#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t2p n PRO 63 N 0.00 0.10 -3.72 1.97 -0.02 -1.26 -5.03 135.00 127.03 1t2p n PRO 63 Ca 0.00 0.07 -0.13 0.00 -2.02 0.00 0.00 63.50 61.42 1t2p n PRO 63 Cb 0.00 -1.70 -0.10 0.00 -0.02 0.00 0.00 33.50 31.68 1t2p n PRO 63 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1t2p s GLN 64 N -2.80 0.49 -0.29 -0.52 2.00 -1.26 -4.95 119.66 112.32 1t2p s GLN 64 Ca 0.60 0.62 -0.13 0.00 -2.00 0.00 0.00 55.36 54.45 1t2p s GLN 64 Cb -0.30 0.21 -0.03 0.00 0.80 0.00 0.00 33.01 33.68 1t2p s GLN 64 CO 0.64 -0.07 0.30 0.42 -0.50 0.00 0.00 175.29 176.07 1t2p s ILE 65 N 0.37 5.23 0.32 -2.34 1.01 -1.26 -4.96 121.20 119.56 1t2p s ILE 65 Ca -0.01 0.27 -0.27 0.00 0.00 0.00 0.00 60.65 60.64 1t2p s ILE 65 Cb -0.04 -3.67 -0.14 0.00 0.01 0.00 0.00 42.46 38.63 1t2p s ILE 65 CO -0.01 0.12 0.89 -2.65 0.00 0.00 0.00 174.94 173.29 1t2p n PRO 66 N 5.24 1.09 0.13 2.79 -0.02 -1.26 -4.87 135.00 138.10 1t2p n PRO 66 Ca -0.11 0.39 -0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1t2p n PRO 66 Cb 0.51 -1.73 0.10 0.00 -0.02 0.00 0.00 33.50 32.36 1t2p n PRO 66 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1t2p h LYS 67 N 1.64 0.00 -6.53 -0.52 6.56 -1.96 -3.42 116.57 112.34 1t2p h LYS 67 Ca -0.39 0.00 -0.57 0.00 -1.06 0.00 0.00 60.65 58.63 1t2p h LYS 67 Cb 1.36 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 32.96 1t2p h LYS 67 CO 0.58 0.64 0.95 0.34 -2.06 0.00 0.00 179.45 179.91 1t2p s ASP 68 N -6.64 6.63 0.58 0.86 3.68 -1.26 -4.90 116.67 115.62 1t2p s ASP 68 Ca 0.01 0.79 0.33 0.00 2.13 0.00 0.00 52.55 55.80 1t2p s ASP 68 Cb 0.11 -2.54 1.77 0.00 -1.45 0.00 0.00 42.92 40.80 1t2p s ASP 68 CO 0.76 -1.20 1.99 0.11 0.13 0.00 0.00 175.17 176.96 1t2p h LYS 69 N 9.38 0.00 -0.09 4.34 1.79 -1.95 -1.51 116.57 128.53 1t2p h LYS 69 Ca -0.24 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.23 1t2p h LYS 69 Cb 1.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.73 1t2p h LYS 69 CO 1.08 0.00 0.00 -1.13 -1.08 0.00 0.00 179.45 178.32 1t2p n SER 70 N -2.77 1.66 -4.75 0.86 3.41 -1.26 -4.42 113.62 106.34 1t2p n SER 70 Ca -0.02 -1.61 -0.36 0.00 -0.26 0.00 0.00 58.87 56.62 1t2p n SER 70 Cb 0.20 -0.05 -0.08 0.00 -0.26 0.00 0.00 64.21 64.02 1t2p n SER 70 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1t2p s LYS 71 N -1.90 3.53 0.15 4.33 1.02 -0.57 -5.07 119.74 121.23 1t2p s LYS 71 Ca 0.35 -0.26 -0.31 0.00 0.02 0.00 0.00 55.97 55.77 1t2p s LYS 71 Cb 0.20 -3.11 -0.09 0.00 -0.52 0.00 0.00 37.83 34.30 1t2p s LYS 71 CO 0.30 0.59 1.51 0.08 -0.92 0.00 0.00 175.35 176.91 1t2p s VAL 72 N -0.51 2.84 -0.12 3.17 1.01 -1.26 -4.15 120.40 121.38 1t2p s VAL 72 Ca 0.11 0.61 0.17 0.00 0.00 0.00 0.00 61.98 62.86 1t2p s VAL 72 Cb -0.12 -3.39 -0.23 0.00 0.00 0.00 0.00 36.38 32.65 1t2p s VAL 72 CO 0.02 0.05 0.46 0.00 0.00 0.00 0.00 175.10 175.62 1t2p n ALA 73 N 3.97 1.75 0.00 5.51 0.00 0.22 -4.86 120.51 127.09 1t2p n ALA 73 Ca 0.13 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.67 1t2p n ALA 73 Cb 0.40 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.24 1t2p n ALA 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t2p n GLY 74 N 1.56 -0.97 3.06 0.00 0.00 -1.01 -4.63 105.19 103.19 1t2p n GLY 74 Ca -0.20 -0.73 -0.20 0.00 0.00 0.00 0.00 46.02 44.89 1t2p n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1t2p s TYR 75 N -3.00 1.03 -0.08 1.61 1.51 -0.04 0.14 117.35 118.51 1t2p s TYR 75 Ca 0.00 -0.20 0.04 0.00 -1.01 0.00 0.00 57.07 55.90 1t2p s TYR 75 Cb 0.00 -0.67 -0.01 0.00 -0.11 0.00 0.00 41.96 41.17 1t2p s TYR 75 CO 0.00 -0.02 -0.22 -1.50 -1.11 0.00 0.00 175.55 172.69 1t2p s ILE 76 N -0.24 2.26 -0.02 2.71 1.10 0.03 -0.68 121.20 126.36 1t2p s ILE 76 Ca 0.04 -0.97 0.01 0.00 -0.51 0.00 0.00 60.65 59.21 1t2p s ILE 76 Cb -0.05 -1.86 0.02 0.00 0.15 0.00 0.00 42.46 40.73 1t2p s ILE 76 CO -0.00 0.56 -0.00 -1.61 -2.11 0.00 0.00 174.94 171.77 1t2p s GLU 77 N 0.03 0.29 -0.48 3.50 2.02 -0.08 -0.67 118.70 123.31 1t2p s GLU 77 Ca -0.09 0.05 0.03 0.00 0.02 0.00 0.00 54.97 54.98 1t2p s GLU 77 Cb -0.15 -0.44 0.15 0.00 0.10 0.00 0.00 34.13 33.79 1t2p s GLU 77 CO 0.05 -0.10 0.32 0.42 0.02 