#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n4p s LEU 56 N 0.00 3.36 0.74 4.37 2.96 -1.26 -5.00 118.68 123.84 1n4p s LEU 56 Ca 0.00 0.01 -0.15 0.00 -0.22 0.00 0.00 54.13 53.77 1n4p s LEU 56 Cb 0.00 -2.96 0.04 0.00 0.50 0.00 0.00 46.19 43.77 1n4p s LEU 56 CO 0.00 -1.65 1.23 -0.55 -1.32 0.00 0.00 176.35 174.06 1n4p s SER 57 N 3.65 4.08 0.23 3.68 0.15 -1.26 -4.93 113.70 119.30 1n4p s SER 57 Ca 0.44 2.44 0.22 0.00 0.70 0.00 0.00 55.95 59.75 1n4p s SER 57 Cb -0.09 -2.60 0.94 0.00 -1.71 0.00 0.00 66.02 62.56 1n4p s SER 57 CO 0.22 -2.34 1.67 0.18 1.20 0.00 0.00 173.24 174.17 1n4p n LEU 58 N -2.70 0.58 -0.05 3.45 4.77 -1.26 -2.58 117.00 119.21 1n4p n LEU 58 Ca 0.14 0.65 0.06 0.00 -0.03 0.00 0.00 56.01 56.83 1n4p n LEU 58 Cb 0.50 -0.58 0.08 0.00 -2.33 0.00 0.00 43.42 41.09 1n4p n LEU 58 CO 0.48 -0.54 0.53 -0.90 -1.33 0.00 0.00 177.39 175.63 1n4p n ASP 59 N -2.14 2.14 -4.76 -1.43 5.75 -1.26 -4.97 116.55 109.87 1n4p n ASP 59 Ca 0.02 -2.63 -0.40 0.00 -0.01 0.00 0.00 54.79 51.77 1n4p n ASP 59 Cb 0.21 -0.26 -0.03 0.00 -1.03 0.00 0.00 41.12 40.02 1n4p n ASP 59 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1n4p s SER 60 N -2.09 6.97 0.40 -1.12 0.15 -1.06 -4.90 113.70 112.05 1n4p s SER 60 Ca 0.19 2.44 0.13 0.00 0.70 0.00 0.00 55.95 59.41 1n4p s SER 60 Cb 0.16 -2.63 0.98 0.00 -1.71 0.00 0.00 66.02 62.82 1n4p s SER 60 CO 0.02 -0.37 1.90 -0.65 1.20 0.00 0.00 173.24 175.34 1n4p h PRO 61 N 3.47 0.49 -0.83 5.44 0.11 -1.96 -0.95 132.00 137.76 1n4p h PRO 61 Ca -0.48 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 65.42 1n4p h PRO 61 Cb 1.22 -0.11 -0.11 0.00 0.11 0.00 0.00 31.00 32.11 1n4p h PRO 61 CO 0.66 0.33 0.23 0.25 -0.21 0.00 0.00 178.00 179.25 1n4p n THR 62 N -4.50 2.36 -2.24 -1.15 -2.24 -1.26 -4.96 114.28 100.29 1n4p n THR 62 Ca 0.15 -1.24 -0.40 0.00 -2.27 0.00 0.00 64.05 60.29 1n4p n THR 62 Cb 0.51 -0.46 -0.02 0.00 -2.10 0.00 0.00 70.33 68.26 1n4p n THR 62 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1n4p s TYR 63 N -2.41 3.15 -0.06 4.78 6.14 -0.37 -5.03 117.35 123.56 1n4p s TYR 63 Ca 0.42 1.51 0.02 0.00 0.64 0.00 0.00 57.07 59.67 1n4p s TYR 63 Cb 0.34 -3.52 0.01 0.00 0.42 0.00 0.00 41.96 39.21 1n4p s TYR 63 CO 0.10 -1.45 -0.11 0.08 0.64 0.00 0.00 175.55 174.81 1n4p s VAL 64 N -1.23 1.03 0.72 3.14 1.01 -1.26 -5.04 120.40 118.77 1n4p s VAL 64 Ca 0.51 -0.42 -0.16 0.00 0.00 0.00 0.00 61.98 61.91 1n4p s VAL 64 Cb -0.35 -0.95 -0.01 0.00 0.00 0.00 0.00 36.38 35.07 1n4p s VAL 64 CO 0.46 0.33 0.78 0.18 0.00 0.00 0.00 175.10 176.85 1n4p n LEU 65 N 3.78 2.35 0.20 3.92 4.77 -1.26 -4.84 117.00 125.91 1n4p n LEU 65 Ca -0.23 0.63 0.04 0.00 -0.03 0.00 0.00 56.01 56.42 1n4p n LEU 65 Cb 0.52 -1.33 0.43 0.00 -2.33 0.00 0.00 43.42 40.72 1n4p n LEU 65 CO 0.25 -2.50 0.83 1.88 -1.33 0.00 0.00 177.39 176.52 1n4p h TYR 66 N -0.32 0.03 0.00 -1.77 0.05 -1.96 -1.83 116.97 111.17 1n4p h TYR 66 Ca -0.46 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.30 1n4p h TYR 66 Cb 1.34 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 39.07 1n4p h TYR 66 CO 0.38 0.28 -0.04 0.07 -1.05 0.00 0.00 178.16 177.80 1n4p h ARG 67 N 0.03 0.00 -0.47 4.88 0.11 -1.91 -2.27 114.38 114.74 1n4p h ARG 67 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1n4p h ARG 67 Cb 0.46 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.54 1n4p h ARG 67 CO 0.03 0.04 0.00 -0.25 0.10 0.00 0.00 179.97 179.89 1n4p n ASP 68 N -3.31 3.30 -4.77 0.08 8.00 -0.70 -4.96 116.55 114.19 1n4p n ASP 68 Ca -0.02 -1.97 -0.37 0.00 0.71 0.00 0.00 54.79 53.14 1n4p n ASP 68 Cb 0.18 -0.31 -0.06 0.00 -0.02 0.00 0.00 41.12 40.90 1n4p n ASP 68 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1n4p s ARG 69 N -1.05 4.10 0.14 -1.24 0.52 -0.85 -4.95 118.95 115.62 1n4p s ARG 69 Ca 0.34 0.25 -0.16 0.00 -0.52 0.00 0.00 55.73 55.64 1n4p s ARG 69 Cb 0.18 -3.34 -0.00 0.00 0.52 0.00 0.00 34.95 32.31 1n4p s ARG 69 CO 0.24 0.41 1.73 0.00 0.02 0.00 0.00 175.30 177.70 1n4p h ALA 70 N 5.91 0.50 0.00 2.13 0.00 -1.93 -2.51 119.26 123.36 1n4p h ALA 70 Ca -0.46 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1n4p h ALA 70 Cb 1.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1n4p h ALA 70 CO 0.70 0.04 0.00 0.39 0.00 0.00 0.00 179.25 180.38 1n4p n GLU 71 N -4.72 0.04 -0.13 0.00 4.71 -1.26 -1.23 120.64 118.05 1n4p n GLU 71 Ca -0.00 0.53 0.04 0.00 -0.01 0.00 0.00 57.16 57.72 1n4p n GLU 71 Cb 0.09 -1.64 0.11 0.00 -1.01 0.00 0.00 31.44 28.98 1n4p n GLU 71 CO 0.00 0.00 0.00 0.91 0.09 0.00 0.00 177.13 178.13 1n4p n TRP 72 N -1.74 0.30 0.16 -0.32 7.02 -0.96 -4.69 117.44 117.21 1n4p n TRP 72 Ca -0.00 -0.59 0.04 0.00 -1.02 0.00 0.00 57.50 55.92 1n4p n TRP 72 Cb 0.02 -0.08 0.44 0.00 -2.42 0.00 0.00 31.31 29.27 1n4p n TRP 72 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1n4p h ALA 73 N 1.04 1.60 0.00 6.99 0.00 -1.08 -2.84 119.26 124.97 1n4p h ALA 73 Ca 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1n4p h ALA 73 Cb 0.75 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1n4p h ALA 73 CO 0.03 0.29 -0.02 0.38 0.00 0.00 0.00 179.25 179.93 1n4p h ASP 74 N 0.14 0.00 -3.26 0.00 -0.00 -1.84 -3.45 116.42 108.02 1n4p h ASP 74 Ca 0.03 0.00 -0.57 0.00 -0.00 0.00 0.00 57.03 56.49 1n4p h ASP 74 Cb 0.33 0.00 -0.05 0.00 -0.00 0.00 0.00 39.33 39.61 1n4p h ASP 74 CO 0.02 0.02 -0.05 -0.63 -0.00 0.00 0.00 179.24 178.60 1n4p s ILE 75 N -3.45 4.91 -0.40 4.15 -1.09 -1.07 -5.06 121.20 119.20 1n4p s ILE 75 Ca 0.04 1.17 -0.16 0.00 -2.23 0.00 0.00 60.65 59.46 1n4p s ILE 75 Cb 0.07 -3.89 0.01 0.00 -1.58 0.00 0.00 42.46 37.07 1n4p s ILE 75 CO 0.61 0.45 0.39 -1.81 -1.23 0.00 0.00 174.94 173.35 1n4p s ASP 76 N -0.39 6.17 0.46 3.58 1.01 -1.26 -5.05 116.67 121.19 1n4p s ASP 76 Ca 0.29 -0.60 -0.24 0.00 0.71 0.00 0.00 52.55 52.71 1n4p s ASP 76 Cb -0.18 -2.20 -0.09 0.00 1.01 0.00 0.00 42.92 41.46 1n4p s ASP 76 CO 0.16 -0.49 1.21 -0.81 0.21 0.00 0.00 175.17 175.46 1n4p n PRO 77 N 5.45 1.69 -3.89 8.23 -0.04 -1.26 -4.74 135.00 140.44 1n4p n PRO 77 Ca -0.09 0.61 -0.35 0.00 -0.04 0.00 0.00 63.50 63.63 1n4p n PRO 77 Cb 0.48 -2.34 -0.14 0.00 -0.04 0.00 0.00 33.50 31.46 1n4p n PRO 77 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1n4p s VAL 78 N -1.26 3.45 0.38 0.52 1.01 0.11 -4.95 120.40 119.67 1n4p s VAL 78 Ca 0.65 -0.49 -0.10 0.00 0.00 0.00 0.00 61.98 62.04 1n4p s VAL 78 Cb -0.49 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.24 1n4p s VAL 78 CO 0.55 0.40 0.74 -2.16 0.00 0.00 0.00 175.10 174.63 1n4p s PRO 79 N 1.49 3.78 -0.03 2.72 0.04 -1.26 -4.32 135.00 137.42 1n4p s PRO 79 Ca 0.06 0.43 -0.20 0.00 0.04 0.00 0.00 61.00 61.33 1n4p s PRO 79 Cb -0.14 -2.42 -0.05 0.00 0.04 0.00 0.00 34.50 31.92 1n4p s PRO 79 CO -0.03 0.01 0.58 -1.14 0.04 0.00 0.00 177.00 176.47 1n4p s GLN 80 N -3.73 4.32 -0.19 4.56 0.74 -1.26 -5.06 119.66 119.03 1n4p s GLN 80 Ca 0.51 0.70 -0.01 0.00 0.05 0.00 0.00 55.36 56.60 1n4p s GLN 80 Cb -0.10 -3.37 0.05 0.00 1.10 0.00 0.00 33.01 30.69 1n4p s GLN 80 CO 0.30 0.31 -0.03 0.54 -0.55 0.00 0.00 175.29 175.86 1n4p s ASN 81 N 0.04 3.12 -0.01 6.67 2.20 -1.26 -4.99 114.94 120.70 1n4p s ASN 81 Ca 0.31 -0.84 0.07 0.00 -0.94 0.00 0.00 52.86 51.45 1n4p s ASN 81 Cb -0.18 -0.89 0.22 0.00 -2.00 0.00 0.00 41.25 38.40 1n4p s ASN 81 CO 0.16 -0.23 1.12 0.47 -2.94 0.00 0.00 177.10 175.68 1n4p n ASP 82 N 4.87 1.50 -0.04 3.54 9.92 -1.26 -5.03 116.55 130.05 1n4p n ASP 82 Ca -0.11 -2.06 0.00 0.00 -0.53 0.00 0.00 54.79 52.10 1n4p n ASP 82 Cb 0.46 -0.23 -0.00 0.00 -0.64 0.00 0.00 41.12 40.71 1n4p n ASP 82 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1n4p n GLY 83 N 0.75 -2.12 0.28 0.44 0.00 -1.26 -4.25 105.19 99.03 1n4p n GLY 83 Ca 0.08 -1.44 -0.11 0.00 0.00 0.00 0.00 46.02 44.54 1n4p n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n4p h PRO 84 N 0.00 -0.37 -3.50 1.61 0.13 -2.06 -3.37 132.00 124.45 1n4p h PRO 84 Ca 0.00 0.02 -0.67 0.00 -0.87 0.00 0.00 66.00 64.49 1n4p h PRO 84 Cb 0.01 0.08 -0.38 0.00 0.13 0.00 0.00 31.00 30.84 1n4p h PRO 84 CO 0.00 -0.24 -0.51 -1.12 -0.23 0.00 0.00 178.00 175.90 1n4p s SER 85 N -4.91 4.75 0.27 1.44 0.01 -1.26 -5.09 113.70 108.91 1n4p s SER 85 Ca -0.15 -2.93 -0.29 0.00 1.31 0.00 0.00 55.95 53.88 1n4p s SER 85 Cb 0.09 -1.74 -0.09 0.00 0.21 0.00 0.00 66.02 64.49 1n4p s SER 85 CO 0.66 -0.30 1.23 -2.16 0.41 0.00 0.00 173.24 173.08 1n4p s PRO 86 N -0.18 4.47 -0.06 12.44 0.04 -1.26 -5.05 135.00 145.40 1n4p s PRO 86 Ca 0.17 2.01 0.01 0.00 0.04 0.00 0.00 61.00 63.23 1n4p s PRO 86 Cb -0.23 -3.15 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 1n4p s PRO 86 CO -0.02 -0.06 -0.07 0.08 0.04 0.00 0.00 177.00 176.98 1n4p s VAL 87 N -0.78 3.73 -1.30 -0.36 1.01 -1.26 -4.62 120.40 116.82 1n4p s VAL 87 Ca 0.49 -0.49 -0.16 0.00 0.00 0.00 0.00 61.98 61.82 1n4p s VAL 87 Cb -0.36 -2.53 0.01 0.00 0.00 0.00 0.00 36.38 33.50 1n4p s VAL 87 CO 0.44 0.58 0.53 0.52 0.00 0.00 0.00 175.10 177.17 1n4p n VAL 88 N 2.17 -3.36 -3.04 2.92 0.31 -1.26 -4.89 118.33 111.18 1n4p n VAL 88 Ca -0.18 -0.66 -0.40 0.00 -0.01 0.00 0.00 64.34 63.10 1n4p n VAL 88 Cb 0.53 -2.72 -0.05 0.00 -0.91 0.00 0.00 33.84 30.69 1n4p n VAL 88 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1n4p s GLN 89 N -6.82 4.45 -0.15 5.55 0.74 -1.26 -5.06 119.66 117.11 1n4p s GLN 89 Ca 0.28 0.96 -0.06 0.00 0.05 0.00 0.00 55.36 56.60 1n4p s GLN 89 Cb -0.13 -3.38 -0.04 0.00 1.10 0.00 0.00 33.01 30.57 1n4p s GLN 89 CO 0.93 0.25 0.03 0.42 -0.55 0.00 0.00 175.29 176.37 1n4p s ILE 90 N 0.11 4.54 0.05 -2.34 1.01 -1.26 -5.09 121.20 118.22 1n4p s ILE 90 Ca 0.37 -0.13 -0.25 0.00 0.00 0.00 0.00 60.65 60.63 1n4p s ILE 90 Cb -0.19 -3.01 -0.05 0.00 0.01 0.00 0.00 42.46 39.22 1n4p s ILE 90 CO 0.21 0.51 0.78 0.27 0.00 0.00 0.00 174.94 176.71 1n4p s ILE 91 N 0.04 4.72 0.03 2.92 -5.25 -1.26 -5.06 121.20 117.35 1n4p s ILE 91 Ca 0.04 1.67 0.06 0.00 -0.99 0.00 0.00 60.65 61.43 1n4p s ILE 91 Cb -0.13 -4.13 -0.03 0.00 2.95 0.00 0.00 42.46 41.12 1n4p s ILE 91 CO 0.01 0.35 -0.16 -0.31 -1.79 0.00 0.00 174.94 173.04 1n4p s TYR 92 N -0.01 2.61 0.84 1.37 1.51 -1.26 -5.12 117.35 117.29 1n4p s TYR 92 Ca 0.39 -0.22 -0.11 0.00 -1.01 0.00 0.00 57.07 56.12 1n4p s TYR 92 Cb -0.21 -1.49 0.09 0.00 -0.11 0.00 0.00 41.96 40.25 1n4p s TYR 92 CO 0.23 0.26 1.09 -1.54 -1.11 0.00 0.00 175.55 174.49 1n4p s SER 93 N -1.40 4.07 0.14 2.29 1.04 -1.26 -4.75 113.70 113.83 1n4p s SER 93 Ca 0.15 1.39 -0.18 0.00 0.48 0.00 0.00 55.95 57.79 1n4p s SER 93 Cb -0.11 -2.10 0.03 0.00 0.10 0.00 0.00 66.02 63.94 1n4p s SER 93 CO 0.05 -2.25 1.72 -0.33 0.98 0.00 0.00 173.24 173.42 1n4p h GLU 94 N -1.28 0.11 -0.30 4.02 4.39 -2.00 -0.03 114.58 119.49 1n4p h GLU 94 Ca -0.48 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.24 1n4p h GLU 94 Cb 1.27 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.87 1n4p h GLU 94 CO 0.57 0.07 0.12 -0.22 -1.16 0.00 0.00 179.01 178.39 1n4p h LYS 95 N 0.11 0.25 0.53 2.33 3.64 -1.99 0.01 116.57 121.45 1n4p h LYS 95 Ca 0.14 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1n4p h LYS 95 Cb 0.17 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1n4p h LYS 95 CO -0.21 0.17 -0.25 0.35 -2.27 0.00 0.00 179.45 177.23 1n4p h PHE 96 N 0.26 -0.66 -0.45 1.91 3.57 -1.84 -2.27 116.94 117.46 1n4p h PHE 96 Ca 0.13 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.67 1n4p h PHE 96 Cb 0.08 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 1n4p h PHE 96 CO -0.12 -0.36 0.30 -0.09 -2.23 0.00 0.00 178.31 175.81 1n4p h ARG 97 N -0.82 0.40 0.04 1.11 2.43 -0.94 -2.22 114.38 114.38 1n4p h ARG 97 Ca -0.07 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1n4p h ARG 97 Cb 0.59 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1n4p h ARG 97 CO 0.12 0.26 -0.02 0.22 -1.51 0.00 0.00 179.97 179.05 1n4p h ASP 98 N 0.41 -0.05 -0.23 -3.80 1.82 -0.77 0.25 116.42 114.06 1n4p h ASP 98 Ca 0.19 -0.19 0.02 0.00 -0.39 0.00 0.00 57.03 56.66 1n4p h ASP 98 Cb 0.25 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 40.25 1n4p h ASP 98 CO -0.05 0.16 0.10 0.58 -1.61 0.00 0.00 179.24 178.43 1n4p h VAL 99 N -0.26 0.98 0.00 2.25 2.07 -0.94 -2.70 116.25 117.66 1n4p h VAL 99 Ca -0.01 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 1n4p h VAL 99 Cb 0.23 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1n4p h VAL 99 CO 0.01 0.04 -0.15 1.88 0.02 0.00 0.00 177.57 179.37 1n4p h TYR 100 N 0.22 0.00 -0.09 1.57 0.05 -1.38 -1.12 116.97 116.21 1n4p h TYR 100 Ca 0.09 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.75 1n4p h TYR 100 Cb 0.03 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 1n4p h TYR 100 CO -0.10 0.15 -0.50 -0.44 -1.05 0.00 0.00 178.16 176.22 1n4p h ASP 101 N 0.00 0.26 0.89 3.88 3.32 -0.63 -1.20 116.42 122.95 1n4p h ASP 101 Ca -0.00 -0.13 -0.22 0.00 0.02 0.00 0.00 57.03 56.71 1n4p h ASP 101 Cb 0.75 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.20 1n4p h ASP 101 CO 0.02 0.72 -1.17 1.88 -1.72 0.00 0.00 179.24 178.96 1n4p h TYR 102 N 0.19 0.00 -0.51 4.55 -1.99 -1.21 0.31 116.97 118.31 1n4p h TYR 102 Ca 0.01 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.70 1n4p h TYR 102 Cb 0.95 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.66 1n4p h TYR 102 CO 0.02 0.89 0.17 0.35 -0.00 0.00 0.00 178.16 179.59 1n4p h PHE 103 N 0.00 0.81 -0.90 4.88 3.57 -0.95 -0.80 116.94 123.54 1n4p h PHE 103 Ca -0.10 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.33 1n4p h PHE 103 Cb 1.77 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 40.23 1n4p h PHE 103 CO 0.00 0.69 0.59 0.00 -2.23 0.00 0.00 178.31 177.36 1n4p h ARG 104 N 0.69 1.20 0.28 1.11 3.08 -1.28 0.26 114.38 119.72 1n4p h ARG 104 Ca 0.17 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1n4p h ARG 104 Cb 0.25 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1n4p h ARG 104 CO -0.01 0.80 -0.13 0.00 -1.07 0.00 0.00 179.97 179.56 1n4p h ALA 105 N 1.42 -0.38 -0.88 0.04 0.00 -1.34 0.41 119.26 118.53 1n4p h ALA 105 Ca 0.33 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1n4p h ALA 105 Cb -0.13 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1n4p h ALA 105 CO -0.07 -0.66 0.58 0.28 0.00 0.00 0.00 179.25 179.39 1n4p h VAL 106 N -0.49 1.21 0.18 0.00 2.07 -0.85 -2.80 116.25 115.57 1n4p h VAL 106 Ca -0.04 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 1n4p h VAL 106 Cb 0.36 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.06 1n4p h VAL 106 CO 0.06 0.22 -0.08 -0.07 0.02 0.00 0.00 177.57 177.71 1n4p h LEU 107 N 1.18 -0.20 -1.94 2.57 3.38 -0.82 -1.39 115.31 118.09 1n4p h LEU 107 Ca 0.33 -0.16 0.18 0.00 0.09 0.00 0.00 57.88 58.31 1n4p h LEU 107 Cb -0.11 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1n4p h LEU 107 CO -0.08 0.05 0.55 -0.61 0.09 0.00 0.00 178.44 178.44 1n4p h GLN 108 N -0.45 0.00 -0.22 1.13 4.15 -0.77 0.21 115.11 119.15 1n4p h GLN 108 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1n4p h GLN 108 Cb 0.35 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.04 1n4p h GLN 108 CO 0.04 0.00 0.00 0.54 -1.93 0.00 0.00 178.83 177.48 1n4p n ARG 109 N -3.91 1.87 -4.16 1.69 1.74 -1.07 -4.97 116.66 107.85 1n4p n ARG 109 Ca 0.12 -1.79 -0.33 0.00 -0.77 0.00 0.00 57.85 55.09 1n4p n ARG 109 Cb 0.78 -1.33 -0.03 0.00 -1.02 0.00 0.00 32.46 30.86 1n4p n ARG 109 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1n4p n ASP 110 N 0.89 -1.85 -4.61 0.55 4.64 0.73 -4.83 116.55 112.07 1n4p n ASP 110 Ca 0.12 -1.05 -0.43 0.00 -1.38 0.00 0.00 54.79 52.05 1n4p n ASP 110 Cb 0.43 -2.68 -0.02 0.00 -1.04 0.00 0.00 41.12 37.81 1n4p n ASP 110 CO 0.00 0.00 0.00 -0.70 -0.82 0.00 0.00 177.20 175.68 1n4p s GLU 111 N -6.87 3.60 -1.15 -0.67 2.12 -0.82 -4.91 118.70 109.99 1n4p s GLU 111 Ca 0.44 1.15 -0.05 0.00 0.36 0.00 0.00 54.97 56.86 1n4p s GLU 111 Cb -0.24 -4.04 0.09 0.00 0.26 0.00 0.00 34.13 30.20 1n4p s GLU 111 CO 0.93 -1.53 2.52 0.54 -0.54 0.00 0.00 175.26 177.17 1n4p n ARG 112 N 8.00 4.10 -3.34 4.30 5.12 -1.26 -4.83 116.66 128.75 1n4p n ARG 112 Ca 0.18 -3.13 -0.19 0.00 -1.93 0.00 0.00 57.85 52.78 1n4p n ARG 112 Cb 0.47 -2.54 -0.00 0.00 -1.16 0.00 0.00 32.46 29.23 1n4p n ARG 112 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1n4p s SER 113 N 0.51 5.76 0.26 0.55 1.04 -1.26 -4.84 113.70 115.72 1n4p s SER 113 Ca 0.56 -0.32 0.10 0.00 0.48 0.00 0.00 55.95 56.77 1n4p s SER 113 Cb 0.22 -0.98 0.29 0.00 0.10 0.00 0.00 66.02 65.66 1n4p s SER 113 CO -0.11 -0.55 1.58 -0.33 0.98 0.00 0.00 173.24 174.80 1n4p h GLU 114 N 0.84 0.01 -0.14 4.02 4.39 -2.00 -2.54 114.58 119.17 1n4p h GLU 114 Ca -0.43 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.11 1n4p h GLU 114 Cb 1.26 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.91 1n4p h GLU 114 CO 0.51 0.67 -0.55 0.07 -1.16 0.00 0.00 179.01 178.55 1n4p h ARG 115 N 0.01 0.42 -0.61 2.33 0.11 -1.97 -2.46 114.38 112.20 1n4p h ARG 115 Ca -0.01 -0.26 -0.10 0.00 0.10 0.00 0.00 59.98 59.72 1n4p h ARG 115 Cb 1.16 0.03 -0.02 0.00 1.11 0.00 0.00 29.97 32.25 1n4p h ARG 115 CO 0.09 0.85 -0.00 0.00 0.10 0.00 0.00 179.97 181.01 1n4p h ALA 116 N 1.09 0.82 -0.67 0.08 0.00 -1.84 -0.96 119.26 117.78 1n4p h ALA 116 Ca 0.01 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.63 1n4p h ALA 116 Cb 1.06 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 1n4p h ALA 116 CO 0.09 0.66 0.42 0.35 0.00 0.00 0.00 179.25 180.78 1n4p h PHE 117 N 0.97 0.79 -0.13 0.00 3.57 -1.24 -1.21 116.94 119.69 1n4p h PHE 117 Ca 0.17 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.59 1n4p h PHE 117 Cb 0.56 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 1n4p h PHE 117 CO 0.04 0.46 -0.37 0.87 -2.23 0.00 0.00 178.31 177.08 1n4p h LYS 118 N 0.84 0.28 -0.64 1.11 6.56 -1.12 -2.85 116.57 120.74 1n4p h LYS 118 Ca 0.26 -0.12 -0.04 0.00 -1.06 0.00 0.00 60.65 59.69 1n4p h LYS 118 Cb -0.01 -0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 31.62 1n4p h LYS 118 CO -0.10 0.61 0.23 1.25 -2.06 0.00 0.00 179.45 179.39 1n4p h LEU 119 N 0.24 0.87 -1.64 2.94 5.85 -0.05 -2.30 115.31 121.23 1n4p h LEU 119 Ca 0.03 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.58 1n4p h LEU 119 Cb 0.77 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 1n4p h LEU 119 CO 0.06 0.80 -0.17 0.71 -0.34 0.00 0.00 178.44 179.49 1n4p h THR 120 N 0.93 1.13 -0.65 1.05 1.35 -1.06 -1.44 112.91 114.21 1n4p h THR 120 Ca 0.21 -0.61 -0.02 0.00 -0.55 0.00 0.00 66.41 65.44 1n4p h THR 120 Cb 0.21 1.32 -0.03 0.00 -1.73 0.00 0.00 68.15 67.93 1n4p h THR 120 CO -0.02 0.18 0.33 -0.09 -0.25 0.00 0.00 175.52 175.67 1n4p h ARG 121 N 0.01 0.91 -0.03 4.72 2.43 -1.43 0.57 114.38 121.56 1n4p h ARG 121 Ca 0.00 -0.11 -0.23 0.00 -0.81 0.00 0.00 59.98 58.83 1n4p h ARG 121 Cb 0.31 -0.18 0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1n4p h ARG 121 CO 0.02 0.70 -0.87 -0.44 -1.51 0.00 0.00 179.97 177.86 1n4p h ASP 122 N 0.91 0.83 -1.01 -3.80 3.45 -1.34 -2.22 116.42 113.25 1n4p h ASP 122 Ca 0.23 -0.72 0.02 0.00 0.43 0.00 0.00 57.03 56.99 1n4p h ASP 122 Cb 0.07 -0.25 -0.05 0.00 -0.56 0.00 0.00 39.33 38.54 1n4p h ASP 122 CO -0.03 1.43 0.67 0.00 -1.57 0.00 0.00 179.24 179.74 1n4p h ALA 123 N 0.41 1.29 -0.29 3.45 0.00 -0.89 -1.21 119.26 122.02 1n4p h ALA 123 Ca -0.10 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.60 1n4p h ALA 123 Cb 1.54 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1n4p h ALA 123 CO 0.17 0.64 -0.39 0.82 0.00 0.00 0.00 179.25 180.50 1n4p h ILE 124 N 1.35 1.29 -0.23 0.00 2.04 -0.89 -0.97 117.51 120.10 1n4p h ILE 124 Ca 0.38 -1.56 -0.07 0.00 1.00 0.00 0.00 64.86 64.61 1n4p h ILE 124 Cb -0.12 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1n4p h ILE 124 CO -0.09 0.50 -0.15 -0.08 0.00 0.00 0.00 178.15 178.33 1n4p h GLU 125 N 0.57 0.38 0.01 2.37 4.81 -0.72 -1.96 114.58 120.04 1n4p h GLU 125 Ca 0.05 -0.11 -0.19 0.00 -0.13 0.00 0.00 59.36 58.98 1n4p h GLU 125 Cb 0.92 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.24 1n4p h GLU 125 CO 0.08 0.53 -0.88 -0.07 -0.73 0.00 0.00 179.01 177.94 1n4p h LEU 126 N 0.36 0.10 -5.88 1.64 3.38 -0.97 -3.43 115.31 110.50 1n4p h LEU 126 Ca 0.07 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1n4p h LEU 126 Cb 0.48 -0.03 -0.19 0.00 0.09 0.00 0.00 40.66 41.01 1n4p h LEU 126 CO 0.03 0.93 -0.37 0.21 0.09 0.00 0.00 178.44 179.33 1n4p s ASN 127 N -6.83 -1.32 0.00 -0.43 2.47 -0.39 -5.01 114.94 103.42 1n4p s ASN 127 Ca -0.01 -0.48 0.18 0.00 0.42 0.00 0.00 52.86 52.97 1n4p s ASN 127 Cb 0.11 1.71 1.02 0.00 -1.45 0.00 0.00 41.25 42.64 1n4p s ASN 127 CO 0.81 -0.17 1.51 0.00 -3.72 0.00 0.00 177.10 175.53 1n4p n ALA 128 N 4.52 2.09 0.76 1.71 0.00 -0.77 -2.80 120.51 126.02 1n4p n ALA 128 Ca 0.09 -0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.54 1n4p n ALA 128 Cb 0.57 -1.29 0.26 0.00 0.00 0.00 0.00 19.45 18.99 1n4p n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n4p n ALA 129 N -1.12 2.46 -2.74 0.00 0.00 -1.26 -4.68 120.51 113.17 1n4p n ALA 129 Ca 0.12 -0.78 -0.42 0.00 0.00 0.00 0.00 53.44 52.36 1n4p n ALA 129 Cb 0.09 -0.94 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 1n4p n ALA 129 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1n4p s ASN 130 N -1.63 6.27 0.46 0.00 3.84 -1.12 -4.88 114.94 117.88 1n4p s ASN 130 Ca 0.35 -1.04 0.13 0.00 0.21 0.00 0.00 52.86 52.51 1n4p s ASN 130 Cb 0.21 -2.47 1.09 0.00 -0.55 0.00 0.00 41.25 39.52 1n4p s ASN 130 CO 0.30 -1.51 2.06 0.10 -2.79 0.00 0.00 177.10 175.26 1n4p h TYR 131 N 9.63 0.28 -0.83 0.43 -0.00 -1.92 -2.03 116.97 122.54 1n4p h TYR 131 Ca -0.16 0.01 -0.04 0.00 0.00 0.00 0.00 58.73 58.54 1n4p h TYR 131 Cb 1.05 -0.09 -0.04 0.00 0.00 0.00 0.00 36.73 37.65 1n4p h TYR 131 CO 1.08 0.16 0.38 1.15 -0.00 0.00 0.00 178.16 180.93 1n4p h THR 132 N 0.28 1.26 -0.37 -0.90 2.02 -1.99 -0.97 112.91 112.24 1n4p h THR 132 Ca 0.14 -0.75 -0.00 0.00 0.77 0.00 0.00 66.41 66.57 1n4p h THR 132 Cb 0.22 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 1n4p h THR 132 CO -0.03 0.32 0.22 0.58 0.37 0.00 0.00 175.52 176.98 1n4p h VAL 133 N 1.18 1.12 -0.45 3.16 2.07 -1.78 -0.72 116.25 120.84 1n4p h VAL 133 Ca 0.28 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 1n4p h VAL 133 Cb 0.15 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1n4p h VAL 133 CO -0.03 0.13 0.06 -0.50 0.02 0.00 0.00 177.57 177.24 1n4p h TRP 134 N 0.48 0.72 -0.01 1.57 4.06 -1.33 -0.11 115.95 121.33 1n4p h TRP 134 Ca 0.13 -0.07 -0.00 