00 0.00 0.00 0.00 54.91 54.32 1n9a h ALA 345 Cb -0.03 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 1n9a h ALA 345 CO -0.04 0.64 -2.34 1.63 0.00 0.00 0.00 179.25 179.14 1n9a n LYS 346 N -4.15 0.68 0.04 0.00 5.02 0.29 -4.35 118.16 115.69 1n9a n LYS 346 Ca 0.01 0.15 -0.00 0.00 -2.02 0.00 0.00 58.31 56.46 1n9a n LYS 346 Cb 0.39 -1.57 -0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1n9a n LYS 346 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1n9a n GLU 347 N -3.21 0.00 0.19 1.97 2.13 0.26 -4.84 120.64 117.14 1n9a n GLU 347 Ca -0.40 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.48 1n9a n GLU 347 Cb 1.03 -0.42 0.54 0.00 0.27 0.00 0.00 31.44 32.86 1n9a n GLU 347 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1n9a h LYS 348 N -0.00 0.12 0.00 5.31 1.63 0.13 -3.39 116.57 120.36 1n9a h LYS 348 Ca 0.00 -0.01 -0.21 0.00 -0.85 0.00 0.00 60.65 59.57 1n9a h LYS 348 Cb 0.00 -0.02 -0.14 0.00 -0.60 0.00 0.00 32.23 31.47 1n9a h LYS 348 CO 0.00 0.15 -0.41 -3.47 -3.45 0.00 0.00 179.45 172.27 1n9a n ASP 349 N -4.44 -2.44 0.01 4.20 2.03 0.28 -4.73 116.55 111.46 1n9a n ASP 349 Ca -0.02 -3.33 0.06 0.00 0.52 0.00 0.00 54.79 52.03 1n9a n ASP 349 Cb 0.15 1.78 0.27 0.00 -0.72 0.00 0.00 41.12 42.60 1n9a n ASP 349 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1n9a n THR 350 N 0.94 1.18 0.05 5.18 -2.24 -1.08 -3.11 114.28 115.21 1n9a n THR 350 Ca 0.06 0.30 0.02 0.00 -2.27 0.00 0.00 64.05 62.16 1n9a n THR 350 Cb 0.68 -1.11 0.37 0.00 -2.10 0.00 0.00 70.33 68.16 1n9a n THR 350 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1n9a h ILE 351 N 0.00 1.16 -2.37 2.28 6.09 -1.90 -2.81 117.51 119.95 1n9a h ILE 351 Ca 0.00 -0.63 -0.67 0.00 -1.37 0.00 0.00 64.86 62.19 1n9a h ILE 351 Cb 0.21 0.96 -0.37 0.00 0.47 0.00 0.00 36.82 38.08 1n9a h ILE 351 CO 0.00 0.22 -0.13 -2.11 -3.07 0.00 0.00 178.15 173.05 1n9a n ARG 352 N -4.33 3.42 0.09 2.19 1.85 -1.18 -4.74 116.66 113.96 1n9a n ARG 352 Ca 0.01 -4.69 0.02 0.00 -1.00 0.00 0.00 57.85 52.18 1n9a n ARG 352 Cb 0.21 -2.33 -0.02 0.00 -1.05 0.00 0.00 32.46 29.27 1n9a n ARG 352 CO 0.00 0.00 0.00 1.57 -0.01 0.00 0.00 177.63 179.19 1n9a h LYS 353 N 4.19 0.00 -0.24 2.89 2.10 -1.68 -2.55 116.57 121.28 1n9a h LYS 353 Ca 0.22 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.71 1n9a h LYS 353 Cb 0.58 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.90 1n9a h LYS 353 CO 0.98 0.41 -0.49 0.93 -2.00 0.00 0.00 179.45 179.27 1n9a h GLU 354 N 0.00 0.65 0.01 0.07 4.39 -1.86 -2.46 114.58 115.37 1n9a h GLU 354 Ca -0.07 -0.38 -0.05 0.00 0.34 0.00 0.00 59.36 59.20 1n9a h GLU 354 Cb 1.46 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 30.15 1n9a h GLU 354 CO 0.06 1.00 -0.20 -0.92 -1.16 0.00 0.00 179.01 177.78 1n9a h TYR 355 N 0.51 0.19 -0.00 4.33 3.20 -1.94 -2.99 116.97 120.28 1n9a h TYR 355 Ca 0.02 -0.11 -0.02 0.00 3.14 0.00 0.00 58.73 61.76 1n9a h TYR 355 Cb 1.04 