0.00 0.00 175.26 175.97 1t2p s ILE 78 N 0.84 1.33 0.25 -1.63 1.09 0.82 -0.72 121.20 123.17 1t2p s ILE 78 Ca -0.08 -2.88 -0.08 0.00 -1.10 0.00 0.00 60.65 56.51 1t2p s ILE 78 Cb -0.12 -1.91 0.31 0.00 -1.06 0.00 0.00 42.46 39.68 1t2p s ILE 78 CO -0.01 -1.02 1.61 -0.65 -0.10 0.00 0.00 174.94 174.77 1t2p h PRO 79 N 6.17 0.05 0.00 2.79 0.11 -1.73 0.71 132.00 140.10 1t2p h PRO 79 Ca 0.10 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1t2p h PRO 79 Cb 0.89 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1t2p h PRO 79 CO 0.48 0.03 0.00 -0.44 -0.21 0.00 0.00 178.00 177.87 1t2p h ASP 80 N 0.05 0.00 -0.07 -2.05 3.32 -1.95 0.50 116.42 116.22 1t2p h ASP 80 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.46 1t2p h ASP 80 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1t2p h ASP 80 CO -0.75 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 176.77 1t2p n ALA 81 N -2.03 2.45 -2.57 3.45 0.00 0.14 -4.54 120.51 117.41 1t2p n ALA 81 Ca -0.02 -0.68 -0.19 0.00 0.00 0.00 0.00 53.44 52.55 1t2p n ALA 81 Cb 0.09 -0.50 0.01 0.00 0.00 0.00 0.00 19.45 19.04 1t2p n ALA 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1t2p n ASP 82 N 0.83 -5.40 -4.61 0.00 8.00 0.17 -4.78 116.55 110.76 1t2p n ASP 82 Ca 0.09 -0.11 -0.35 0.00 0.71 0.00 0.00 54.79 55.13 1t2p n ASP 82 Cb 0.38 -4.37 -0.10 0.00 -0.02 0.00 0.00 41.12 37.01 1t2p n ASP 82 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1t2p s ILE 83 N -2.98 4.89 -0.25 0.53 1.01 -0.74 -4.99 121.20 118.67 1t2p s ILE 83 Ca 0.10 0.01 -0.02 0.00 0.00 0.00 0.00 60.65 60.74 1t2p s ILE 83 Cb -0.05 -3.24 0.12 0.00 0.01 0.00 0.00 42.46 39.30 1t2p s ILE 83 CO 0.13 0.40 0.27 -0.75 0.00 0.00 0.00 174.94 174.99 1t2p s LYS 84 N 0.79 0.27 0.02 2.79 2.20 -1.26 -0.13 119.74 124.43 1t2p s LYS 84 Ca 0.05 0.04 0.02 0.00 -0.36 0.00 0.00 55.97 55.72 1t2p s LYS 84 Cb -0.13 -0.85 -0.01 0.00 -1.51 0.00 0.00 37.83 35.32 1t2p s LYS 84 CO 0.02 -0.85 -0.07 -1.21 -0.36 0.00 0.00 175.35 172.88 1t2p s GLU 85 N 2.36 0.54 0.36 4.03 0.41 0.15 -5.00 118.70 121.55 1t2p s GLU 85 Ca 0.09 -0.46 -0.26 0.00 -0.41 0.00 0.00 54.97 53.93 1t2p s GLU 85 Cb -0.15 -0.44 -0.09 0.00 -1.78 0.00 0.00 34.13 31.67 1t2p s GLU 85 CO -0.24 0.11 1.08 -2.14 -0.49 0.00 0.00 175.26 173.58 1t2p s PRO 86 N -0.76 4.31 -0.17 0.39 0.02 -1.26 -0.79 135.00 136.74 1t2p s PRO 86 Ca -0.02 1.64 -0.03 0.00 0.02 0.00 0.00 61.00 62.61 1t2p s PRO 86 Cb -0.06 -2.77 -0.02 0.00 0.02 0.00 0.00 34.50 31.68 1t2p s PRO 86 CO 0.00 -0.04 -0.06 0.08 -0.33 0.00 0.00 177.00 176.65 1t2p s VAL 87 N -1.47 3.59 0.30 3.83 1.01 0.37 -3.54 120.40 124.50 1t2p s VAL 87 Ca 0.53 -0.45 0.07 0.00 0.00 0.00 0.00 61.98 62.13 1t2p s VAL 87 Cb -0.26 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 1t2p s VAL 87 CO 0.33 0.48 0.35 -0.31 0.00 0.00 0.00 175.10 175.95 1t2p s TYR 88 N 0.68 3.11 0.74 5.22 1.51 0.52 0.69 117.35 129.83 1t2p s TYR 88 Ca -0.03 -0.19 -0.15 0.00 -1.01 0.00 0.00 57.07 55.69 1t2p s TYR 88 Cb -0.15 -1.77 0.04 0.00 -0.11 0.00 0.00 41.96 39.98 1t2p s TYR 88 CO 0.02 0.21 1.16 -2.30 -1.11 0.00 0.00 175.55 173.54 1t2p n PRO 89 N -1.45 0.51 -1.35 -1.71 -0.02 -1.26 -1.35 135.00 128.37 1t2p n PRO 89 Ca -0.03 0.24 -0.10 0.00 -2.02 0.00 0.00 63.50 61.59 1t2p n PRO 89 Cb 0.58 -2.40 0.06 0.00 -0.02 0.00 0.00 33.50 31.72 1t2p n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1t2p n GLY 90 N 0.80 0.44 3.81 -1.23 0.00 -1.24 -4.34 105.19 103.41 1t2p n GLY 90 Ca 0.14 -1.95 -0.31 0.00 0.00 0.00 0.00 46.02 43.91 1t2p n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1t2p s PRO 91 N -3.63 2.51 -1.22 1.61 0.04 -1.26 -4.49 135.00 128.57 1t2p s PRO 91 Ca 0.28 0.86 -0.20 0.00 0.04 0.00 0.00 61.00 61.99 1t2p s PRO 91 Cb -0.01 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 1t2p s PRO 91 CO 0.19 -1.38 1.88 0.00 0.04 0.00 0.00 177.00 177.73 1t2p n ALA 92 N -3.30 2.95 -1.98 8.56 0.00 -0.90 -4.75 120.51 121.08 1t2p n ALA 92 Ca 0.07 -3.46 -0.21 0.00 0.00 0.00 0.00 53.44 49.85 1t2p n ALA 92 Cb 0.54 -3.55 0.04 0.00 0.00 0.00 0.00 19.45 16.48 1t2p n ALA 92 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1t2p s THR 93 N 7.10 2.64 0.33 