0.00 2.06 0.00 0.00 58.89 61.01 1n4p h TRP 134 Cb 0.01 -0.21 -0.00 0.00 -1.00 0.00 0.00 29.16 27.96 1n4p h TRP 134 CO -0.04 0.65 0.00 1.25 -3.56 0.00 0.00 178.44 176.74 1n4p h HIS 135 N 0.66 0.02 -0.72 0.49 2.76 -0.80 -1.58 115.15 115.99 1n4p h HIS 135 Ca 0.14 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.35 1n4p h HIS 135 Cb 0.33 -0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.24 1n4p h HIS 135 CO 0.02 0.30 0.44 0.35 -1.30 0.00 0.00 177.93 177.74 1n4p h PHE 136 N -0.28 0.83 -0.78 5.26 3.57 -0.93 -0.15 116.94 124.47 1n4p h PHE 136 Ca 0.00 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.56 1n4p h PHE 136 Cb 0.30 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 1n4p h PHE 136 CO 0.03 0.47 0.51 -0.09 -2.23 0.00 0.00 178.31 177.00 1n4p h ARG 137 N 0.86 0.94 -0.35 1.11 2.43 -0.86 0.66 114.38 119.17 1n4p h ARG 137 Ca 0.29 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.28 1n4p h ARG 137 Cb 0.04 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.37 1n4p h ARG 137 CO -0.12 0.62 -0.27 0.00 -1.51 0.00 0.00 179.97 178.69 1n4p h ARG 138 N 0.97 0.72 -0.34 0.20 3.08 -0.06 0.14 114.38 119.08 1n4p h ARG 138 Ca 0.31 -0.31 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1n4p h ARG 138 Cb 0.03 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1n4p h ARG 138 CO -0.09 0.91 0.21 0.28 -1.07 0.00 0.00 179.97 180.21 1n4p h VAL 139 N 0.62 1.11 -0.65 2.04 2.07 0.30 -2.31 116.25 119.44 1n4p h VAL 139 Ca 0.08 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.29 1n4p h VAL 139 Cb 0.78 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 1n4p h VAL 139 CO 0.06 0.11 0.21 -0.07 0.02 0.00 0.00 177.57 177.90 1n4p h LEU 140 N 0.45 0.94 -1.04 2.57 3.38 -0.61 -0.35 115.31 120.65 1n4p h LEU 140 Ca 0.12 -0.21 0.16 0.00 0.09 0.00 0.00 57.88 58.05 1n4p h LEU 140 Cb 0.00 -0.25 -0.09 0.00 0.09 0.00 0.00 40.66 40.41 1n4p h LEU 140 CO -0.02 0.89 0.62 -0.07 0.09 0.00 0.00 178.44 179.95 1n4p h LEU 141 N 0.93 0.83 0.12 1.67 3.38 -0.31 0.23 115.31 122.17 1n4p h LEU 141 Ca 0.21 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 1n4p h LEU 141 Cb 0.29 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1n4p h LEU 141 CO -0.01 0.37 -0.06 0.03 0.09 0.00 0.00 178.44 178.87 1n4p h ARG 142 N 0.85 -0.16 -0.48 1.13 3.08 -0.94 -1.62 114.38 116.24 1n4p h ARG 142 Ca 0.53 0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.69 1n4p h ARG 142 Cb 0.72 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 30.71 1n4p h ARG 142 CO -0.31 0.23 -0.19 0.77 -1.07 0.00 0.00 179.97 179.40 1n4p h SER 143 N -0.96 -0.66 -0.17 7.04 0.02 -0.74 0.20 113.55 118.28 1n4p h SER 143 Ca -0.02 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1n4p h SER 143 Cb 0.46 0.38 0.00 0.00 0.14 0.00 0.00 62.40 63.38 1n4p h SER 143 CO 0.03 -0.22 0.00 0.18 -1.14 0.00 0.00 176.83 175.68 1n4p n LEU 144 N -5.39 1.12 -4.13 5.07 4.77 0.04 -4.93 117.00 113.54 1n4p n LEU 144 Ca 0.04 -0.53 -0.43 0.00 -0.03 0.00 0.00 56.01 55.07 1n4p n LEU 144 Cb 0.30 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.27 1n4p n LEU 144 CO 0.09 0.26 -0.24 0.00 -1.33 0.00 0.00 177.39 176.17 1n4p n GLN 145 N 0.05 -0.48 -1.76 3.23 6.02 0.06 -4.90 117.38 119.60 1n4p n GLN 145 Ca 0.10 0.09 -0.31 0.00 -0.01 0.00 0.00 57.00 56.87 1n4p n GLN 145 Cb 0.20 -2.83 0.03 0.00 1.02 0.00 0.00 30.24 28.66 1n4p n GLN 145 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1n4p s LYS 146 N -7.40 3.16 -0.37 -1.09 -0.14 -0.64 -4.96 119.74 108.31 1n4p s LYS 146 Ca 0.37 0.98 -0.28 0.00 -1.36 0.00 0.00 55.97 55.68 1n4p s LYS 146 Cb -0.20 -2.02 -0.01 0.00 -1.68 0.00 0.00 37.83 33.92 1n4p s LYS 146 CO 0.98 -0.92 1.74 0.34 -0.76 0.00 0.00 175.35 176.73 1n4p s ASP 147 N -3.59 5.91 0.45 2.83 3.68 -1.26 -4.86 116.67 119.83 1n4p s ASP 147 Ca 0.59 1.13 0.22 0.00 2.13 0.00 0.00 52.55 56.62 1n4p s ASP 147 Cb -0.14 -2.53 1.08 0.00 -1.45 0.00 0.00 42.92 39.88 1n4p s ASP 147 CO 0.50 -1.73 1.92 -0.07 0.13 0.00 0.00 175.17 175.92 1n4p h LEU 148 N 13.69 0.00 -1.31 -1.34 3.38 -1.95 -2.04 115.31 125.74 1n4p h LEU 148 Ca -0.32 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 1n4p h LEU 148 Cb 1.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1n4p h LEU 148 CO 1.06 0.23 -0.31 -0.61 0.09 0.00 0.00 178.44 178.90 1n4p h GLN 149 N 0.00 0.00 -0.07 1.13 5.75 -2.00 -1.31 115.11 118.61 1n4p h GLN 149 Ca -0.00 0.00 -0.23 0.00 -0.15 0.00 0.00 58.65 58.27 1n4p h GLN 149 Cb 0.57 0.00 0.02 0.00 1.07 0.00 0.00 27.48 29.14 1n4p h GLN 149 CO 0.03 0.31 -0.86 1.49 -2.65 0.00 0.00 178.83 177.14 1n4p h GLU 150 N 0.00 0.70 -0.16 1.69 4.57 -1.77 -3.07 114.58 116.54 1n4p h GLU 150 Ca -0.00 -0.67 -0.02 0.00 -1.18 0.00 0.00 59.36 57.48 1n4p h GLU 150 Cb 0.66 0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.41 1n4p h GLU 150 CO 0.04 1.26 -0.01 1.49 -1.18 0.00 0.00 179.01 180.61 1n4p h GLU 151 N 0.38 0.23 -0.53 1.92 4.57 -1.18 -1.21 114.58 118.76 1n4p h GLU 151 Ca -0.09 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.01 1n4p h GLU 151 Cb 1.51 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 30.04 1n4p h GLU 151 CO 0.17 0.27 0.13 0.52 -1.18 0.00 0.00 179.01 178.92 1n4p h MET 152 N 0.23 0.81 -0.41 1.92 2.86 -1.16 -0.15 114.93 119.02 1n4p h MET 152 Ca 0.05 -0.16 -0.15 0.00 -2.06 0.00 0.00 59.70 57.39 1n4p h MET 152 Cb 0.18 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1n4p h MET 152 CO 0.00 0.73 -0.32 -0.91 1.06 0.00 0.00 176.91 177.47 1n4p h ASN 153 N 0.78 0.98 0.77 1.22 2.35 -1.20 -1.01 115.58 119.48 1n4p h ASN 153 Ca 0.17 -0.42 -0.04 0.00 -0.55 0.00 0.00 56.30 55.47 1n4p h ASN 153 Cb 0.28 -0.27 0.01 0.00 0.05 0.00 0.00 38.32 38.38 1n4p h ASN 153 CO -0.00 1.21 -0.38 0.22 -1.65 0.00 0.00 177.43 176.83 1n4p h TYR 154 N 0.78 -0.98 -0.23 1.19 3.20 -0.80 -2.46 116.97 117.67 1n4p h TYR 154 Ca 0.08 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 1n4p h TYR 154 Cb 0.91 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.49 1n4p h TYR 154 CO 0.06 -0.61 0.02 0.97 -1.64 0.00 0.00 178.16 176.96 1n4p h ILE 155 N -1.05 1.14 -0.62 1.81 6.09 -1.07 -1.75 117.51 122.06 1n4p h ILE 155 Ca -0.11 -0.51 -0.02 0.00 -1.37 0.00 0.00 64.86 62.85 1n4p h ILE 155 Cb 0.81 0.94 -0.03 0.00 0.47 0.00 0.00 36.82 39.01 1n4p h ILE 155 CO 0.17 0.18 0.29 0.40 -3.07 0.00 0.00 178.15 176.12 1n4p h ILE 156 N 0.33 1.21 -0.09 2.19 2.04 -0.99 -1.02 117.51 121.18 1n4p h ILE 156 Ca 0.08 -0.59 -0.09 0.00 1.00 0.00 0.00 64.86 65.27 1n4p h ILE 156 Cb 0.19 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1n4p h ILE 156 CO 0.00 0.24 -0.28 0.00 0.00 0.00 0.00 178.15 178.12 1n4p h ALA 157 N 1.44 0.16 -0.41 1.87 0.00 -0.87 -2.90 119.26 118.55 1n4p h ALA 157 Ca 0.22 -0.41 0.05 0.00 0.00 0.00 0.00 54.91 54.76 1n4p h ALA 157 Cb 0.10 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1n4p h ALA 157 CO -0.03 0.17 0.16 0.82 0.00 0.00 0.00 179.25 180.37 1n4p h ILE 158 N -0.11 0.89 -0.72 0.00 1.08 -1.11 -2.51 117.51 115.03 1n4p h ILE 158 Ca -0.01 -0.11 -0.03 0.00 -0.39 0.00 0.00 64.86 64.31 1n4p h ILE 158 Cb 0.90 0.54 -0.03 0.00 -3.07 0.00 0.00 36.82 35.15 1n4p h ILE 158 CO 0.06 0.06 0.32 0.40 -0.69 0.00 0.00 178.15 178.30 1n4p h ILE 159 N 0.33 1.24 -0.34 -0.67 2.04 -1.26 -0.29 117.51 118.56 1n4p h ILE 159 Ca 0.19 -0.72 0.03 0.00 1.00 0.00 0.00 64.86 65.36 1n4p h ILE 159 Cb 0.16 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 1n4p h ILE 159 CO -0.18 0.29 0.23 -0.33 0.00 0.00 0.00 178.15 178.16 1n4p h GLU 160 N 1.01 0.31 0.00 2.37 5.08 -1.24 0.98 114.58 123.10 1n4p h GLU 160 Ca 0.24 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.47 1n4p h GLU 160 Cb 0.16 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1n4p h GLU 160 CO -0.03 0.21 -0.80 0.93 -1.00 0.00 0.00 179.01 178.33 1n4p h GLU 161 N 0.32 0.00 -2.01 2.33 5.08 -1.00 -3.39 114.58 115.92 1n4p h GLU 161 Ca 0.14 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.99 1n4p h GLU 161 Cb 0.16 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.01 1n4p h GLU 161 CO -0.03 0.38 -1.15 1.04 -1.00 0.00 0.00 179.01 178.25 1n4p n GLN 162 N -3.08 0.95 0.00 2.33 6.02 -0.18 -4.97 117.38 118.45 1n4p n GLN 162 Ca -0.02 -3.37 0.01 0.00 -0.01 0.00 0.00 57.00 53.61 1n4p n GLN 162 Cb 0.75 -1.55 0.04 0.00 1.02 0.00 0.00 30.24 30.50 1n4p n GLN 162 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1n4p n PRO 163 N 0.67 0.01 -0.15 -1.09 -0.04 0.24 -2.24 135.00 132.41 1n4p n PRO 163 Ca 0.24 0.38 0.08 0.00 -0.04 0.00 0.00 63.50 64.17 1n4p n PRO 163 Cb 0.60 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.72 1n4p n PRO 163 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1n4p n LYS 164 N -1.41 2.16 -2.93 0.54 4.76 -1.26 -4.82 118.16 115.19 1n4p n LYS 164 Ca 0.01 -1.97 -0.41 0.00 -2.87 0.00 0.00 58.31 53.07 1n4p n LYS 164 Cb 0.02 -1.37 -0.04 0.00 -1.84 0.00 0.00 35.03 31.80 1n4p n LYS 164 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1n4p s ASN 165 N -1.18 6.99 0.15 4.39 3.84 -0.95 -4.98 114.94 123.19 1n4p s ASN 165 Ca 0.28 1.20 -0.12 0.00 0.21 0.00 0.00 52.86 54.43 1n4p s ASN 165 Cb 0.16 -2.45 0.02 0.00 -0.55 0.00 0.00 41.25 38.44 1n4p s ASN 165 CO 0.23 -0.30 1.61 1.88 -2.79 0.00 0.00 177.10 177.73 1n4p h TYR 166 N 7.13 0.93 -0.71 0.43 0.05 -1.93 -3.23 116.97 119.65 1n4p h TYR 166 Ca -0.34 -0.15 -0.02 0.00 0.05 0.00 0.00 58.73 58.27 1n4p h TYR 166 Cb 1.16 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 38.62 1n4p h TYR 166 CO 0.69 0.87 0.35 1.96 -1.05 0.00 0.00 178.16 180.99 1n4p h GLN 167 N 0.72 1.00 -0.12 4.88 7.50 -1.93 -2.24 115.11 124.93 1n4p h GLN 167 Ca 0.14 -0.13 -0.13 0.00 0.50 0.00 0.00 58.65 59.04 1n4p h GLN 167 Cb 0.49 -0.19 -0.01 0.00 0.05 0.00 0.00 27.48 27.81 1n4p h GLN 167 CO 0.02 0.76 -0.49 -0.39 -1.50 0.00 0.00 178.83 177.23 1n4p h VAL 168 N 1.00 1.34 -0.02 -0.54 -1.51 -1.83 -1.17 116.25 113.51 1n4p h VAL 168 Ca 0.25 -1.72 -0.17 0.00 -1.23 0.00 0.00 66.70 63.82 1n4p h VAL 168 Cb 0.08 1.79 -0.01 0.00 -2.13 0.00 0.00 31.29 31.02 1n4p h VAL 168 CO -0.03 0.52 -0.76 -0.50 -1.23 0.00 0.00 177.57 175.56 1n4p h TRP 169 N 0.24 0.24 -0.39 5.19 4.06 -1.54 -2.40 115.95 121.35 1n4p h TRP 169 Ca 0.01 -0.11 -0.12 0.00 2.06 0.00 0.00 58.89 60.73 1n4p h TRP 169 Cb 0.96 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 29.07 1n4p h TRP 169 CO 0.02 0.86 -0.21 1.25 -3.56 0.00 0.00 178.44 176.80 1n4p h HIS 170 N 0.11 0.96 -0.24 0.49 2.76 -1.21 -2.18 115.15 115.85 1n4p h HIS 170 Ca -0.02 -0.25 0.01 0.00 -2.20 0.00 0.00 60.37 57.91 1n4p h HIS 170 Cb 1.33 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 30.06 1n4p h HIS 170 CO 0.02 1.01 0.13 1.25 -1.30 0.00 0.00 177.93 179.04 1n4p h HIS 171 N 0.64 0.25 -0.92 5.26 6.17 -1.14 -1.54 115.15 123.87 1n4p h HIS 171 Ca 0.08 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.18 1n4p h HIS 171 Cb 0.77 -0.08 -0.05 0.00 2.52 0.00 0.00 27.41 30.58 1n4p h HIS 171 CO 0.06 0.14 0.59 -0.09 0.71 0.00 0.00 177.93 179.34 1n4p h ARG 172 N 0.28 1.23 -0.60 5.26 2.43 -1.34 -1.96 114.38 119.68 1n4p h ARG 172 Ca 0.10 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 1n4p h ARG 172 Cb 0.01 -0.27 -0.03 0.00 -0.42 0.00 0.00 29.97 29.27 1n4p