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.29 1n9a h TYR 355 CO 0.05 0.93 -0.10 -1.49 -1.64 0.00 0.00 178.16 175.92 1n9a h TRP 356 N -0.60 0.00 0.00 -3.82 -0.00 -1.50 0.08 115.95 110.11 1n9a h TRP 356 Ca -0.03 -0.00 -0.16 0.00 -0.00 0.00 0.00 58.89 58.70 1n9a h TRP 356 Cb 1.00 -0.00 -0.03 0.00 -0.00 0.00 0.00 29.16 30.13 1n9a h TRP 356 CO 0.20 0.10 -1.11 0.00 -0.00 0.00 0.00 178.44 177.62 1n9a h ARG 357 N 0.00 0.00 0.00 0.49 3.08 -1.56 -2.98 114.38 113.42 1n9a h ARG 357 Ca -0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 1n9a h ARG 357 Cb 0.17 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1n9a h ARG 357 CO 0.01 0.45 -0.45 -0.92 -1.07 0.00 0.00 179.97 178.00 1n9a h TYR 358 N 0.00 0.00 0.00 3.04 3.20 -1.02 -0.63 116.97 121.56 1n9a h TYR 358 Ca -0.11 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.75 1n9a h TYR 358 Cb 1.58 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.85 1n9a h TYR 358 CO 0.00 0.45 -0.07 0.82 -1.64 0.00 0.00 178.16 177.72 1n9a h ILE 359 N 0.00 0.13 -0.00 1.81 1.08 -1.03 -1.14 117.51 118.36 1n9a h ILE 359 Ca -0.00 -1.08 -0.17 0.00 -0.39 0.00 0.00 64.86 63.21 1n9a h ILE 359 Cb 0.81 1.97 0.01 0.00 -3.07 0.00 0.00 36.82 36.55 1n9a h ILE 359 CO 0.06 0.07 -0.65 1.23 -0.69 0.00 0.00 178.15 178.17 1n9a h GLY 360 N 3.58 0.50 1.68 5.37 0.00 -1.11 -2.14 103.07 110.94 1n9a h GLY 360 Ca -0.00 -0.87 -0.13 0.00 0.00 0.00 0.00 47.33 46.33 1n9a h GLY 360 CO 0.01 0.77 -0.49 3.21 0.00 0.00 0.00 176.54 180.04 1n9a h ARG 361 N -0.04 0.35 -0.04 4.80 3.08 -1.05 -2.84 114.38 118.63 1n9a h ARG 361 Ca -0.08 -0.19 -0.21 0.00 0.07 0.00 0.00 59.98 59.57 1n9a h ARG 361 Cb 1.36 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.42 1n9a h ARG 361 CO 0.13 0.76 -0.84 0.77 -1.07 0.00 0.00 179.97 179.72 1n9a h SER 362 N 0.28 0.50 0.26 7.04 0.02 -1.26 -2.47 113.55 117.91 1n9a h SER 362 Ca 0.01 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1n9a h SER 362 Cb 0.96 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.35 1n9a h SER 362 CO 0.08 1.14 0.00 -0.11 -1.14 0.00 0.00 176.83 176.80 1n9a n LEU 363 N -3.78 0.21 -0.05 5.07 7.94 -0.81 0.47 117.00 126.05 1n9a n LEU 363 Ca -0.05 0.57 -0.01 0.00 -1.11 0.00 0.00 56.01 55.41 1n9a n LEU 363 Cb 0.78 -0.57 -0.00 0.00 0.53 0.00 0.00 43.42 44.15 1n9a n LEU 363 CO 0.50 -0.52 -0.09 1.56 -1.11 0.00 0.00 177.39 177.72 1n9a h GLN 364 N 0.00 0.00 0.83 1.96 1.08 -1.21 -3.38 115.11 114.39 1n9a h GLN 364 Ca 0.00 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 1n9a h GLN 364 Cb 0.13 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.57 1n9a h GLN 364 CO 0.00 0.00 -0.40 0.77 -0.95 0.00 0.00 178.83 178.25 1n9a h SER 365 N -0.86 -0.95 -0.02 1.46 0.02 -1.36 -3.52 113.55 108.32 1n9a h SER 365 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1n9a h SER 365 Cb 0.14 0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1n9a h SER 365 CO 0.00 -0.66 0.00 2.29 -1.14 0.00 0.00 176.83 177.32