0.00 -4.23 -1.26 -4.87 115.64 115.34 1t2p s THR 93 Ca 0.60 -0.73 0.04 0.00 -1.18 0.00 0.00 61.69 60.42 1t2p s THR 93 Cb 0.04 -2.91 0.29 0.00 1.34 0.00 0.00 72.50 71.26 1t2p s THR 93 CO 0.09 0.00 1.93 -0.65 -0.54 0.00 0.00 174.62 175.45 1t2p h PRO 94 N 0.10 0.84 0.02 3.99 0.11 -1.98 -0.75 132.00 134.34 1t2p h PRO 94 Ca -0.40 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 1t2p h PRO 94 Cb 1.29 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1t2p h PRO 94 CO 0.49 0.56 -0.01 1.49 -0.21 0.00 0.00 178.00 180.32 1t2p h GLU 95 N 0.87 -0.03 -0.50 1.05 4.81 -1.96 -0.81 114.58 118.01 1t2p h GLU 95 Ca 0.36 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.63 1t2p h GLU 95 Cb 0.28 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 1t2p h GLU 95 CO -0.13 0.13 0.27 1.96 -0.73 0.00 0.00 179.01 180.51 1t2p h GLN 96 N -0.18 0.52 0.00 1.92 1.08 -1.71 0.26 115.11 117.00 1t2p h GLN 96 Ca -0.00 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 1t2p h GLN 96 Cb 0.17 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.48 1t2p h GLN 96 CO 0.00 0.35 0.00 1.28 -0.95 0.00 0.00 178.83 179.51 1t2p n LEU 97 N -4.85 0.45 0.07 1.46 7.99 -0.34 -1.15 117.00 120.63 1t2p n LEU 97 Ca 0.04 0.62 -0.05 0.00 -0.01 0.00 0.00 56.01 56.60 1t2p n LEU 97 Cb 0.11 -0.57 -0.08 0.00 -0.11 0.00 0.00 43.42 42.77 1t2p n LEU 97 CO 0.30 -0.49 0.20 -1.13 -1.51 0.00 0.00 177.39 174.76 1t2p h ASN 98 N 0.00 0.00 0.05 -1.43 -1.24 0.55 -3.15 115.58 110.36 1t2p h ASN 98 Ca 0.00 0.00 -0.22 0.00 0.71 0.00 0.00 56.30 56.79 1t2p h ASN 98 Cb 0.30 0.00 0.02 0.00 0.73 0.00 0.00 38.32 39.37 1t2p h ASN 98 CO 0.00 0.91 -0.89 0.03 -1.29 0.00 0.00 177.43 176.19 1t2p h ARG 99 N 0.00 0.52 0.00 6.67 3.08 -0.63 -3.50 114.38 120.52 1t2p h ARG 99 Ca -0.01 -0.62 0.00 0.00 0.07 0.00 0.00 59.98 59.42 1t2p h ARG 99 Cb 1.68 0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.92 1t2p h ARG 99 CO 0.12 1.24 0.00 0.41 -1.07 0.00 0.00 179.97 180.67 1t2p n GLY 100 N 1.23 -1.50 3.73 0.04 0.00 -0.30 -5.06 105.19 103.33 1t2p n GLY 100 Ca -0.12 -1.16 -0.41 0.00 0.00 0.00 0.00 46.02 44.33 1t2p n GLY 100 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1t2p n VAL 101 N 6.39 2.45 -3.94 1.61 0.31 -1.23 -3.65 118.33 120.27 1t2p n VAL 101 Ca 0.00 -0.50 -0.08 0.00 -0.01 0.00 0.00 64.34 63.75 1t2p n VAL 101 Cb 0.00 -1.73 -0.09 0.00 -0.91 0.00 0.00 33.84 31.11 1t2p n VAL 101 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1t2p s SER 102 N -0.40 0.23 0.40 4.52 0.01 -0.63 -0.35 113.70 117.48 1t2p s SER 102 Ca 0.59 -0.70 -0.27 0.00 1.31 0.00 0.00 55.95 56.88 1t2p s SER 102 Cb -0.49 0.27 -0.09 0.00 0.21 0.00 0.00 66.02 65.91 1t2p s SER 102 CO 0.60 -0.63 1.41 -0.36 0.41 0.00 0.00 173.24 174.67 1t2p s PHE 103 N -3.48 2.63 0.27 2.43 0.40 -0.46 -0.03 117.98 119.74 1t2p s PHE 103 Ca 0.02 1.27 -0.01 0.00 -0.60 0.00 0.00 56.93 57.62 1t2p s PHE 103 Cb 0.04 -3.88 0.39 0.00 0.51 0.00 0.00 43.02 40.07 1t2p s PHE 103 CO -0.09 -2.68 1.78 0.00 0.70 0.00 0.00 175.22 174.93 1t2p h ALA 104 N 2.74 1.15 -3.73 5.36 0.00 -1.58 -2.48 119.26 120.72 1t2p h ALA 104 Ca -0.50 -0.26 -0.68 0.00 0.00 0.00 0.00 54.91 53.47 1t2p h ALA 104 Cb 1.25 -0.18 -0.18 0.00 0.00 0.00 0.00 17.79 18.67 1t2p h ALA 104 CO 0.63 0.55 -0.76 -1.21 0.00 0.00 0.00 179.25 178.45 1t2p s GLU 105 N -4.95 2.13 0.21 0.00 2.02 -1.26 -2.13 118.70 114.72 1t2p s GLU 105 Ca -0.09 -0.98 -0.04 0.00 0.02 0.00 0.00 54.97 53.88 1t2p s GLU 105 Cb 0.15 -2.27 0.17 0.00 0.10 0.00 0.00 34.13 32.27 1t2p s GLU 105 CO 0.80 0.53 1.60 1.49 0.02 0.00 0.00 175.26 179.70 1t2p h GLU 106 N 4.10 0.74 -0.68 1.61 4.81 -1.86 -2.98 114.58 120.31 1t2p h GLU 106 Ca -0.49 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 58.42 1t2p h GLU 106 Cb 1.16 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1t2p h GLU 106 CO 0.50 0.94 0.00 0.27 -0.73 0.00 0.00 179.01 179.99 1t2p n ASN 107 N -4.08 2.88 -4.75 1.04 6.94 -1.26 -4.75 115.26 111.28 1t2p n ASN 107 Ca -0.01 -2.32 -0.41 0.00 -0.02 0.00 0.00 54.58 51.82 1t2p n ASN 107 Cb 0.47 -0.49 0.00 0.00 -2.36 0.00 0.00 39.78 37.40 1t2p n ASN 107 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 