h ARG 172 CO -0.06 0.84 0.11 -0.09 -1.51 0.00 0.00 179.97 179.26 1n4p h ARG 173 N 1.26 0.96 -0.73 0.20 2.43 -0.93 -1.04 114.38 116.53 1n4p h ARG 173 Ca 0.33 -0.23 -0.06 0.00 -0.81 0.00 0.00 59.98 59.21 1n4p h ARG 173 Cb -0.10 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.29 1n4p h ARG 173 CO -0.07 0.88 0.22 0.28 -1.51 0.00 0.00 179.97 179.77 1n4p h VAL 174 N 0.91 1.26 -0.25 0.20 2.07 -0.79 -1.49 116.25 118.16 1n4p h VAL 174 Ca 0.19 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 1n4p h VAL 174 Cb 0.38 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1n4p h VAL 174 CO 0.01 0.36 0.11 -0.07 0.02 0.00 0.00 177.57 178.00 1n4p h LEU 175 N 1.09 0.33 -1.25 2.57 3.38 -0.85 -0.65 115.31 119.93 1n4p h LEU 175 Ca 0.23 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1n4p h LEU 175 Cb 0.32 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1n4p h LEU 175 CO -0.01 0.38 0.27 0.58 0.09 0.00 0.00 178.44 179.76 1n4p h VAL 176 N 0.26 1.19 -0.22 1.22 2.07 -1.01 0.09 116.25 119.85 1n4p h VAL 176 Ca 0.08 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 1n4p h VAL 176 Cb 0.14 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1n4p h VAL 176 CO -0.01 0.22 0.06 -0.33 0.02 0.00 0.00 177.57 177.52 1n4p h GLU 177 N 0.79 0.35 -0.17 1.57 5.08 -0.90 0.15 114.58 121.44 1n4p h GLU 177 Ca 0.20 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.50 1n4p h GLU 177 Cb 0.08 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1n4p h GLU 177 CO -0.03 0.46 0.01 -1.49 -1.00 0.00 0.00 179.01 176.97 1n4p h TRP 178 N 0.17 0.02 0.00 4.33 6.55 -0.45 -2.66 115.95 123.91 1n4p h TRP 178 Ca 0.07 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.92 1n4p h TRP 178 Cb 0.27 0.02 0.00 0.00 -0.86 0.00 0.00 29.16 28.58 1n4p h TRP 178 CO 0.01 -0.01 0.00 -0.07 -1.05 0.00 0.00 178.44 177.32 1n4p h LEU 179 N 0.07 0.00 1.24 -4.49 3.38 -0.94 -3.46 115.31 111.11 1n4p h LEU 179 Ca 0.08 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.71 1n4p h LEU 179 Cb 0.09 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1n4p h LEU 179 CO -0.12 0.00 -0.49 0.29 0.09 0.00 0.00 178.44 178.21 1n4p n LYS 180 N -2.63 -3.24 -3.97 1.13 4.76 0.52 -4.93 118.16 109.79 1n4p n LYS 180 Ca 0.04 0.57 -0.31 0.00 -2.87 0.00 0.00 58.31 55.74 1n4p n LYS 180 Cb 0.42 -5.27 -0.15 0.00 -1.84 0.00 0.00 35.03 28.19 1n4p n LYS 180 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1n4p s ASP 181 N -2.50 4.23 0.00 4.39 3.68 -1.19 -4.98 116.67 120.30 1n4p s ASP 181 Ca 0.26 -1.51 0.20 0.00 2.13 0.00 0.00 52.55 53.63 1n4p s ASP 181 Cb -0.13 -1.34 0.47 0.00 -1.45 0.00 0.00 42.92 40.47 1n4p s ASP 181 CO 0.32 -0.28 1.40 -0.81 0.13 0.00 0.00 175.17 175.93 1n4p n PRO 182 N 4.53 2.57 -0.05 4.34 -0.04 -1.26 -4.63 135.00 140.46 1n4p n PRO 182 Ca -0.08 -2.34 0.25 0.00 -0.04 0.00 0.00 63.50 61.29 1n4p n PRO 182 Cb 0.43 -1.47 0.72 0.00 -0.04 0.00 0.00 33.50 33.14 1n4p n PRO 182 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1n4p h SER 183 N 3.75 0.00 0.44 3.54 4.64 -2.01 -1.96 113.55 121.95 1n4p h SER 183 Ca 0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 1n4p h SER 183 Cb 0.91 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.95 1n4p h SER 183 CO 0.00 0.00 -1.77 0.00 -0.87 0.00 0.00 176.83 174.19 1n4p n GLN 184 N -3.96 0.64 -0.05 4.77 6.02 -1.26 -4.73 117.38 118.80 1n4p n GLN 184 Ca 0.13 0.21 -0.06 0.00 -0.01 0.00 0.00 57.00 57.27 1n4p n GLN 184 Cb 0.83 -1.74 -0.04 0.00 1.02 0.00 0.00 30.24 30.30 1n4p n GLN 184 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1n4p h GLU 185 N 0.00 -0.17 -0.99 -1.09 4.39 -1.67 -2.23 114.58 112.81 1n4p h GLU 185 Ca -0.29 0.01 0.20 0.00 0.34 0.00 0.00 59.36 59.62 1n4p h GLU 185 Cb 1.92 0.04 -0.10 0.00 -0.10 0.00 0.00 28.75 30.51 1n4p h GLU 185 CO 0.06 -0.12 0.62 -0.07 -1.16 0.00 0.00 179.01 178.34 1n4p h LEU 186 N -0.18 0.70 -0.22 1.33 3.38 -1.85 -0.12 115.31 118.35 1n4p h LEU 186 Ca 0.03 0.09 -0.22 0.00 0.09 0.00 0.00 57.88 57.87 1n4p h LEU 186 Cb 0.26 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 40.98 1n4p h LEU 186 CO -0.25 0.24 -0.77 -0.08 0.09 0.00 0.00 178.44 177.67 1n4p h GLU 187 N 0.67 0.71 -0.17 1.13 4.81 -1.85 -1.87 114.58 118.02 1n4p h GLU 187 Ca 0.56 -0.58 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1n4p h GLU 187 Cb 1.00 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1n4p h GLU 187 CO -0.34 1.19 0.07 0.35 -0.73 0.00 0.00 179.01 179.55 1n4p h PHE 188 N 0.48 0.25 -0.87 0.92 3.57 -0.62 -2.17 116.94 118.50 1n4p h PHE 188 Ca -0.05 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.41 1n4p h PHE 188 Cb 1.39 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 40.01 1n4p h PHE 188 CO 0.08 0.30 0.45 0.82 -2.23 0.00 0.00 178.31 177.72 1n4p h ILE 189 N 0.13 1.26 -0.15 1.41 2.04 -1.09 -1.78 117.51 119.32 1n4p h ILE 189 Ca 0.06 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.21 1n4p h ILE 189 Cb 0.15 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 1n4p h ILE 189 CO -0.01 0.31 0.04 0.00 0.00 0.00 0.00 178.15 178.49 1n4p h ALA 190 N 1.24 1.78 -0.26 1.87 0.00 -1.09 0.17 119.26 122.97 1n4p h ALA 190 Ca 0.30 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 1n4p h ALA 190 Cb 0.08 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1n4p h ALA 190 CO -0.04 0.18 -0.43 -0.44 0.00 0.00 0.00 179.25 178.51 1n4p h ASP 191 N 0.21 0.83 -0.22 0.00 3.32 -0.69 -1.91 116.42 117.96 1n4p h ASP 191 Ca 0.05 -0.53 -0.03 0.00 0.02 0.00 0.00 57.03 56.55 1n4p h ASP 191 Cb 0.09 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1n4p h ASP 191 CO -0.00 1.19 0.02 0.40 -1.72 0.00 0.00 179.24 179.13 1n4p h ILE 192 N 0.48 1.24 0.00 0.35 1.08 -0.87 -2.02 117.51 117.78 1n4p h ILE 192 Ca 0.02 -0.82 0.00 0.00 -0.39 0.00 0.00 64.86 63.67 1n4p h ILE 192 Cb 1.03 1.35 0.00 0.00 -3.07 0.00 0.00 36.82 36.13 1n4p h ILE 192 CO 0.10 0.26 0.00 0.18 -0.69 0.00 0.00 178.15 177.99 1n4p n LEU 193 N -4.69 0.27 0.14 1.44 4.77 0.52 -0.83 117.00 118.62 1n4p n LEU 193 Ca -0.04 0.60 0.08 0.00 -0.03 0.00 0.00 56.01 56.63 1n4p n LEU 193 Cb 0.22 -0.61 0.05 0.00 -2.33 0.00 0.00 43.42 40.74 1n4p n LEU 193 CO 0.37 -0.60 0.31 -1.13 -1.33 0.00 0.00 177.39 175.01 1n4p h ASN 194 N 0.00 0.00 0.55 -1.43 -0.73 -0.57 -2.16 115.58 111.24 1n4p h ASN 194 Ca 0.00 0.00 -0.03 0.00 1.87 0.00 0.00 56.30 58.14 1n4p h ASN 194 Cb 0.10 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.68 1n4p h ASN 194 CO 0.00 0.18 -1.48 0.00 -0.37 0.00 0.00 177.43 175.76 1n4p n GLN 195 N -2.95 0.63 -3.24 6.67 10.64 -0.01 -4.75 117.38 124.38 1n4p n GLN 195 Ca 0.00 0.01 -0.02 0.00 -1.83 0.00 0.00 57.00 55.15 1n4p n GLN 195 Cb 0.62 -1.70 -0.02 0.00 -0.86 0.00 0.00 30.24 28.28 1n4p n GLN 195 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1n4p s ASP 196 N -5.09 -1.02 0.00 2.61 2.15 -0.67 -5.03 116.67 109.62 1n4p s ASP 196 Ca -0.04 -0.89 0.04 0.00 0.43 0.00 0.00 52.55 52.09 1n4p s ASP 196 Cb 0.11 1.70 0.19 0.00 -0.30 0.00 0.00 42.92 44.63 1n4p s ASP 196 CO 0.84 -0.19 0.84 0.00 -0.17 0.00 0.00 175.17 176.49 1n4p n ALA 197 N 4.43 1.47 -0.28 3.66 0.00 -0.81 -2.20 120.51 126.78 1n4p n ALA 197 Ca 0.11 -0.02 0.01 0.00 0.00 0.00 0.00 53.44 53.54 1n4p n ALA 197 Cb 0.55 -1.06 0.02 0.00 0.00 0.00 0.00 19.45 18.95 1n4p n ALA 197 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1n4p n LYS 198 N -1.17 2.37 -1.58 0.00 5.02 -1.26 -4.83 118.16 116.71 1n4p n LYS 198 Ca 0.02 -1.48 -0.45 0.00 -2.02 0.00 0.00 58.31 54.38 1n4p n LYS 198 Cb 0.02 -0.98 -0.04 0.00 -0.02 0.00 0.00 35.03 34.01 1n4p n LYS 198 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1n4p n ASN 199 N -0.53 3.13 -0.30 4.39 2.85 -0.94 -4.85 115.26 119.01 1n4p n ASN 199 Ca 0.02 0.39 -0.02 0.00 -0.11 0.00 0.00 54.58 54.86 1n4p n ASN 199 Cb 0.33 -1.47 0.11 0.00 1.24 0.00 0.00 39.78 39.99 1n4p n ASN 199 CO 0.00 0.00 0.00 0.22 -2.11 0.00 0.00 177.26 175.37 1n4p h TYR 200 N 13.51 1.00 -0.66 1.20 3.20 -1.95 -2.45 116.97 130.82 1n4p h TYR 200 Ca -0.40 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.54 1n4p h TYR 200 Cb 1.26 -0.33 -0.05 0.00 1.54 0.00 0.00 36.73 39.16 1n4p h TYR 200 CO 0.94 0.57 0.40 0.45 -1.64 0.00 0.00 178.16 178.88 1n4p h HIS 201 N 1.03 0.74 0.05 -3.82 3.86 -1.88 -1.04 115.15 114.09 1n4p h HIS 201 Ca 0.33 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.56 1n4p h HIS 201 Cb 0.02 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.25 1n4p h HIS 201 CO -0.02 0.40 -0.02 0.00 0.86 0.00 0.00 177.93 179.15 1n4p h ALA 202 N 1.30 -0.06 -0.42 2.45 0.00 -1.77 -0.79 119.26 119.97 1n4p h ALA 202 Ca 0.27 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 1n4p h ALA 202 Cb 0.07 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1n4p h ALA 202 CO -0.13 -0.50 0.10 -1.49 0.00 0.00 0.00 179.25 177.23 1n4p h TRP 203 N -0.13 0.64 -0.20 0.00 4.06 -1.26 0.42 115.95 119.48 1n4p h TRP 203 Ca -0.01 -0.05 -0.03 0.00 2.06 0.00 0.00 58.89 60.87 1n4p h TRP 203 Cb 0.11 -0.19 -0.01 0.00 -1.00 0.00 0.00 29.16 28.07 1n4p h TRP 203 CO -0.05 0.56 0.02 0.37 -3.56 0.00 0.00 178.44 175.78 1n4p h GLN 204 N 0.62 0.34 -0.69 0.49 4.15 -0.94 -1.05 115.11 118.02 1n4p h GLN 204 Ca 0.14 -0.10 -0.02 0.00 0.77 0.00 0.00 58.65 59.45 1n4p h GLN 204 Cb 0.24 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.86 1n4p h GLN 204 CO -0.00 0.51 0.36 1.25 -1.93 0.00 0.00 178.83 179.02 1n4p h HIS 205 N 0.13 0.97 -0.74 3.99 2.76 -0.77 -1.87 115.15 119.61 1n4p h HIS 205 Ca 0.06 -0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.21 1n4p h HIS 205 Cb 0.34 -0.31 -0.04 0.00 1.55 0.00 0.00 27.41 28.96 1n4p h HIS 205 CO 0.02 0.70 0.49 -0.09 -1.30 0.00 0.00 177.93 177.76 1n4p h ARG 206 N 0.96 0.97 -0.31 5.26 2.43 -0.65 -0.45 114.38 122.59 1n4p h ARG 206 Ca 0.24 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.25 1n4p h ARG 206 Cb 0.07 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1n4p h ARG 206 CO -0.04 0.64 -0.24 1.96 -1.51 0.00 0.00 179.97 180.78 1n4p h GLN 207 N 1.00 0.60 -0.02 0.20 4.20 -0.88 -1.72 115.11 118.48 1n4p h GLN 207 Ca 0.27 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 1n4p h GLN 207 Cb -0.12 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.63 1n4p h GLN 207 CO -0.06 0.79 0.01 2.35 -0.67 0.00 0.00 178.83 181.25 1n4p h TRP 208 N 0.53 0.03 0.43 2.96 7.01 -0.68 -1.69 115.95 124.53 1n4p h TRP 208 Ca 0.07 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.06 1n4p h TRP 208 Cb 0.70 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.74 1n4p h TRP 208 CO 0.03 0.21 -0.31 0.28 -2.79 0.00 0.00 178.44 175.86 1n4p h VAL 209 N -0.15 0.37 -0.71 2.65 2.07 -0.99 0.46 116.25 119.95 1n4p h VAL 209 Ca 0.01 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 1n4p h VAL 209 Cb 0.19 0.37 -0.09 0.00 -1.52 0.00 0.00 31.29 30.24 1n4p h VAL 209 CO -0.00 0.00 0.27 0.40 0.02 0.00 0.00 177.57 178.26 1n4p h ILE 210 N -0.72 0.69 -0.07 4.57 2.04 -1.30 -0.77 117.51 121.94 1n4p h ILE 210 Ca -0.04 -0.15 -0.04 0.00 1.00 0.00 0.00 64.86 65.63 1n4p h ILE 210 Cb 0.61 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.91 1n4p h ILE 210 CO 0.01 0.08 -0.11 -0.61 0.00 0.00 0.00 178.15 177.52 1n4p h GLN 211 N 0.42 0.20 -0.44 