1t2p n GLU 108 N 0.36 2.37 -4.46 -3.83 4.07 -1.13 -5.02 120.64 113.01 1t2p n GLU 108 Ca 0.13 0.83 -0.21 0.00 -0.06 0.00 0.00 57.16 57.86 1t2p n GLU 108 Cb 0.59 -2.55 -0.15 0.00 -0.06 0.00 0.00 31.44 29.27 1t2p n GLU 108 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 1t2p s SER 109 N -0.30 1.31 0.00 4.31 0.01 -1.26 -4.97 113.70 112.80 1t2p s SER 109 Ca 0.56 -0.20 0.09 0.00 1.31 0.00 0.00 55.95 57.71 1t2p s SER 109 Cb -0.49 -0.26 0.45 0.00 0.21 0.00 0.00 66.02 65.93 1t2p s SER 109 CO 0.61 0.10 1.20 0.18 0.41 0.00 0.00 173.24 175.74 1t2p n LEU 110 N 3.07 0.00 -0.66 2.44 7.99 -1.26 -2.14 117.00 126.43 1t2p n LEU 110 Ca -0.16 0.33 0.10 0.00 -0.01 0.00 0.00 56.01 56.27 1t2p n LEU 110 Cb 0.55 -0.33 0.05 0.00 -0.11 0.00 0.00 43.42 43.58 1t2p n LEU 110 CO 0.25 -0.23 0.45 -0.90 -1.51 0.00 0.00 177.39 175.45 1t2p n ASP 111 N -1.33 2.36 -4.76 -1.43 5.75 -1.26 -4.99 116.55 110.89 1t2p n ASP 111 Ca 0.04 -1.68 -0.32 0.00 -0.01 0.00 0.00 54.79 52.82 1t2p n ASP 111 Cb 0.08 0.22 0.07 0.00 -1.03 0.00 0.00 41.12 40.46 1t2p n ASP 111 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1t2p s ASP 112 N -2.00 4.79 0.33 -1.12 1.11 -0.91 -4.94 116.67 113.93 1t2p s ASP 112 Ca 0.21 1.98 0.06 0.00 0.18 0.00 0.00 52.55 54.98 1t2p s ASP 112 Cb 0.17 -2.55 0.58 0.00 1.07 0.00 0.00 42.92 42.20 1t2p s ASP 112 CO 0.38 -1.85 1.81 -0.61 1.18 0.00 0.00 175.17 176.08 1t2p h GLN 113 N -0.39 0.36 -4.23 8.23 -0.00 -1.90 -3.41 115.11 113.76 1t2p h GLN 113 Ca -0.46 -0.11 -0.53 0.00 -0.00 0.00 0.00 58.65 57.56 1t2p h GLN 113 Cb 1.25 -0.03 -0.37 0.00 0.00 0.00 0.00 27.48 28.32 1t2p h GLN 113 CO 0.52 0.54 -0.80 1.21 0.00 0.00 0.00 178.83 180.30 1t2p s ASN 114 N -6.83 2.19 -0.19 -0.69 2.47 -1.26 -0.29 114.94 110.34 1t2p s ASN 114 Ca -0.06 -0.30 -0.06 0.00 0.42 0.00 0.00 52.86 52.85 1t2p s ASN 114 Cb 0.15 -0.85 -0.03 0.00 -1.45 0.00 0.00 41.25 39.07 1t2p s ASN 114 CO 0.76 -0.12 0.03 -0.63 -3.72 0.00 0.00 177.10 173.42 1t2p s ILE 115 N 1.70 4.37 -0.15 -5.21 1.01 -0.69 -4.93 121.20 117.30 1t2p s ILE 115 Ca 0.05 -0.18 -0.04 0.00 0.00 0.00 0.00 60.65 60.48 1t2p s ILE 115 Cb -0.13 -2.97 -0.03 0.00 0.01 0.00 0.00 42.46 39.35 1t2p s ILE 115 CO -0.08 0.45 -0.01 -0.44 0.00 0.00 0.00 174.94 174.85 1t2p s SER 116 N 0.62 5.00 -0.06 3.58 0.01 -1.26 -1.04 113.70 120.55 1t2p s SER 116 Ca 0.01 -0.06 0.03 0.00 1.31 0.00 0.00 55.95 57.23 1t2p s SER 116 Cb -0.14 -1.79 0.01 0.00 0.21 0.00 0.00 66.02 64.31 1t2p s SER 116 CO 0.02 0.19 -0.14 -0.63 0.41 0.00 0.00 173.24 173.09 1t2p s ILE 117 N 0.26 1.24 0.12 1.44 1.01 -0.44 -1.48 121.20 123.35 1t2p s ILE 117 Ca -0.01 -0.56 0.06 0.00 0.00 0.00 0.00 60.65 60.14 1t2p s ILE 117 Cb -0.14 -1.11 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 1t2p s ILE 117 CO 0.02 0.38 0.00 0.00 0.00 0.00 0.00 174.94 175.34 1t2p s ALA 118 N 0.51 3.26 0.05 9.38 0.00 0.95 -0.74 121.76 135.18 1t2p s ALA 118 Ca -0.13 -1.20 -0.14 0.00 0.00 0.00 0.00 51.96 50.49 1t2p s ALA 118 Cb -0.15 -1.13 0.02 0.00 0.00 0.00 0.00 23.12 21.86 1t2p s ALA 118 CO 0.04 0.63 0.31 0.20 0.00 0.00 0.00 175.76 176.94 1t2p s GLY 119 N -2.52 -0.14 0.55 0.00 0.00 -0.03 -1.60 107.32 103.58 1t2p s GLY 119 Ca 0.26 0.02 -0.17 0.00 0.00 0.00 0.00 44.72 44.83 1t2p s GLY 119 CO 0.18 -0.21 1.03 0.30 0.00 0.00 0.00 173.10 174.40 1t2p s HIS 120 N -2.63 3.17 -0.23 1.90 3.76 -1.26 0.29 115.29 120.29 1t2p s HIS 120 Ca -0.04 1.51 0.02 0.00 -0.15 0.00 0.00 55.06 56.39 1t2p s HIS 120 Cb -0.01 -2.93 0.05 0.00 1.11 0.00 0.00 32.58 30.80 1t2p s HIS 120 CO -0.04 -0.78 -0.11 0.99 -0.85 0.00 0.00 174.74 173.96 1t2p s THR 121 N -2.45 1.88 -0.30 1.30 2.01 -1.06 -1.70 115.64 115.32 1t2p s THR 121 Ca 0.62 -1.28 -0.01 0.00 0.31 0.00 0.00 61.69 61.33 1t2p s THR 121 Cb -0.14 -1.97 0.10 0.00 0.01 0.00 0.00 72.50 70.51 1t2p s THR 121 CO 0.32 0.09 0.10 0.12 -0.69 0.00 0.00 174.62 174.56 1t2p s PHE 122 N 1.27 1.58 0.48 4.92 5.99 -1.26 -4.86 117.98 126.10 1t2p s PHE 122 Ca -0.04 -1.64 0.25 0.00 0.00 0.00 0.00 56.93 55.50 1t2p s PHE 122 Cb -0.18 -1.63 1.30 0.00 0.00 0.00 0.00 43.02 42.51 1t2p s PHE 122 CO -0.07 -0.86 1.88 -0.84 -0.00 0.00 0.00 175.22 175.33 1t2p h ILE 123 N 6.49 0.62 0.00 3.12 3.07 -1.98 0.35 117.51 129.18 1t2p h ILE 123 Ca -0.14 -0.06 0.00 0.00 1.55 0.00 0.00 64.86 66.21 1t2p h ILE 123 Cb 1.02 0.42 0.00 0.00 -0.27 0.00 0.00 36.82 37.99 1t2p h ILE 123 CO 0.46 0.03 0.00 0.44 -1.05 0.00 0.00 178.15 178.04 1t2p h ASP 124 N 0.18 0.00 -2.47 2.16 5.19 -2.03 -3.31 116.42 116.14 1t2p h ASP 124 Ca 0.43 0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 56.29 1t2p h ASP 124 Cb 1.40 0.00 -0.38 0.00 0.18 0.00 0.00 39.33 40.54 1t2p h ASP 124 CO -0.09 0.00 -0.85 -0.13 -3.12 0.00 0.00 179.24 175.06 1t2p s ARG 125 N -3.73 0.60 0.54 3.56 0.52 0.12 -5.01 118.95 115.55 1t2p s ARG 125 Ca -0.03 -1.37 0.44 0.00 -0.52 0.00 0.00 55.73 54.25 1t2p s ARG 125 Cb 0.08 -1.23 1.65 0.00 0.52 0.00 0.00 34.95 35.97 1t2p s ARG 125 CO 0.27 -1.23 1.65 -1.35 0.02 0.00 0.00 175.30 174.65 1t2p h PRO 126 N 6.83 0.01 -0.17 3.54 0.11 -1.69 0.30 132.00 140.94 1t2p h PRO 126 Ca 0.09 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.14 1t2p h PRO 126 Cb 0.97 -0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.04 1t2p h PRO 126 CO 0.27 0.01 -0.15 0.09 -0.21 0.00 0.00 178.00 178.01 1t2p n ASN 127 N -4.11 2.53 -4.65 -2.05 3.02 -1.26 -3.16 115.26 105.59 1t2p n ASN 127 Ca 0.38 -3.50 -0.41 0.00 -0.03 0.00 0.00 54.58 51.02 1t2p n ASN 127 Cb 1.73 -0.54 -0.05 0.00 -0.61 0.00 0.00 39.78 40.30 1t2p n ASN 127 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1t2p s TYR 128 N -3.08 3.33 0.00 3.10 5.04 0.10 -4.89 117.35 120.94 1t2p s TYR 128 Ca 0.40 1.04 0.00 0.00 -2.44 0.00 0.00 57.07 56.06 1t2p s TYR 128 Cb 0.36 -2.95 0.00 0.00 0.35 0.00 0.00 41.96 39.72 1t2p s TYR 128 CO 0.01 -0.32 0.00 1.04 -1.34 0.00 0.00 175.55 174.94 1t2p n GLN 129 N 5.65 0.00 -0.81 4.97 6.02 -1.26 -1.40 117.38 130.55 1t2p n GLN 129 Ca 0.03 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.09 1t2p n GLN 129 Cb 0.48 0.00 0.39 0.00 1.02 0.00 0.00 30.24 32.13 1t2p n GLN 129 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1t2p n PHE 130 N 4.16 1.88 -0.30 1.08 0.99 -0.69 -4.55 117.46 120.04 1t2p n PHE 130 Ca 0.00 -0.72 -0.04 0.00 -0.00 0.00 0.00 57.45 56.69 1t2p n PHE 130 Cb 0.00 -0.45 0.07 0.00 -1.00 0.00 0.00 39.48 38.10 1t2p n PHE 130 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 1t2p h THR 131 N 3.84 1.22 -0.48 4.37 2.02 -1.05 -2.76 112.91 120.07 1t2p h THR 131 Ca 0.00 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.70 1t2p h THR 131 Cb 1.84 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 1t2p h THR 131 CO 0.42 0.23 0.00 -3.20 0.37 0.00 0.00 175.52 173.34 1t2p n ASN 132 N -4.47 2.74 -0.27 4.18 5.15 -1.19 -4.47 115.26 116.94 1t2p n ASN 132 Ca 0.08 -2.06 0.12 0.00 -0.60 0.00 0.00 54.58 52.12 1t2p n ASN 132 Cb 0.05 -0.35 0.38 0.00 -0.53 0.00 0.00 39.78 39.32 1t2p n ASN 132 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1t2p h LEU 133 N 2.82 0.66 -1.19 1.20 5.85 -1.79 0.08 115.31 122.94 1t2p h LEU 133 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1t2p h LEU 133 Cb 0.73 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1t2p h LEU 133 CO 0.03 0.34 0.05 2.29 -0.34 0.00 0.00 178.44 180.81 1t2p n LYS 134 N -4.56 0.12 0.27 1.25 0.00 -1.26 -0.69 118.16 113.29 1t2p n LYS 134 Ca 0.17 0.61 0.16 0.00 -0.00 0.00 0.00 58.31 59.25 1t2p n LYS 134 Cb 0.46 -1.94 0.72 0.00 -0.00 0.00 0.00 35.03 34.27 1t2p n LYS 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1t2p h ALA 135 N 1.85 1.04 -2.48 0.58 0.00 -1.31 -3.42 119.26 115.52 1t2p h ALA 135 Ca 0.00 -0.05 -0.60 0.00 0.00 0.00 0.00 54.91 54.25 1t2p h ALA 135 Cb 0.11 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.78 1t2p h ALA 135 CO 0.00 0.07 0.18 0.00 0.00 0.00 0.00 179.25 179.51 1t2p s ALA 136 N -3.79 3.60 0.40 0.00 0.00 0.13 -4.76 121.76 117.34 1t2p s ALA 136 Ca -0.00 -0.35 0.06 0.00 0.00 0.00 0.00 51.96 51.67 1t2p s ALA 136 Cb 0.10 -3.04 0.06 0.00 0.00 0.00 0.00 23.12 20.24 1t2p s ALA 136 CO 0.55 -0.75 0.51 1.63 0.00 0.00 0.00 175.76 177.71 1t2p n LYS 137 N 5.55 0.76 -1.67 0.00 4.76 -1.26 -4.98 118.16 121.31 1t2p n LYS 137 Ca -0.00 -2.24 -0.45 0.00 -2.87 0.00 0.00 58.31 52.75 1t2p n LYS 137 Cb 0.49 -0.09 -0.03 0.00 -1.84 0.00 0.00 35.03 33.56 1t2p n LYS 137 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 1t2p n LYS 138 N -1.80 2.03 0.00 1.97 4.81 -1.26 -1.71 118.16 122.20 1t2p n LYS 138 Ca 0.09 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.25 1t2p n LYS 138 Cb 0.43 -2.38 0.00 0.00 0.02 0.00 0.00 35.03 33.09 1t2p n LYS 138 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1t2p n GLY 139 N 2.23 2.99 3.68 3.14 0.00 0.12 -4.94 105.19 112.40 1t2p n GLY 139 Ca 0.12 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.69 1t2p n GLY 139 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1t2p n SER 140 N 0.00 3.01 -4.77 1.61 7.64 -0.70 -4.45 113.62 115.97 1t2p n SER 140 Ca 0.00 1.11 -0.40 0.00 1.01 0.00 0.00 58.87 60.60 1t2p n SER 140 Cb 0.00 -1.44 -0.03 0.00 -1.01 0.00 0.00 64.21 61.73 1t2p n SER 140 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1t2p s MET 141 N 0.24 4.40 -0.04 1.43 -1.94 -1.26 -1.15 119.30 120.98 1t2p s MET 141 Ca 0.73 1.93 0.02 0.00 -1.71 0.00 0.00 55.69 56.66 1t2p s MET 141 Cb -0.65 -3.01 0.01 0.00 2.01 0.00 0.00 34.83 33.19 1t2p s MET 141 CO 0.44 -0.04 -0.07 0.08 -0.01 0.00 0.00 175.02 175.41 1t2p s VAL 142 N -1.23 0.72 -0.11 -6.03 1.01 -0.05 -4.18 120.40 110.53 1t2p s VAL 142 Ca 0.49 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 62.22 1t2p s VAL 142 Cb -0.34 -0.68 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 1t2p s VAL 142 CO 0.44 0.25 -0.16 -0.31 0.00 0.00 0.00 175.10 175.32 1t2p s TYR 143 N 0.59 2.74 -0.27 5.22 4.12 0.10 -1.13 117.35 128.70 1t2p s TYR 143 Ca -0.09 -0.67 0.03 0.00 0.02 0.00 0.00 57.07 56.35 1t2p s TYR 143 Cb -0.12 -1.78 0.07 0.00 -1.52 0.00 0.00 41.96 38.60 1t2p s TYR 143 CO 0.01 -0.21 -0.06 0.12 0.02 0.00 0.00 175.55 175.43 1t2p s PHE 144 N 0.21 3.16 -0.17 2.71 5.36 -0.28 -0.90 117.98 128.08 1t2p s PHE 144 Ca -0.10 -2.35 -0.06 0.00 -0.96 0.00 0.00 56.93 53.46 1t2p s PHE 144 Cb -0.16 -2.08 -0.04 0.00 -0.34 0.00 0.00 43.02 40.41 1t2p s PHE 144 CO 0.06 -0.87 0.04 0.15 -1.46 0.00 0.00 175.22 173.13 1t2p s LYS 145 N 1.13 3.84 0.45 10.12 1.02 0.14 -0.50 119.74 135.94 1t2p s LYS 145 Ca -0.03 -0.37 0.03 0.00 0.02 0.00 0.00 55.97 55.61 1t2p s LYS 145 Cb -0.19 -3.13 -0.03 0.00 -0.52 0.00 0.00 37.83 33.96 1t2p s LYS 145 CO -0.07 0.32 0.06 0.14 -0.92 0.00 0.00 175.35 174.88 1t2p s VAL 146 N 0.23 1.01 0.23 3.17 -7.23 0.17 -0.87 120.40 117.11 1t2p s VAL 146 Ca 0.03 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 58.07 1t2p s VAL 146 Cb -0.13 -2.35 0.29 0.00 0.56 0.00 0.00 36.38 34.75 1t2p s VAL 146 CO 0.01 0.00 1.60 1.23 -0.31 0.00 0.00 175.10 177.63 1t2p h GLY 147 N 1.62 0.46 -2.23 2.32 0.00 -1.95 -2.81 103.07 100.47 1t2p h GLY 147 Ca -0.40 0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1t2p h GLY 147 CO 0.67 -0.27 0.00 1.16 0.00 0.00 0.00 176.54 178.10 1t2p n ASN 148 N -5.49 3.56 -3.55 0.19 6.94 -1.26 -5.02 115.26 110.62 1t2p n ASN 148 Ca 0.10 -1.98 -0.09 0.00 -0.02 0.00 0.00 54.58 52.59 1t2p n ASN 148 Cb 0.38 -0.37 -0.04 0.00 -2.36 0.00 0.00 39.78 37.40 1t2p n ASN 148 CO 0.00 0.00 0.00 -1.83 -1.03 0.00 0.00 177.26 174.40 1t2p s GLU 149 N -1.08 0.63 -0.29 -3.83 -1.05 -1.06 -5.09 118.70 106.92 1t2p s GLU 149 Ca 0.40 -0.05 -0.03 0.00 -0.15 0.00 0.00 54.97 55.14 1t2p s GLU 149 Cb 0.21 0.29 0.04 0.00 -0.44 0.00 0.00 34.13 34.24 1t2p s GLU 149 CO 0.28 -0.24 0.01 0.99 0.95 0.00 0.00 175.26 177.25 1t2p s THR 150 N -2.01 3.14 -0.05 1.83 2.01 -1.26 -0.65 115.64 118.65 1t2p s THR 150 Ca 0.02 -1.22 -0.15 0.00 0.31 0.00 0.00 61.69 60.66 1t2p s THR 150 Cb -0.01 -2.74 -0.05 0.00 0.01 0.00 0.00 72.50 69.71 1t2p s THR 150 CO -0.03 -0.04 0.39 -0.13 -0.69 0.00 0.00 174.62 174.12 1t2p s ARG 151 N 1.31 4.01 -0.09 4.92 0.52 0.35 -4.93 118.95 125.03 1t2p s ARG 151 Ca -0.03 0.34 0.01 0.00 -0.52 0.00 0.00 55.73 55.53 1t2p s ARG 151 Cb -0.19 -3.28 -0.02 0.00 0.52 0.00 0.00 34.95 31.97 1t2p s ARG 151 CO -0.01 0.55 -0.10 0.15 0.02 0.00 0.00 175.30 175.91 1t2p s LYS 152 N -0.58 2.96 0.08 3.54 -0.14 -1.26 -1.12 119.74 123.22 1t2p s LYS 152 Ca 0.23 -0.61 -0.00 0.00 -1.36 0.00 0.00 55.97 54.22 1t2p s LYS 152 Cb -0.16 -2.59 -0.04 0.00 -1.68 0.00 