2.37 5.75 -1.15 -0.12 115.11 122.15 1n4p h GLN 211 Ca 0.38 -0.12 -0.03 0.00 -0.15 0.00 0.00 58.65 58.73 1n4p h GLN 211 Cb 0.55 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.08 1n4p h GLN 211 CO -0.38 0.68 0.14 1.49 -2.65 0.00 0.00 178.83 178.11 1n4p h GLU 212 N -0.26 0.64 -0.16 1.69 4.57 -0.55 -3.09 114.58 117.42 1n4p h GLU 212 Ca 0.01 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1n4p h GLU 212 Cb 0.66 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 1n4p h GLU 212 CO 0.02 0.56 0.00 1.19 -1.18 0.00 0.00 179.01 179.60 1n4p n PHE 213 N -4.34 0.34 -3.69 0.92 3.01 -0.32 -5.02 117.46 108.36 1n4p n PHE 213 Ca 0.03 -0.67 -0.30 0.00 1.01 0.00 0.00 57.45 57.52 1n4p n PHE 213 Cb 0.18 -0.12 0.03 0.00 -0.01 0.00 0.00 39.48 39.56 1n4p n PHE 213 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1n4p n ARG 214 N -0.35 -1.13 -2.50 -1.08 0.63 -0.21 -4.92 116.66 107.10 1n4p n ARG 214 Ca 0.11 0.53 -0.34 0.00 -0.92 0.00 0.00 57.85 57.23 1n4p n ARG 214 Cb 0.51 -3.82 0.01 0.00 0.45 0.00 0.00 32.46 29.60 1n4p n ARG 214 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1n4p n LEU 215 N -3.91 6.09 0.14 6.15 4.77 -0.29 -4.76 117.00 125.19 1n4p n LEU 215 Ca -0.11 -5.29 0.05 0.00 -0.03 0.00 0.00 56.01 50.63 1n4p n LEU 215 Cb 0.59 -0.83 0.05 0.00 -2.33 0.00 0.00 43.42 40.90 1n4p n LEU 215 CO 0.66 2.10 0.44 -0.50 -1.33 0.00 0.00 177.39 178.76 1n4p h TRP 216 N 3.22 0.00 -0.93 -1.77 4.06 -1.91 -3.40 115.95 115.21 1n4p h TRP 216 Ca 0.39 0.00 0.33 0.00 2.06 0.00 0.00 58.89 61.67 1n4p h TRP 216 Cb 0.43 0.00 -0.17 0.00 -1.00 0.00 0.00 29.16 28.42 1n4p h TRP 216 CO 1.06 0.36 0.29 -0.25 -3.56 0.00 0.00 178.44 176.34 1n4p n ASP 217 N -3.12 0.14 -0.18 -3.49 8.00 -1.26 -2.48 116.55 114.15 1n4p n ASP 217 Ca 0.01 1.57 0.02 0.00 0.71 0.00 0.00 54.79 57.10 1n4p n ASP 217 Cb 0.69 -0.68 0.03 0.00 -0.02 0.00 0.00 41.12 41.14 1n4p n ASP 217 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1n4p n ASN 218 N -5.23 1.79 -0.18 -2.24 4.13 -1.26 -4.75 115.26 107.52 1n4p n ASN 218 Ca 0.30 -1.56 -0.09 0.00 1.68 0.00 0.00 54.58 54.90 1n4p n ASN 218 Cb 0.99 -0.04 0.01 0.00 -1.54 0.00 0.00 39.78 39.20 1n4p n ASN 218 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1n4p h GLU 219 N 0.70 0.86 0.00 3.52 4.57 -1.72 -2.14 114.58 120.37 1n4p h GLU 219 Ca 0.00 -0.23 -0.01 0.00 -1.18 0.00 0.00 59.36 57.94 1n4p h GLU 219 Cb 0.36 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1n4p h GLU 219 CO 0.00 0.85 -0.04 1.25 -1.18 0.00 0.00 179.01 179.89 1n4p h LEU 220 N 0.74 0.00 0.07 1.64 5.85 -1.85 0.88 115.31 122.63 1n4p h LEU 220 Ca 0.16 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.60 1n4p h LEU 220 Cb 0.41 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.45 1n4p h LEU 220 CO 0.01 0.04 -1.20 -0.61 -0.34 0.00 0.00 178.44 176.34 1n4p h GLN 221 N 0.00 0.40 -0.70 1.25 4.15 -1.81 -2.16 115.11 116.24 1n4p h GLN 221 Ca -0.00 -0.58 -0.05 0.00 0.77 0.00 0.00 58.65 58.79 1n4p h GLN 221 Cb 0.09 0.20 -0.03 0.00 0.21 0.00 0.00 27.48 27.95 1n4p h GLN 221 CO 0.00 1.25 0.23 -0.92 -1.93 0.00 0.00 178.83 177.46 1n4p h TYR 222 N 0.15 1.12 -0.18 3.99 3.20 -0.49 -1.65 116.97 123.12 1n4p h TYR 222 Ca -0.15 -0.11 -0.01 0.00 3.14 0.00 0.00 58.73 61.61 1n4p h TYR 222 Cb 1.89 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.83 1n4p h TYR 222 CO 0.08 0.89 0.07 0.28 -1.64 0.00 0.00 178.16 177.84 1n4p h VAL 223 N 1.03 1.15 -0.88 1.81 2.07 -0.89 -1.63 116.25 118.90 1n4p h VAL 223 Ca 0.23 -0.45 0.10 0.00 0.82 0.00 0.00 66.70 67.40 1n4p h VAL 223 Cb 0.29 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 1n4p h VAL 223 CO -0.01 0.14 0.57 0.44 0.02 0.00 0.00 177.57 178.73 1n4p h ASP 224 N 0.14 0.78 -0.23 0.57 3.32 -1.10 -0.58 116.42 119.32 1n4p h ASP 224 Ca 0.06 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.08 1n4p h ASP 224 Cb 0.16 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1n4p h ASP 224 CO -0.01 0.46 -0.06 1.56 -1.72 0.00 0.00 179.24 179.48 1n4p h GLN 225 N 0.86 0.44 -0.07 3.56 1.08 -0.94 -2.99 115.11 117.06 1n4p h GLN 225 Ca 0.41 -0.17 -0.12 0.00 -1.45 0.00 0.00 58.65 57.32 1n4p h GLN 225 Cb 0.42 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.81 1n4p h GLN 225 CO -0.17 0.68 -0.50 -0.07 -0.95 0.00 0.00 178.83 177.81 1n4p h LEU 226 N 0.17 0.18 -1.60 1.46 3.38 -0.73 -2.57 115.31 115.61 1n4p h LEU 226 Ca 0.06 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1n4p h LEU 226 Cb 0.52 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 1n4p h LEU 226 CO 0.02 0.65 -0.02 -0.07 0.09 0.00 0.00 178.44 179.12 1n4p h LEU 227 N 0.14 0.00 0.09 1.67 3.38 -1.11 -1.18 115.31 118.29 1n4p h LEU 227 Ca 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.71 1n4p h LEU 227 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1n4p h LEU 227 CO 0.07 0.02 -1.21 0.11 0.09 0.00 0.00 178.44 177.52 1n4p h LYS 228 N 0.00 0.29 -0.09 1.13 1.57 -1.32 -2.33 116.57 115.83 1n4p h LYS 228 Ca -0.00 -0.46 -0.13 0.00 -1.87 0.00 0.00 60.65 58.18 1n4p h LYS 228 Cb 0.47 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1n4p h LYS 228 CO 0.00 1.21 -0.54 0.93 -0.57 0.00 0.00 179.45 180.48 1n4p h GLU 229 N 0.09 0.25 -0.78 3.15 5.08 -1.10 -3.42 114.58 117.86 1n4p h GLU 229 Ca -0.13 -0.16 0.02 0.00 -1.00 0.00 0.00 59.36 58.09 1n4p h GLU 229 Cb 1.92 0.02 -0.19 0.00 0.50 0.00 0.00 28.75 31.00 1n4p h GLU 229 CO 0.20 0.73 -0.33 0.34 -1.00 0.00 0.00 179.01 178.95 1n4p s ASP 230 N -6.89 -1.23 0.04 1.42 2.15 -0.52 -5.01 116.67 106.62 1n4p s ASP 230 Ca -0.04 -0.39 0.08 0.00 0.43 0.00 0.00 52.55 52.62 1n4p s ASP 230 Cb 0.12 1.62 0.35 0.00 -0.30 0.00 0.00 42.92 44.72 1n4p s ASP 230 CO 0.79 -0.16 1.25 0.55 -0.17 0.00 0.00 175.17 177.43 1n4p n VAL 231 N 4.54 1.52 1.23 1.11 3.14 -0.88 -1.77 118.33 127.22 1n4p n VAL 231 Ca 0.09 0.42 0.13 0.00 -2.96 0.00 0.00 64.34 62.01 1n4p n VAL 231 Cb 0.58 -1.33 0.36 0.00 -1.06 0.00 0.00 33.84 32.39 1n4p n VAL 231 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1n4p n ARG 232 N -1.59 1.94 -2.24 1.45 1.74 -1.26 -4.76 116.66 111.94 1n4p n ARG 232 Ca 0.01 -1.37 -0.41 0.00 -0.77 0.00 0.00 57.85 55.32 1n4p n ARG 232 Cb 0.07 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.02 1n4p n ARG 232 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1n4p s ASN 233 N -1.91 5.79 0.53 0.55 3.84 -0.73 -4.85 114.94 118.17 1n4p s ASN 233 Ca 0.34 0.34 0.19 0.00 0.21 0.00 0.00 52.86 53.94 1n4p s ASN 233 Cb 0.20 -2.54 1.34 0.00 -0.55 0.00 0.00 41.25 39.70 1n4p s ASN 233 CO 0.31 -1.97 2.13 -1.13 -2.79 0.00 0.00 177.10 173.66 1n4p h ASN 234 N 12.56 0.00 -0.46 -4.21 -1.24 -1.90 -2.22 115.58 118.11 1n4p h ASN 234 Ca -0.27 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.65 1n4p h ASN 234 Cb 1.12 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.15 1n4p h ASN 234 CO 1.19 0.00 -0.02 0.28 -1.29 0.00 0.00 177.43 177.59 1n4p h SER 235 N 0.00 0.86 -0.13 1.15 0.02 -1.89 -2.26 113.55 111.30 1n4p h SER 235 Ca 0.04 -0.23 -0.16 0.00 -0.84 0.00 0.00 61.79 60.60 1n4p h SER 235 Cb 0.18 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.48 1n4p h SER 235 CO -0.00 0.93 -0.51 0.58 -1.14 0.00 0.00 176.83 176.69 1n4p h VAL 236 N 0.81 1.30 -0.43 2.27 2.07 -1.72 -1.37 116.25 119.17 1n4p h VAL 236 Ca 0.15 -1.71 -0.07 0.00 0.82 0.00 0.00 66.70 65.88 1n4p h VAL 236 Cb 0.51 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 1n4p h VAL 236 CO 0.03 0.55 -0.03 -0.50 0.02 0.00 0.00 177.57 177.64 1n4p h TRP 237 N 0.55 0.76 -0.63 1.57 4.06 -1.41 -0.43 115.95 120.42 1n4p h TRP 237 Ca 0.02 -0.11 -0.09 0.00 2.06 0.00 0.00 58.89 60.77 1n4p h TRP 237 Cb 1.07 -0.21 -0.02 0.00 -1.00 0.00 0.00 29.16 29.00 1n4p h TRP 237 CO 0.05 0.73 0.04 -0.97 -3.56 0.00 0.00 178.44 174.74 1n4p h ASN 238 N 0.67 1.06 -0.82 -3.49 -1.24 -1.15 -2.56 115.58 108.04 1n4p h ASN 238 Ca 0.13 -0.28 -0.03 0.00 0.71 0.00 0.00 56.30 56.82 1n4p h ASN 238 Cb 0.45 -0.28 -0.04 0.00 0.73 0.00 0.00 38.32 39.18 1n4p h ASN 238 CO 0.02 1.08 0.38 -0.61 -1.29 0.00 0.00 177.43 177.02 1n4p h GLN 239 N 1.00 1.19 -0.27 6.67 5.75 -0.57 -1.26 115.11 127.62 1n4p h GLN 239 Ca 0.18 -0.18 0.03 0.00 -0.15 0.00 0.00 58.65 58.53 1n4p h GLN 239 Cb 0.52 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.83 1n4p h GLN 239 CO 0.02 0.92 0.11 -0.09 -2.65 0.00 0.00 178.83 177.14 1n4p h ARG 240 N 1.17 0.23 -0.19 1.69 2.43 -0.78 0.36 114.38 119.29 1n4p h ARG 240 Ca 0.28 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.37 1n4p h ARG 240 Cb 0.13 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1n4p h ARG 240 CO -0.03 0.15 -0.16 1.25 -1.51 0.00 0.00 179.97 179.67 1n4p h HIS 241 N 0.24 0.33 -0.02 2.20 2.76 -1.14 -1.96 115.15 117.56 1n4p h HIS 241 Ca 0.12 -0.05 -0.00 0.00 -2.20 0.00 0.00 60.37 58.24 1n4p h HIS 241 Cb 0.07 -0.09 -0.00 0.00 1.55 0.00 0.00 27.41 28.94 1n4p h HIS 241 CO -0.12 0.46 0.01 0.35 -1.30 0.00 0.00 177.93 177.33 1n4p h PHE 242 N 0.29 0.03 0.68 5.26 3.57 -0.26 -1.12 116.94 125.39 1n4p h PHE 242 Ca 0.06 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 1n4p h PHE 242 Cb 0.45 -0.01 0.01 0.00 2.79 0.00 0.00 35.95 39.19 1n4p h PHE 242 CO 0.01 0.17 -0.33 0.28 -2.23 0.00 0.00 178.31 176.21 1n4p h VAL 243 N -0.11 0.28 0.01 1.41 2.07 -0.75 -2.81 116.25 116.35 1n4p h VAL 243 Ca 0.01 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.42 1n4p h VAL 243 Cb 0.15 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1n4p h VAL 243 CO -0.00 0.01 -0.08 0.40 0.02 0.00 0.00 177.57 177.92 1n4p h ILE 244 N -1.01 0.79 0.00 4.57 2.04 -1.40 -1.75 117.51 120.76 1n4p h ILE 244 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1n4p h ILE 244 Cb 0.73 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1n4p h ILE 244 CO 0.15 0.00 0.00 0.77 0.00 0.00 0.00 178.15 179.07 1n4p h SER 245 N -0.15 0.00 -0.01 1.72 4.64 -1.28 0.82 113.55 119.30 1n4p h SER 245 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1n4p h SER 245 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1n4p h SER 245 CO -0.08 0.00 -0.40 0.59 -0.87 0.00 0.00 176.83 176.07 1n4p n ASN 246 N -2.41 2.16 0.00 4.97 3.02 -0.86 -4.44 115.26 117.71 1n4p n ASN 246 Ca 0.00 -1.58 0.00 0.00 -0.03 0.00 0.00 54.58 52.98 1n4p n ASN 246 Cb 0.16 0.40 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 1n4p n ASN 246 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1n4p n THR 247 N 0.17 0.00 -0.10 3.41 -2.24 -0.67 -4.93 114.28 109.92 1n4p n THR 247 Ca 0.10 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.84 1n4p n THR 247 Cb 0.49 -0.01 0.16 0.00 -2.10 0.00 0.00 70.33 68.87 1n4p n THR 247 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1n4p h THR 248 N 0.00 1.24 0.00 4.28 1.35 -1.79 -3.50 112.91 114.50 1n4p h THR 248 Ca 0.00 -1.01 0.00 0.00 -0.55 0.00 0.00 66.41 64.85 1n4p h THR 248 Cb 0.00 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 67.31 1n4p h THR 248 CO 0.00 0.36 0.00 0.61 -0.25 0.00 0.00 175.52 176.24 1n4p n GLY 249 N -0.63 -0.59 0.39 5.82 0.00 0.20 -4.72 105.19 105.67 1n4p n GLY 249 Ca 0.02 -1.77 0.05 0.00 0.00 0.00 0.00 46.02 44.33 1n4p n GLY 249 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1n4p n TYR 250 N -0.61 0.00 0.31 1.61 