0.00 37.83 33.36 1t2p s LYS 152 CO 0.11 0.49 -0.02 0.71 -0.76 0.00 0.00 175.35 175.88 1t2p s TYR 153 N -0.36 0.70 -0.10 3.18 1.51 -0.29 -1.26 117.35 120.73 1t2p s TYR 153 Ca 0.04 -1.07 0.04 0.00 -1.01 0.00 0.00 57.07 55.07 1t2p s TYR 153 Cb -0.12 -0.45 0.00 0.00 -0.11 0.00 0.00 41.96 41.28 1t2p s TYR 153 CO 0.02 -0.36 -0.22 0.15 -1.11 0.00 0.00 175.55 174.04 1t2p s LYS 154 N -3.93 2.83 0.26 -0.62 1.02 0.02 -0.87 119.74 118.44 1t2p s LYS 154 Ca 0.12 -0.80 -0.31 0.00 0.02 0.00 0.00 55.97 55.00 1t2p s LYS 154 Cb 0.07 -2.17 -0.12 0.00 -0.52 0.00 0.00 37.83 35.09 1t2p s LYS 154 CO -0.06 0.13 1.61 -0.12 -0.92 0.00 0.00 175.35 176.00 1t2p n MET 155 N 3.64 2.63 -0.36 1.68 0.00 -0.30 -1.55 117.12 122.86 1t2p n MET 155 Ca -0.20 0.94 0.00 0.00 -0.00 0.00 0.00 57.70 58.44 1t2p n MET 155 Cb 0.53 -2.73 0.00 0.00 0.00 0.00 0.00 33.22 31.02 1t2p n MET 155 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1t2p n THR 156 N 2.71 0.00 0.60 1.12 -2.24 0.11 0.12 114.28 116.70 1t2p n THR 156 Ca 0.11 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.02 1t2p n THR 156 Cb 0.35 -1.32 0.32 0.00 -2.10 0.00 0.00 70.33 67.58 1t2p n THR 156 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1t2p n SER 157 N -1.59 0.80 -4.54 3.42 7.64 -1.26 -4.24 113.62 113.85 1t2p n SER 157 Ca 0.00 0.43 -0.43 0.00 1.01 0.00 0.00 58.87 59.88 1t2p n SER 157 Cb 0.00 -0.49 -0.01 0.00 -1.01 0.00 0.00 64.21 62.70 1t2p n SER 157 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1t2p s ILE 158 N -3.13 4.31 0.01 0.44 -1.09 -1.26 -4.91 121.20 115.57 1t2p s ILE 158 Ca 0.09 -1.83 -0.01 0.00 -2.23 0.00 0.00 60.65 56.67 1t2p s ILE 158 Cb 0.12 -5.09 -0.01 0.00 -1.58 0.00 0.00 42.46 35.91 1t2p s ILE 158 CO 0.64 -1.90 0.01 0.00 -1.23 0.00 0.00 174.94 172.46 1t2p s ARG 159 N 3.72 0.19 -1.49 2.79 1.70 -1.26 -0.07 118.95 124.54 1t2p s ARG 159 Ca 0.49 -0.29 -0.12 0.00 -0.47 0.00 0.00 55.73 55.33 1t2p s ARG 159 Cb 0.01 0.07 0.07 0.00 -0.57 0.00 0.00 34.95 34.53 1t2p s ARG 159 CO 0.02 -0.03 0.96 -3.47 -1.08 0.00 0.00 175.30 171.70 1t2p n ASP 160 N 2.28 -5.17 -4.45 -2.89 4.64 0.11 -4.94 116.55 106.13 1t2p n ASP 160 Ca -0.18 -0.66 -0.32 0.00 -1.38 0.00 0.00 54.79 52.24 1t2p n ASP 160 Cb 0.57 -4.12 -0.13 0.00 -1.04 0.00 0.00 41.12 36.40 1t2p n ASP 160 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 1t2p s VAL 161 N -3.26 2.85 0.40 5.18 -7.23 -0.90 -4.81 120.40 112.63 1t2p s VAL 161 Ca 0.61 -0.89 -0.25 0.00 -1.81 0.00 0.00 61.98 59.64 1t2p s VAL 161 Cb -0.30 -2.12 -0.08 0.00 0.56 0.00 0.00 36.38 34.44 1t2p s VAL 161 CO 0.75 0.53 1.12 -0.54 -0.31 0.00 0.00 175.10 176.64 1t2p s LYS 162 N -0.90 4.08 0.63 4.82 1.02 -1.26 0.33 119.74 128.46 1t2p s LYS 162 Ca 0.12 1.70 0.33 0.00 0.02 0.00 0.00 55.97 58.14 1t2p s LYS 162 Cb -0.10 -2.61 1.80 0.00 -0.52 0.00 0.00 37.83 36.40 1t2p s LYS 162 CO 0.02 -0.26 2.09 -1.35 -0.92 0.00 0.00 175.35 174.92 1t2p h PRO 163 N 2.56 0.00 -0.23 -1.68 0.11 -1.96 0.11 132.00 130.91 1t2p h PRO 163 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1t2p h PRO 163 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1t2p h PRO 163 CO 0.62 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.66 1t2p n THR 164 N -3.36 0.00 0.00 -1.15 -2.24 -1.26 -2.36 114.28 103.91 1t2p n THR 164 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1t2p n THR 164 Cb 0.31 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1t2p n THR 164 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1t2p n ASP 165 N -0.33 2.43 0.00 3.42 8.00 0.03 -4.97 116.55 125.13 1t2p n ASP 165 Ca 0.00 -0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.27 1t2p n ASP 165 Cb 0.06 0.95 0.00 0.00 -0.02 0.00 0.00 41.12 42.11 1t2p n ASP 165 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1t2p n VAL 166 N -1.20 0.00 -1.98 2.53 0.31 -1.05 -5.07 118.33 111.88 1t2p n VAL 166 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1t2p n VAL 166 Cb 0.00 -0.29 -0.00 0.00 -0.91 0.00 0.00 33.84 32.64 1t2p n VAL 166 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1t2p n GLY 167 N 2.19 -3.49 3.23 2.92 0.00 -1.00 -5.11 105.19 103.95 1t2p n GLY 167 Ca 0.00 0.10 