4.02 -1.26 -4.56 117.16 116.67 1n4p n TYR 250 Ca 0.00 0.00 0.17 0.00 -0.01 0.00 0.00 57.90 58.06 1n4p n TYR 250 Cb 0.00 0.00 0.74 0.00 -0.02 0.00 0.00 39.34 40.06 1n4p n TYR 250 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1n4p h SER 251 N 1.94 0.00 -3.40 7.72 4.64 -2.00 -3.38 113.55 119.07 1n4p h SER 251 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 1n4p h SER 251 Cb 0.42 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.44 1n4p h SER 251 CO 0.00 0.00 0.99 -0.62 -0.87 0.00 0.00 176.83 176.33 1n4p s ASP 252 N -5.21 6.47 0.51 4.97 3.68 -1.26 -4.88 116.67 120.95 1n4p s ASP 252 Ca 0.00 0.40 0.35 0.00 2.13 0.00 0.00 52.55 55.43 1n4p s ASP 252 Cb 0.10 -2.55 1.48 0.00 -1.45 0.00 0.00 42.92 40.50 1n4p s ASP 252 CO 0.47 -1.40 1.75 0.03 0.13 0.00 0.00 175.17 176.14 1n4p h ARG 253 N 9.78 0.08 -0.24 4.34 3.08 -1.99 0.52 114.38 129.95 1n4p h ARG 253 Ca -0.25 -0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.67 1n4p h ARG 253 Cb 1.07 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 1n4p h ARG 253 CO 1.14 0.05 -0.40 0.00 -1.07 0.00 0.00 179.97 179.70 1n4p h ALA 254 N 1.41 0.85 -0.07 0.04 0.00 -1.93 -1.24 119.26 118.32 1n4p h ALA 254 Ca 0.65 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 1n4p h ALA 254 Cb 2.37 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 20.05 1n4p h ALA 254 CO -0.10 0.64 -0.38 0.28 0.00 0.00 0.00 179.25 179.69 1n4p h VAL 255 N 0.47 1.41 -0.70 0.00 2.07 -0.35 -2.14 116.25 117.01 1n4p h VAL 255 Ca 0.04 -1.77 0.05 0.00 0.82 0.00 0.00 66.70 65.84 1n4p h VAL 255 Cb 0.90 2.31 -0.05 0.00 -1.52 0.00 0.00 31.29 32.93 1n4p h VAL 255 CO 0.08 0.52 0.41 0.25 0.02 0.00 0.00 177.57 178.85 1n4p h LEU 256 N -0.08 0.65 -0.57 2.57 5.85 -1.21 -0.18 115.31 122.34 1n4p h LEU 256 Ca -0.03 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 1n4p h LEU 256 Cb 1.03 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 1n4p h LEU 256 CO 0.08 0.43 0.07 -0.08 -0.34 0.00 0.00 178.44 178.60 1n4p h GLU 257 N 0.78 0.96 -0.43 1.25 4.81 -1.23 0.16 114.58 120.87 1n4p h GLU 257 Ca 0.30 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1n4p h GLU 257 Cb 0.11 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1n4p h GLU 257 CO -0.15 0.93 0.27 -0.09 -0.73 0.00 0.00 179.01 179.24 1n4p h ARG 258 N 0.85 0.57 -0.20 1.92 2.43 -0.71 -0.62 114.38 118.62 1n4p h ARG 258 Ca 0.17 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1n4p h ARG 258 Cb 0.45 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1n4p h ARG 258 CO 0.02 0.40 -0.07 0.93 -1.51 0.00 0.00 179.97 179.73 1n4p h GLU 259 N 0.57 0.41 -0.80 0.20 4.39 -0.84 0.20 114.58 118.71 1n4p h GLU 259 Ca 0.16 -0.17 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 1n4p h GLU 259 Cb -0.04 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.56 1n4p h GLU 259 CO -0.03 0.67 0.40 0.28 -1.16 0.00 0.00 179.01 179.18 1n4p h VAL 260 N 0.12 1.24 -0.29 3.13 2.07 -0.90 -0.17 116.25 121.45 1n4p h VAL 260 Ca 0.05 -0.65 -0.05 0.00 0.82 0.00 0.00 66.70 66.87 1n4p h VAL 260 Cb 0.54 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1n4p h VAL 260 CO 0.02 0.28 -0.00 -0.61 0.02 0.00 0.00 177.57 177.29 1n4p h GLN 261 N 1.13 0.52 -0.69 1.57 5.75 -1.01 -2.13 115.11 120.25 1n4p h GLN 261 Ca 0.28 -0.17 0.02 0.00 -0.15 0.00 0.00 58.65 58.63 1n4p h GLN 261 Cb 0.08 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.55 1n4p h GLN 261 CO -0.04 0.67 0.45 -0.92 -2.65 0.00 0.00 178.83 176.33 1n4p h TYR 262 N 0.31 0.84 -0.27 3.99 3.20 -0.51 -1.91 116.97 122.61 1n4p h TYR 262 Ca 0.08 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 1n4p h TYR 262 Cb 0.43 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 1n4p h TYR 262 CO 0.04 0.51 0.01 1.15 -1.64 0.00 0.00 178.16 178.23 1n4p h THR 263 N 0.90 1.25 -0.55 1.81 2.02 -0.95 -2.21 112.91 115.18 1n4p h THR 263 Ca 0.26 -0.89 0.03 0.00 0.77 0.00 0.00 66.41 66.58 1n4p h THR 263 Cb -0.06 1.30 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 1n4p h THR 263 CO -0.07 0.28 0.36 -0.07 0.37 0.00 0.00 175.52 176.39 1n4p h LEU 264 N 0.27 0.56 -0.55 2.58 3.38 -1.17 0.22 115.31 120.59 1n4p h LEU 264 Ca 0.08 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1n4p h LEU 264 Cb 0.40 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1n4p h LEU 264 CO 0.01 0.39 0.19 -0.33 0.09 0.00 0.00 178.44 178.79 1n4p h GLU 265 N 0.65 0.85 -0.27 1.13 4.39 -1.03 -0.50 114.58 119.81 1n4p h GLU 265 Ca 0.22 -0.17 -0.12 0.00 0.34 0.00 0.00 59.36 59.62 1n4p h GLU 265 Cb 0.07 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1n4p h GLU 265 CO -0.06 0.76 -0.35 0.52 -1.16 0.00 0.00 179.01 178.72 1n4p h MET 266 N 0.77 0.59 -0.59 2.33 2.86 -0.57 -2.68 114.93 117.64 1n4p h MET 266 Ca 0.18 -0.28 -0.07 0.00 -2.06 0.00 0.00 59.70 57.47 1n4p h MET 266 Cb 0.25 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 1n4p h MET 266 CO -0.01 0.86 0.08 0.82 1.06 0.00 0.00 176.91 179.72 1n4p h ILE 267 N 0.50 1.26 -0.29 -1.22 2.04 -0.31 -2.21 117.51 117.28 1n4p h ILE 267 Ca 0.05 -1.02 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 1n4p h ILE 267 Cb 0.84 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 1n4p h ILE 267 CO 0.07 0.37 0.09 0.11 0.00 0.00 0.00 178.15 178.80 1n4p h LYS 268 N 0.89 0.41 -0.19 2.37 1.79 -0.87 0.30 116.57 121.26 1n4p h LYS 268 Ca 0.18 -0.05 -0.20 0.00 -2.18 0.00 0.00 60.65 58.39 1n4p h LYS 268 Cb 0.44 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.02 1n4p h LYS 268 CO 0.01 0.37 -0.67 -0.07 -1.08 0.00 0.00 179.45 178.01 1n4p h LEU 269 N 0.41 0.87 -6.16 2.94 4.07 -1.13 -3.39 115.31 112.93 1n4p h LEU 269 Ca 0.10 -0.53 -0.53 0.00 0.08 0.00 0.00 57.88 57.01 1n4p h LEU 269 Cb 0.13 -0.25 -0.35 0.00 1.08 0.00 0.00 40.66 41.26 1n4p h LEU 269 CO -0.01 1.31 -0.92 0.52 -1.08 0.00 0.00 178.44 178.27 1n4p n VAL 270 N -3.95 -1.04 -0.06 1.22 0.31 -0.87 -5.02 118.33 108.93 1n4p n VAL 270 Ca -0.06 -3.11 0.24 0.00 -0.01 0.00 0.00 64.34 61.40 1n4p n VAL 270 Cb 0.69 -1.29 0.72 0.00 -0.91 0.00 0.00 33.84 33.04 1n4p n VAL 270 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1n4p h PRO 271 N 5.47 0.00 -3.55 5.55 0.13 -0.62 -3.26 132.00 135.73 1n4p h PRO 271 Ca 0.23 0.00 -0.79 0.00 -0.87 0.00 0.00 66.00 64.57 1n4p h PRO 271 Cb 0.94 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 31.82 1n4p h PRO 271 CO 0.33 0.00 0.89 1.58 -0.23 0.00 0.00 178.00 180.56 1n4p n HIS 272 N -4.19 4.03 -3.47 1.56 -0.00 -1.26 -4.88 115.22 107.01 1n4p n HIS 272 Ca 0.13 -3.28 -0.23 0.00 0.46 0.00 0.00 57.72 54.80 1n4p n HIS 272 Cb 0.77 -1.67 -0.12 0.00 -0.12 0.00 0.00 29.99 28.84 1n4p n HIS 272 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1n4p s ASN 273 N 0.54 2.55 0.28 0.26 2.47 -1.23 -5.03 114.94 114.78 1n4p s ASN 273 Ca 0.34 -0.99 0.01 0.00 0.42 0.00 0.00 52.86 52.64 1n4p s ASN 273 Cb -0.02 0.10 0.55 0.00 -1.45 0.00 0.00 41.25 40.43 1n4p s ASN 273 CO 0.00 -0.41 1.83 -0.08 -3.72 0.00 0.00 177.10 174.72 1n4p h GLU 274 N 8.33 0.95 -0.30 0.43 4.81 -1.93 -2.64 114.58 124.24 1n4p h GLU 274 Ca -0.16 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.05 1n4p h GLU 274 Cb 1.05 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 30.17 1n4p h GLU 274 CO 0.38 0.63 0.06 0.77 -0.73 0.00 0.00 179.01 180.12 1n4p h SER 275 N 0.98 0.02 -0.37 1.04 0.02 -1.92 0.26 113.55 113.58 1n4p h SER 275 Ca 0.49 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.48 1n4p h SER 275 Cb 0.49 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 1n4p h SER 275 CO -0.27 0.05 0.20 0.00 -1.14 0.00 0.00 176.83 175.67 1n4p h ALA 276 N 1.22 0.48 -0.53 3.77 0.00 -1.77 -1.53 119.26 120.89 1n4p h ALA 276 Ca 0.14 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1n4p h ALA 276 Cb 0.14 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1n4p h ALA 276 CO -0.18 0.01 0.08 -1.49 0.00 0.00 0.00 179.25 177.67 1n4p h TRP 277 N 0.47 0.89 -0.36 0.00 4.06 -1.23 -1.41 115.95 118.36 1n4p h TRP 277 Ca 0.13 -0.10 -0.09 0.00 2.06 0.00 0.00 58.89 60.89 1n4p h TRP 277 Cb 0.07 -0.25 -0.02 0.00 -1.00 0.00 0.00 29.16 27.97 1n4p h TRP 277 CO -0.02 0.77 -0.14 -0.91 -3.56 0.00 0.00 178.44 174.57 1n4p h ASN 278 N 0.80 0.64 0.05 -3.49 2.35 -0.18 -1.11 115.58 114.65 1n4p h ASN 278 Ca 0.17 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1n4p h ASN 278 Cb 0.37 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.57 1n4p h ASN 278 CO 0.01 0.81 -0.02 0.22 -1.65 0.00 0.00 177.43 176.79 1n4p h TYR 279 N 0.59 -0.06 -0.43 1.19 3.20 -0.90 0.30 116.97 120.86 1n4p h TYR 279 Ca 0.10 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.04 1n4p h TYR 279 Cb 0.58 0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.82 1n4p h TYR 279 CO 0.03 0.26 0.08 1.25 -1.64 0.00 0.00 178.16 178.14 1n4p h LEU 280 N -0.39 0.01 -0.59 2.82 5.85 -1.12 -0.85 115.31 121.04 1n4p h LEU 280 Ca -0.01 0.07 -0.14 0.00 0.84 0.00 0.00 57.88 58.65 1n4p h LEU 280 Cb 0.35 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1n4p h LEU 280 CO 0.01 0.04 -0.33 0.50 -0.34 0.00 0.00 178.44 178.32 1n4p h LYS 281 N 0.22 0.76 -0.54 1.25 3.64 -1.16 -3.15 116.57 117.58 1n4p h LYS 281 Ca 0.21 -0.36 0.05 0.00 -1.27 0.00 0.00 60.65 59.28 1n4p h LYS 281 Cb 0.26 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.02 1n4p h LYS 281 CO -0.27 0.98 0.27 0.78 -2.27 0.00 0.00 179.45 178.94 1n4p h GLY 282 N 0.94 0.77 1.53 5.01 0.00 0.74 0.30 103.07 112.35 1n4p h GLY 282 Ca 0.07 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.22 1n4p h GLY 282 CO 0.08 0.10 0.00 0.29 0.00 0.00 0.00 176.54 177.00 1n4p n ILE 283 N -4.89 0.01 -0.01 2.60 -5.35 -0.43 -3.96 119.36 107.32 1n4p n ILE 283 Ca 0.06 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.53 1n4p n ILE 283 Cb 0.16 -0.51 -0.02 0.00 -1.74 0.00 0.00 39.64 37.53 1n4p n ILE 283 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1n4p n LEU 284 N -1.27 0.00 -0.33 7.28 4.77 -0.84 -4.76 117.00 121.85 1n4p n LEU 284 Ca 0.15 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.32 1n4p n LEU 284 Cb 0.23 0.07 0.45 0.00 -2.33 0.00 0.00 43.42 41.83 1n4p n LEU 284 CO 0.22 0.07 1.20 0.06 -1.33 0.00 0.00 177.39 177.61 1n4p h GLN 285 N 0.00 0.49 0.00 3.23 3.07 -0.55 -0.55 115.11 120.80 1n4p h GLN 285 Ca -0.08 -0.03 -0.01 0.00 0.09 0.00 0.00 58.65 58.63 1n4p h GLN 285 Cb 1.10 -0.11 -0.00 0.00 0.08 0.00 0.00 27.48 28.55 1n4p h GLN 285 CO 0.00 0.32 -0.30 -0.44 0.09 0.00 0.00 178.83 178.51 1n4p h ASP 286 N 0.50 0.00 1.29 0.06 3.45 -1.84 -3.15 116.42 116.74 1n4p h ASP 286 Ca 0.60 0.00 -0.11 0.00 0.43 0.00 0.00 57.03 57.95 1n4p h ASP 286 Cb 1.32 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 40.08 1n4p h ASP 286 CO -0.36 0.03 -0.55 0.03 -1.57 0.00 0.00 179.24 176.83 1n4p h ARG 287 N 0.00 0.00 0.00 3.56 2.47 -1.43 -3.48 114.38 115.50 1n4p h ARG 287 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1n4p h ARG 287 Cb 1.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.35 1n4p h ARG 287 CO 0.00 0.55 0.00 0.41 0.56 0.00 0.00 179.97 181.49 1n4p n GLY 288 N 1.03 1.17 0.40 0.04 0.00 -0.79 -4.86 105.19 102.18 1n4p n GLY 288 Ca 0.01 -0.78 0.19 0.00 0.00 0.00 0.00 46.02 45.44 1n4p n GLY 288 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1n4p h LEU 289 N 0.00 0.32 -0.31 0.99 3.38 -1.77 -1.17 115.31 116.76 1n4p h LEU 289 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1n4p h LEU 289 Cb 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1n4p h LEU 289 CO 0.00 0.15 0.00 -1.54 0.09 0.00 0.00 178.44 177.14 1n4p n SER 290 N -4.46 0.31 -0.09 -0.43 3.41 -1.26 -2.95 113.62 108.15 1n4p n SER 290 Ca 0.17 0.57 0.14 0.00 -0.26 0.00 0.00 58.87 59.49 1n4p n SER 290 Cb 0.66 -0.64 0.76 0.00 -0.26 0.00 0.00 64.21 64.72 1n4p n SER 290 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1n4p n ARG 291 N -1.84 1.12 -3.46 4.33 1.74 -0.44 -4.42 116.66 113.68 1n4p n ARG 291 Ca 0.03 -0.17 -0.29 0.00 -0.77 0.00 0.00 57.85 56.64 1n4p n ARG 291 Cb 0.21 -1.43 -0.08 0.00 -1.02 0.00 0.00 32.46 30.14 1n4p n ARG 291 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1n4p n TYR 292 N -0.73 3.49 -0.29 -1.55 4.01 -1.15 -4.96 117.16 115.97 1n4p n TYR 292 Ca 0.20 -4.01 0.12 0.00 -0.16 0.00 0.00 57.90 54.05 1n4p n TYR 292 Cb 0.14 -0.68 0.28 0.00 -0.31 0.00 0.00 39.34 38.77 1n4p n TYR 292 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1n4p h PRO 293 N 4.61 0.23 0.00 -0.72 0.13 -1.87 0.12 132.00 134.51 1n4p h PRO 293 Ca 0.19 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.24 1n4p h PRO 293 Cb 0.68 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 1n4p h PRO 293 CO 0.88 0.15 -0.30 -0.91 -0.23 0.00 0.00 178.00 177.59 1n4p h ASN 294 N 0.24 0.00 -0.31 1.44 4.21 -1.98 -2.93 115.58 116.25 1n4p h ASN 294 Ca 0.54 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.98 1n4p h ASN 294 Cb 1.07 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.26 1n4p h ASN 294 CO -0.62 0.30 -0.06 0.25 -1.29 0.00 0.00 177.43 176.01 1n4p h LEU 295 N 0.00 0.59 -0.45 1.61 5.85 -1.38 -1.37 115.31 120.16 1n4p h LEU 295 Ca -0.00 -0.36 0.05 0.00 0.84 0.00 0.00 57.88 58.41 1n4p h LEU 295 Cb 0.67 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 1n4p h LEU 295 CO 0.04 0.81 0.19 0.25 -0.34 0.00 0.00 178.44 179.39 1n4p h LEU 296 N 0.37 0.23 -0.15 2.25 5.85 -1.38 -0.70 115.31 121.78 1n4p h LEU 296 Ca 0.08 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1n4p h LEU 296 Cb 0.54 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1n4p h LEU 296 CO 0.03 0.17 0.07 0.78 -0.34 0.00 0.00 178.44 179.15 1n4p h ASN 297 N 0.38 0.20 -0.92 1.25 -0.26 -1.44 -1.33 115.58 113.45 1n4p h ASN 297 Ca 0.21 -0.14 0.07 0.00 -0.56 0.00 0.00 56.30 55.88 1n4p h ASN 297 Cb 0.17 -0.05 -0.06 0.00 -1.06 0.00 0.00 38.32 37.32 1n4p h ASN 297 CO -0.19 0.28 0.60 1.56 -1.06 0.00 0.00 177.43 178.62 1n4p h GLN 298 N 0.11 1.02 -0.27 0.81 4.20 -0.80 -1.15 115.11 119.02 1n4p h GLN 298 Ca 0.05 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.55 1n4p h GLN 298 Cb 0.14 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.69 1n4p h GLN 298 CO -0.01 0.67 -0.42 -0.07 -0.67 0.00 0.00 178.83 178.34 1n4p h LEU 299 N 1.05 0.84 -1.93 1.46 3.38 -0.92 -2.76 115.31 116.42 1n4p h LEU 299 Ca 0.40 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1n4p h LEU 299 Cb 0.20 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1n4p h LEU 299 CO -0.15 1.19 0.05 -0.07 0.09 0.00 0.00 178.44 179.55 1n4p h LEU 300 N 0.51 0.09 -0.07 1.67 3.38 -0.60 0.27 115.31 120.56 1n4p h LEU 300 Ca 0.02 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1n4p h LEU 300 Cb 1.01 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1n4p h LEU 300 CO 0.10 0.06 0.00 0.47 0.09 0.00 0.00 178.44 179.16 1n4p n ASP 301 N -4.53 0.32 -0.01 -0.43 9.92 -0.49 -3.02 116.55 118.31 1n4p n ASP 301 Ca -0.02 0.54 -0.06 0.00 -0.53 0.00 0.00 54.79 54.72 1n4p n ASP 301 Cb 0.09 -0.62 -0.13 0.00 -0.64 0.00 0.00 41.12 39.82 1n4p n ASP 301 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1n4p n LEU 302 N -1.81 0.78 -0.30 0.64 4.77 0.05 -4.33 117.00 116.79 1n4p n LEU 302 Ca 0.06 0.36 0.04 0.00 -0.03 0.00 0.00 56.01 56.44 1n4p n LEU 302 Cb 0.34 0.17 0.13 0.00 -2.33 0.00 0.00 43.42 41.72 1n4p n LEU 302 CO 0.26 0.32 0.71 1.56 -1.33 0.00 0.00 177.39 178.91 1n4p h GLN 303 N 0.00 0.01 -0.47 3.23 4.20 -1.36 -1.07 115.11 119.65 1n4p h GLN 303 Ca -0.27 -0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.49 1n4p h GLN 303 Cb 1.89 -0.00 -0.07 0.00 0.30 0.00 0.00 27.48 29.60 1n4p h GLN 303 CO 0.06 0.01 -0.38 -1.35 -0.67 0.00 0.00 178.83 176.50 1n4p h PRO 304 N 0.01 -0.13 0.00 1.46 0.11 -1.75 -3.26 132.00 128.44 1n4p h PRO 304 Ca 0.42 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.54 1n4p h PRO 304 Cb 0.68 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1n4p h PRO 304 CO -0.87 -0.09 0.00 -1.13 -0.21 0.00 0.00 178.00 175.71 1n4p n SER 305 N -4.49 0.00 -1.48 -2.05 3.41 -0.95 -4.66 113.62 103.40 1n4p n SER 305 Ca -0.01 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1n4p n SER 305 Cb 0.20 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 1n4p n SER 305 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1n4p n HIS 306 N -2.42 0.00 -1.35 7.33 8.25 -0.45 -4.89 115.22 121.69 1n4p n HIS 306 Ca 0.00 -0.27 -0.30 0.00 -0.26 0.00 0.00 57.72 56.89 1n4p n HIS 306 Cb 0.00 -0.26 0.10 0.00 1.12 0.00 0.00 29.99 30.95 1n4p n HIS 306 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1n4p s SER 307 N 1.57 4.27 -0.26 0.41 0.15 -1.21 -4.74 113.70 113.88 1n4p s SER 307 Ca 0.00 1.56 -0.38 0.00 0.70 0.00 0.00 55.95 57.83 1n4p s SER 307 Cb 0.00 -2.28 0.15 0.00 -1.71 0.00 0.00 66.02 62.18 1n4p s SER 307 CO 0.00 -2.15 1.36 -0.94 1.20 0.00 0.00 173.24 172.72 1n4p s SER 308 N -3.58 -0.03 0.47 5.45 1.04 -1.26 -4.87 113.70 110.92 1n4p s SER 308 Ca 0.61 -0.00 0.12 0.00 0.48 0.00 0.00 55.95 57.16 1n4p s SER 308 Cb -0.16 0.03 1.07 0.00 0.10 0.00 0.00 66.02 67.06 1n4p s SER 308 CO 0.56 -0.05 2.10 1.55 0.98 0.00 0.00 173.24 178.37 1n4p h PRO 309 N 2.00 0.22 -0.59 4.02 0.13 -1.95 -2.25 132.00 133.58 1n4p h PRO 309 Ca -0.05 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.05 1n4p h PRO 309 Cb 1.13 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 32.19 1n4p h PRO 309 CO 0.20 0.17 0.30 1.88 -0.23 0.00 0.00 178.00 180.31 1n4p h TYR 310 N 0.23 0.84 0.00 1.56 0.99 -1.95 0.87 116.97 119.51 1n4p h TYR 310 Ca 0.06 -0.04 -0.00 0.00 2.00 0.00 0.00 58.73 60.75 1n4p h TYR 310 Cb 0.01 -0.26 0.00 0.00 1.00 0.00 0.00 36.73 37.47 1n4p h TYR 310 CO 0.00 0.64 -0.00 1.25 -0.00 0.00 0.00 178.16 180.04 1n4p h LEU 311 N 0.81 -0.00 -0.77 3.88 6.46 -1.78 -0.40 115.31 123.50 1n4p h LEU 311 Ca 0.20 -0.20 0.06 0.00 -0.12 0.00 0.00 57.88 57.83 1n4p h LEU 311 Cb 0.10 0.00 -0.06 0.00 -0.73 0.00 0.00 40.66 39.97 1n4p h LEU 311 CO -0.03 0.20 0.46 0.40 -0.62 0.00 0.00 178.44 178.85 1n4p h ILE 312 N -0.20 1.00 -0.73 4.05 1.08 -1.27 -0.45 117.51 120.99 1n4p h ILE 312 Ca -0.00 -0.29 -0.03 0.00 -0.39 0.00 0.00 64.86 64.16 1n4p h ILE 312 Cb 0.20 0.09 -0.03 0.00 -3.07 0.00 0.00 36.82 34.01 1n4p h ILE 312 CO 0.00 0.15 0.35 0.00 -0.69 0.00 0.00 178.15 177.97 1n4p h ALA 313 N 1.38 0.94 -0.11 1.87 0.00 -0.64 -1.35 119.26 121.35 1n4p h ALA 313 Ca 0.34 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1n4p h ALA 313 Cb 0.19 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1n4p h ALA 313 CO -0.18 0.50 0.02 0.35 0.00 0.00 0.00 179.25 179.95 1n4p h PHE 314 N 1.02 0.04 -0.44 0.00 3.57 0.21 -0.72 116.94 120.62 1n4p h PHE 314 Ca 0.25 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.83 1n4p h PHE 314 Cb 0.12 -0.00 -0.06 0.00 2.79 0.00 0.00 35.95 38.79 1n4p h PHE 314 CO 0.01 0.01 0.08 -0.07 -2.23 0.00 0.00 178.31 176.11 1n4p h LEU 315 N 0.07 -0.01 -0.38 0.59 3.38 -0.77 0.59 115.31 118.77 1n4p h LEU 315 Ca 0.05 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.16 1n4p h LEU 315 Cb 0.04 0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1n4p h LEU 315 CO -0.06 0.03 0.05 0.58 0.09 0.00 0.00 178.44 179.13 1n4p h VAL 316 N 0.21 0.78 -0.54 1.22 2.07 -0.74 -0.13 116.25 119.12 1n4p h VAL 316 Ca 0.22 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.70 1n4p h VAL 316 Cb 0.28 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1n4p h VAL 316 CO -0.29 0.03 0.36 0.44 0.02 0.00 0.00 177.57 178.13 1n4p h ASP 317 N 0.17 0.59 0.19 0.57 3.45 0.08 0.16 116.42 121.63 1n4p h ASP 317 Ca 0.19 -0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.62 1n4p h ASP 317 Cb 0.23 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 38.86 1n4p h ASP 317 CO -0.26 0.42 -0.09 0.40 -1.57 0.00 0.00 179.24 178.13 1n4p h ILE 318 N 0.69 0.91 -0.92 0.35 2.04 0.16 -1.90 117.51 118.84 1n4p h ILE 318 Ca 0.21 -0.76 0.10 0.00 1.00 0.00 0.00 64.86 65.40 1n4p h ILE 318 Cb -0.01 1.35 -0.08 0.00 -0.74 0.00 0.00 36.82 37.34 1n4p h ILE 318 CO -0.05 0.17 0.56 1.88 0.00 0.00 0.00 178.15 180.71 1n4p h TYR 319 N -0.65 1.02 -0.67 1.37 0.99 -0.59 -0.52 116.97 117.91 1n4p h TYR 319 Ca -0.03 0.03 -0.04 0.00 2.00 0.00 0.00 58.73 60.69 1n4p h TYR 319 Cb 0.47 -0.32 -0.03 0.00 1.00 0.00 0.00 36.73 37.85 1n4p h TYR 319 CO 0.04 0.43 0.26 1.49 -0.00 0.00 0.00 178.16 180.37 1n4p h GLU 320 N 0.92 1.00 -0.35 4.88 4.81 -0.61 -0.68 114.58 124.55 1n4p h GLU 320 Ca 0.44 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 59.42 1n4p h GLU 320 Cb 0.39 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1n4p h GLU 320 CO -0.25 0.82 -0.11 0.22 -0.73 0.00 0.00 179.01 178.97 1n4p h ASP 321 N 0.97 0.57 0.40 1.04 -0.00 -0.30 -0.47 116.42 118.64 1n4p h ASP 321 Ca 0.23 -0.15 -0.02 0.00 -0.00 0.00 0.00 57.03 57.08 1n4p h ASP 321 Cb 0.21 -0.15 0.00 0.00 -0.00 0.00 0.00 39.33 39.39 1n4p h ASP 321 CO -0.02 0.72 -0.19 0.24 -0.00 0.00 0.00 179.24 179.99 1n4p h MET 322 N 0.55 -0.52 -0.75 0.28 2.86 -0.40 -1.68 114.93 115.27 1n4p h MET 322 Ca 0.10 0.04 0.16 0.00 -2.06 0.00 0.00 59.70 57.93 1n4p h MET 322 Cb 0.51 0.12 -0.05 0.00 0.06 0.00 0.00 31.60 32.24 1n4p h MET 322 CO 0.03 -0.26 0.51 -0.07 1.06 0.00 0.00 176.91 178.17 1n4p h LEU 323 N -0.69 0.33 -1.10 1.22 3.38 -0.93 0.18 115.31 117.71 1n4p h LEU 323 Ca -0.05 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1n4p h LEU 323 Cb 0.49 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1n4p h LEU 323 CO 0.09 0.16 -0.12 -0.08 0.09 0.00 0.00 178.44 178.58 1n4p h GLU 324 N 0.35 0.49 -2.22 1.13 4.57 -0.62 -3.24 114.58 115.03 1n4p h GLU 324 Ca 0.37 -0.14 -0.74 0.00 -1.18 0.00 0.00 59.36 57.66 1n4p h GLU 324 Cb 0.94 -0.05 -0.31 0.00 -0.16 0.00 0.00 28.75 29.16 1n4p h GLU 324 CO -0.11 0.61 0.56 0.09 -1.18 0.00 0.00 179.01 178.99 1n4p n ASN 325 N -4.20 6.57 -2.64 1.04 3.02 0.64 -4.94 115.26 114.74 1n4p n ASN 325 Ca 0.01 -3.70 0.00 0.00 -0.03 0.00 0.00 54.58 50.85 1n4p n ASN 325 Cb 0.32 -0.98 0.00 0.00 -0.61 0.00 0.00 39.78 38.51 1n4p n ASN 325 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n4p n GLN 326 N -0.16 -0.28 -1.35 3.52 10.64 -1.22 -4.87 117.38 123.66 1n4p n GLN 326 Ca 0.43 -0.14 -0.22 0.00 -1.83 0.00 0.00 57.00 55.24 1n4p n GLN 326 Cb 0.30 0.25 0.16 0.00 -0.86 0.00 0.00 30.24 30.09 1n4p n GLN 326 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1n4p s ASP 328 N -4.54 6.70 -0.14 0.00 -0.00 -1.26 -4.06 116.67 113.37 1n4p s ASP 328 Ca 0.56 0.83 -0.01 0.00 -0.00 0.00 0.00 52.55 53.93 1n4p s ASP 328 Cb -0.02 -2.27 0.00 0.00 -0.00 0.00 0.00 42.92 40.63 1n4p s ASP 328 CO 0.40 0.10 0.12 0.59 -0.00 0.00 0.00 175.17 176.38 1n4p n ASN 329 N 3.14 -2.45 -0.31 0.27 3.02 -1.26 -4.84 115.26 112.82 1n4p n ASN 329 Ca -0.09 -0.06 -0.07 0.00 -0.03 0.00 0.00 54.58 54.33 1n4p n ASN 329 Cb 0.52 -0.97 -0.03 0.00 -0.61 0.00 0.00 39.78 38.69 1n4p n ASN 329 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1n4p h LYS 330 N -0.28 -0.10 0.00 3.52 3.64 -1.98 0.45 116.57 121.82 1n4p h LYS 330 Ca -0.06 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1n4p h LYS 330 Cb 1.04 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1n4p h LYS 330 CO 0.06 -0.07 -0.04 0.93 -2.27 0.00 0.00 179.45 178.06 1n4p h GLU 331 N -0.11 0.00 0.23 1.90 5.08 -1.93 -1.21 114.58 118.55 1n4p h GLU 331 Ca 0.22 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.25 1n4p h GLU 331 Cb 0.53 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.82 1n4p h GLU 331 CO -0.84 0.04 -1.48 0.22 -1.00 0.00 0.00 179.01 175.95 1n4p h ASP 332 N 0.00 0.77 -0.20 1.42 3.58 -0.58 -3.17 116.42 118.23 1n4p h ASP 332 Ca -0.00 -0.85 -0.01 0.00 0.42 0.00 0.00 57.03 56.58 1n4p h ASP 332 Cb 0.10 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.89 1n4p h ASP 332 CO 0.01 1.67 0.07 0.40 -2.88 0.00 0.00 179.24 178.51 1n4p h ILE 333 N 0.13 1.18 -0.85 2.25 1.08 -0.51 -2.61 117.51 118.19 1n4p h ILE 333 Ca -0.25 -0.56 0.20 0.00 -0.39 0.00 0.00 64.86 63.86 1n4p h ILE 333 Cb 2.14 1.18 -0.05 0.00 -3.07 0.00 0.00 36.82 37.01 1n4p h ILE 333 CO 0.26 0.18 0.58 0.25 -0.69 0.00 0.00 178.15 178.73 1n4p h LEU 334 N 0.16 0.28 -0.11 1.44 5.85 -1.32 0.17 115.31 121.79 1n4p h LEU 334 Ca 0.07 0.03 -0.21 0.00 0.84 0.00 0.00 57.88 58.61 1n4p h LEU 334 Cb 0.21 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1n4p h LEU 334 CO -0.00 0.12 -0.97 0.78 -0.34 0.00 0.00 178.44 178.03 1n4p h ASN 335 N 0.29 0.06 -0.52 1.25 2.35 -1.46 -1.79 115.58 115.76 1n4p h ASN 335 Ca 0.43 -0.06 -0.09 0.00 -0.55 0.00 0.00 56.30 56.03 1n4p h ASN 335 Cb 1.23 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 39.56 1n4p h ASN 335 CO -0.12 0.99 0.01 0.11 -1.65 0.00 0.00 177.43 176.77 1n4p h LYS 336 N 0.02 0.96 0.44 0.81 1.57 -0.36 0.15 116.57 120.15 1n4p h LYS 336 Ca -0.02 -0.28 -0.02 0.00 -1.87 0.00 0.00 60.65 58.45 1n4p h LYS 336 Cb 1.68 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.90 1n4p h LYS 336 CO 0.13 0.94 -0.21 0.00 -0.57 0.00 0.00 179.45 179.74 1n4p h ALA 337 N 1.12 -0.59 -0.98 3.86 0.00 -1.18 -2.59 119.26 118.90 1n4p h ALA 337 Ca 0.16 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 55.02 1n4p h ALA 337 Cb 0.50 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.44 1n4p h ALA 337 CO 0.02 -0.65 0.62 -0.07 0.00 0.00 0.00 179.25 179.17 1n4p h LEU 338 N -0.95 0.85 -0.73 0.00 3.38 -1.26 0.15 115.31 116.74 1n4p h LEU 338 Ca -0.06 0.05 0.03 0.00 0.09 0.00 0.00 57.88 57.99 1n4p h LEU 338 Cb 0.57 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.16 1n4p h LEU 338 CO 0.10 0.43 0.46 -0.33 0.09 0.00 0.00 178.44 179.19 1n4p h GLU 339 N 0.90 0.87 -0.30 1.13 4.39 -0.66 -1.97 114.58 118.95 1n4p h GLU 339 Ca 0.50 -0.05 -0.11 0.00 0.34 0.00 0.00 59.36 60.03 1n4p h GLU 339 Cb 0.59 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1n4p h GLU 339 CO -0.26 0.57 -0.25 -0.07 -1.16 0.00 0.00 179.01 177.84 1n4p h LEU 340 N 0.89 0.74 -0.79 1.33 3.38 -0.41 -2.28 115.31 118.18 1n4p h LEU 340 Ca 0.29 -0.45 0.11 0.00 0.09 0.00 0.00 57.88 57.92 1n4p h LEU 340 Cb 0.02 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 40.49 1n4p h LEU 340 CO -0.11 1.04 0.41 0.00 0.09 0.00 0.00 178.44 179.87 1n4p h GLU 342 N 0.66 0.26 -0.44 0.00 4.57 -1.27 -0.16 114.58 118.20 1n4p h GLU 342 Ca 0.40 -0.13 -0.12 0.00 -1.18 0.00 0.00 59.36 58.33 1n4p h GLU 342 Cb 0.45 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 1n4p h GLU 342 CO -0.29 0.66 -0.19 0.82 -1.18 0.00 0.00 179.01 178.83 1n4p h ILE 343 N 0.21 1.27 0.29 2.32 2.04 -0.59 0.22 117.51 123.27 1n4p h ILE 343 Ca 0.02 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 64.54 1n4p h ILE 343 Cb 0.87 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 1n4p h ILE 343 CO 0.07 0.45 -0.14 -0.07 0.00 0.00 0.00 178.15 178.46 1n4p h LEU 344 N 0.76 -0.33 -0.52 1.44 3.38 -0.54 -0.71 115.31 118.79 1n4p h LEU 344 Ca 0.11 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1n4p h LEU 344 Cb 0.72 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 1n4p h LEU 344 CO 0.06 -0.07 0.34 0.00 0.09 0.00 0.00 178.44 178.86 1n4p h ALA 345 N 0.05 0.66 0.04 1.53 0.00 -0.92 0.19 119.26 120.83 1n4p h ALA 345 Ca -0.04 -0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.61 1n4p h ALA 345 Cb 0.43 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1n4p h ALA 345 CO 0.07 0.11 -1.03 0.87 0.00 0.00 0.00 179.25 179.27 1n4p h LYS 346 N 0.71 0.16 0.00 0.00 6.56 -0.60 -3.38 116.57 120.02 1n4p h LYS 346 Ca 0.19 -0.23 0.00 0.00 -1.06 0.00 0.00 60.65 59.55 1n4p h LYS 346 Cb -0.08 0.08 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1n4p h LYS 346 CO -0.04 1.05 0.00 -0.85 -2.06 0.00 0.00 179.45 177.55 1n4p n GLU 347 N -3.53 1.89 -0.07 3.15 0.28 -0.39 -4.89 120.64 117.08 1n4p n GLU 347 Ca -0.04 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.80 1n4p n GLU 347 Cb 0.91 -0.16 -0.14 0.00 1.43 0.00 0.00 31.44 33.49 1n4p n GLU 347 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1n4p n LYS 348 N 0.00 0.68 -2.87 3.44 4.76 -0.50 -4.66 118.16 119.00 1n4p n LYS 348 Ca 0.00 0.16 -0.13 0.00 -2.87 0.00 0.00 58.31 55.48 1n4p n LYS 348 Cb 0.00 -1.60 0.01 0.00 -1.84 0.00 0.00 35.03 31.59 1n4p n LYS 348 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1n4p n ASP 349 N -3.18 1.24 -0.29 4.39 4.64 0.66 -4.66 116.55 119.34 1n4p n ASP 349 Ca -0.36 -2.84 0.16 0.00 -1.38 0.00 0.00 54.79 50.36 1n4p n ASP 349 Cb 1.05 -0.57 0.42 0.00 -1.04 0.00 0.00 41.12 40.98 1n4p n ASP 349 CO 0.00 0.00 0.00 0.71 -0.82 0.00 0.00 177.20 177.09 1n4p h THR 350 N 2.19 0.71 -0.08 5.18 1.35 -1.72 -0.76 112.91 119.78 1n4p h THR 350 Ca -0.02 -0.20 0.02 0.00 -0.55 0.00 0.00 66.41 65.67 1n4p h THR 350 Cb 1.09 0.07 -0.00 0.00 -1.73 0.00 0.00 68.15 67.57 1n4p h THR 350 CO 0.50 0.11 0.14 -0.29 -0.25 0.00 0.00 175.52 175.73 1n4p h ILE 351 N 0.59 0.31 -0.40 6.82 2.10 -1.90 0.41 117.51 125.44 1n4p h ILE 351 Ca 0.51 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.45 1n4p h ILE 351 Cb 1.01 0.88 0.00 0.00 -1.09 0.00 0.00 36.82 37.62 1n4p h ILE 351 CO -0.26 0.00 0.00 0.54 -1.08 0.00 0.00 178.15 177.35 1n4p n ARG 352 N -3.52 3.74 -0.32 2.19 1.74 -0.30 -4.75 116.66 115.44 1n4p n ARG 352 Ca -0.01 -2.96 -0.05 0.00 -0.77 0.00 0.00 57.85 54.07 1n4p n ARG 352 Cb 0.23 -2.00 -0.01 0.00 -1.02 0.00 0.00 32.46 29.66 1n4p n ARG 352 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1n4p h LYS 353 N 2.76 -0.08 0.00 5.56 3.64 -0.14 0.35 116.57 128.66 1n4p h LYS 353 Ca 0.00 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 1n4p h LYS 353 Cb 1.64 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.47 1n4p h LYS 353 CO 0.32 -0.05 -0.12 0.93 -2.27 0.00 0.00 179.45 178.26 1n4p h GLU 354 N -0.08 0.00 -0.03 1.90 5.08 -1.85 -2.10 114.58 117.50 1n4p h GLU 354 Ca 0.26 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 1n4p h GLU 354 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1n4p h GLU 354 CO -0.87 0.12 -0.07 -0.92 -1.00 0.00 0.00 179.01 176.28 1n4p h TYR 355 N 0.00 0.13 -0.85 4.33 3.20 -0.76 -2.21 116.97 120.82 1n4p h TYR 355 Ca -0.00 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.83 1n4p h TYR 355 Cb 0.23 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 1n4p h TYR 355 CO 0.00 0.66 0.55 -1.49 -1.64 0.00 0.00 178.16 176.24 1n4p h TRP 356 N -0.44 1.08 0.00 -3.82 -0.00 -0.85 0.14 115.95 112.06 1n4p h TRP 356 Ca 0.00 0.02 -0.07 0.00 -0.00 0.00 0.00 58.89 58.84 1n4p h TRP 356 Cb 0.66 -0.36 -0.01 0.00 -0.00 0.00 0.00 29.16 29.44 1n4p h TRP 356 CO 0.12 0.69 -0.35 0.00 -0.00 0.00 0.00 178.44 178.90 1n4p h ARG 357 N 1.15 0.00 -0.34 0.49 3.08 -1.43 0.20 114.38 117.53 1n4p h ARG 357 Ca 0.31 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.21 1n4p h ARG 357 Cb -0.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1n4p h ARG 357 CO -0.07 0.35 -0.37 -0.92 -1.07 0.00 0.00 179.97 177.90 1n4p h TYR 358 N 0.00 0.96 -0.31 3.04 3.20 -0.55 -0.64 116.97 122.66 1n4p h TYR 358 Ca -0.00 -0.28 -0.10 0.00 3.14 0.00 0.00 58.73 61.49 1n4p h TYR 358 Cb 0.63 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1n4p h TYR 358 CO 0.00 1.05 -0.18 0.82 -1.64 0.00 0.00 178.16 178.22 1n4p h ILE 359 N 0.67 1.29 0.16 1.81 1.08 0.09 -1.64 117.51 120.97 1n4p h ILE 359 Ca 0.06 -1.30 0.01 0.00 -0.39 0.00 0.00 64.86 63.24 1n4p h ILE 359 Cb 0.93 1.46 -0.02 0.00 -3.07 0.00 0.00 36.82 36.12 1n4p h ILE 359 CO 0.09 0.42 -0.20 1.23 -0.69 0.00 0.00 178.15 178.99 1n4p h GLY 360 N 0.43 -0.40 0.57 5.37 0.00 -0.47 -0.42 103.07 108.15 1n4p h GLY 360 Ca 0.07 0.23 0.13 0.00 0.00 0.00 0.00 47.33 47.75 1n4p h GLY 360 CO 0.05 -0.19 0.59 3.21 0.00 0.00 0.00 176.54 180.20 1n4p h ARG 361 N -0.41 0.79 -0.77 4.80 3.08 -1.08 -0.69 114.38 120.10 1n4p h ARG 361 Ca 0.01 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1n4p h ARG 361 Cb 0.40 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 30.24 1n4p h ARG 361 CO -0.08 0.52 0.37 0.77 -1.07 0.00 0.00 179.97 180.49 1n4p h SER 362 N 0.81 1.00 -0.02 7.04 0.02 -0.26 -2.24 113.55 119.90 1n4p h SER 362 Ca 0.45 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 61.26 1n4p h SER 362 Cb 0.58 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 1n4p h SER 362 CO -0.21 0.85 0.00 -0.07 -1.14 0.00 0.00 176.83 176.26 1n4p h LEU 363 N 1.08 0.04 -0.20 5.07 3.38 0.37 -2.84 115.31 122.21 1n4p h LEU 363 Ca 0.26 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1n4p h LEU 363 Cb 0.11 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1n4p h LEU 363 CO -0.03 0.29 -0.04 1.56 0.09 0.00 0.00 178.44 180.30 1n4p h GLN 364 N -0.22 0.01 0.00 1.13 7.50 -1.24 -0.47 115.11 121.82 1n4p h GLN 364 Ca 0.01 -0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.16 1n4p h GLN 364 Cb 0.27 -0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.79 1n4p h GLN 364 CO 0.00 0.01 0.00 -1.13 -1.50 0.00 0.00 178.83 176.21 1n4p n SER 365 N -5.19 0.00 -0.01 1.46 3.41 -0.85 -2.58 113.62 109.86 1n4p n SER 365 Ca -0.02 -0.40 0.03 0.00 -0.26 0.00 0.00 58.87 58.21 1n4p n SER 365 Cb 0.12 -0.05 -0.07 0.00 -0.26 0.00 0.00 64.21 63.94 1n4p n SER 365 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1n4p n LYS 366 N -1.05 0.78 -3.30 4.33 3.00 -0.36 -4.84 118.16 116.71 1n4p n LYS 366 Ca 0.11 -0.07 -0.25 0.00 -0.00 0.00 0.00 58.31 58.10 1n4p n LYS 366 Cb 0.07 -1.23 -0.08 0.00 0.00 0.00 0.00 35.03 33.79 1n4p n LYS 366 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1n4p n HIS 367 N -1.95 0.17 -1.80 5.64 8.25 -0.33 -5.09 115.22 120.11 1n4p n HIS 367 Ca -0.05 -3.61 0.00 0.00 -0.26 0.00 0.00 57.72 53.81 1n4p n HIS 367 Cb 0.37 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 31.24 1n4p n HIS 367 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41