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 1t2p n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t2p s VAL 168 N -0.60 0.11 0.00 1.61 1.01 -1.26 -5.15 120.40 116.11 1t2p s VAL 168 Ca -0.02 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1t2p s VAL 168 Cb 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.27 1t2p s VAL 168 CO 0.31 -0.48 0.00 0.00 0.00 0.00 0.00 175.10 174.93 1t2p n LEU 169 N 0.25 0.00 -0.08 3.92 -0.00 -1.26 -4.99 117.00 114.84 1t2p n LEU 169 Ca -0.17 0.00 0.04 0.00 -0.00 0.00 0.00 56.01 55.88 1t2p n LEU 169 Cb 0.61 0.00 0.19 0.00 -0.00 0.00 0.00 43.42 44.22 1t2p n LEU 169 CO 0.21 0.00 0.63 -0.90 -0.00 0.00 0.00 177.39 177.33 1t2p n ASP 170 N 0.00 0.24 -4.58 1.45 3.85 -1.26 -4.74 116.55 111.51 1t2p n ASP 170 Ca 0.00 -1.82 -0.21 0.00 -0.71 0.00 0.00 54.79 52.05 1t2p n ASP 170 Cb 0.00 -0.03 -0.09 0.00 -1.35 0.00 0.00 41.12 39.66 1t2p n ASP 170 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.20 174.36 1t2p s GLU 171 N -1.95 1.82 -0.17 0.11 -1.05 -1.26 -4.82 118.70 111.38 1t2p s GLU 171 Ca 0.11 -0.76 -0.05 0.00 -0.15 0.00 0.00 54.97 54.12 1t2p s GLU 171 Cb 0.06 -5.10 0.08 0.00 -0.44 0.00 0.00 34.13 28.73 1t2p s GLU 171 CO 0.09 -4.75 0.31 -0.65 0.95 0.00 0.00 175.26 171.21 1t2p s GLN 172 N 7.51 0.22 0.00 -4.83 -1.52 -1.26 -5.08 119.66 114.70 1t2p s GLN 172 Ca 0.75 0.74 0.00 0.00 -1.95 0.00 0.00 55.36 54.91 1t2p s GLN 172 Cb -0.03 -0.11 0.00 0.00 -0.22 0.00 0.00 33.01 32.65 1t2p s GLN 172 CO 0.15 -0.36 0.00 1.63 -0.25 0.00 0.00 175.29 176.46 1t2p n LYS 173 N 5.36 0.00 -0.57 2.91 4.76 -1.26 -4.59 118.16 124.77 1t2p n LYS 173 Ca -0.06 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.45 1t2p n LYS 173 Cb 0.50 -0.19 0.28 0.00 -1.84 0.00 0.00 35.03 33.78 1t2p n LYS 173 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1t2p n GLY 174 N 0.92 3.90 3.77 0.72 0.00 -1.26 -5.01 105.19 108.23 1t2p n GLY 174 Ca 0.00 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.58 1t2p n GLY 174 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1t2p s LYS 175 N -2.86 4.21 0.50 1.61 2.20 -1.26 -4.92 119.74 119.23 1t2p s LYS 175 Ca 0.45 2.39 -0.19 0.00 -0.36 0.00 0.00 55.97 58.26 1t2p s LYS 175 Cb 0.36 -3.00 -0.12 0.00 -1.51 0.00 0.00 37.83 33.56 1t2p s LYS 175 CO 0.10 -0.37 0.33 -0.25 -0.36 0.00 0.00 175.35 174.79 1t2p n ASP 176 N 0.59 -1.83 -4.67 1.43 10.43 -1.26 -4.89 116.55 116.35 1t2p n ASP 176 Ca 0.01 0.76 -0.35 0.00 2.57 0.00 0.00 54.79 57.78 1t2p n ASP 176 Cb 0.41 -1.05 0.10 0.00 1.84 0.00 0.00 41.12 42.41 1t2p n ASP 176 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1t2p n LYS 177 N 0.62 0.52 -3.73 -1.24 4.76 -1.26 -4.88 118.16 112.95 1t2p n LYS 177 Ca 0.11 0.24 -0.09 0.00 -2.87 0.00 0.00 58.31 55.70 1t2p n LYS 177 Cb 0.45 -2.39 -0.03 0.00 -1.84 0.00 0.00 35.03 31.22 1t2p n LYS 177 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 1t2p s GLN 178 N -3.66 1.51 -0.03 1.97 -2.07 0.61 -1.85 119.66 116.14 1t2p s GLN 178 Ca 0.76 -0.85 0.05 0.00 -1.82 0.00 0.00 55.36 53.50 1t2p s GLN 178 Cb -0.33 0.56 -0.01 0.00 -1.09 0.00 0.00 33.01 32.14 1t2p s GLN 178 CO 0.48 -0.67 -0.18 -0.51 -1.32 0.00 0.00 175.29 173.09 1t2p s LEU 179 N -2.87 1.99 -0.27 2.60 1.43 0.42 -1.70 118.68 120.28 1t2p s LEU 179 Ca 0.09 -0.35 -0.02 0.00 -1.03 0.00 0.00 54.13 52.82 1t2p s LEU 179 Cb -0.03 -0.99 0.03 0.00 0.03 0.00 0.00 46.19 45.24 1t2p s LEU 179 CO -0.01 0.20 -0.03 -0.89 0.23 0.00 0.00 176.35 175.86 1t2p s THR 180 N -0.25 3.00 -0.17 5.49 2.01 -0.20 -0.88 115.64 124.63 1t2p s THR 180 Ca 0.03 -1.13 -0.13 0.00 0.31 0.00 0.00 61.69 60.76 1t2p s THR 180 Cb -0.09 -2.60 -0.05 0.00 0.01 0.00 0.00 72.50 69.77 1t2p s THR 180 CO 0.01 0.07 0.27 -0.76 -0.69 0.00 0.00 174.62 173.52 1t2p s LEU 181 N 1.31 4.24 -0.16 4.42 1.43 0.21 -1.32 118.68 128.80 1t2p s LEU 181 Ca -0.02 0.46 0.01 0.00 -1.03 0.00 0.00 54.13 53.55 1t2p s LEU 181 Cb -0.18 -2.33 0.02 0.00 0.03 0.00 0.00 46.19 43.73 1t2p s LEU 181 CO -0.03 0.11 -0.17 -0.63 0.23 0.00 0.00 176.35 175.86 1t2p s ILE 182 N 0.47 1.83 0.13 -0.59 1.01 0.08 -0.52 121.20 123.61 1t2p s ILE 182 Ca 0.15 -0.80 -0.25 0.00 0.00 0.00 0.00 60.65 59.76 1t2p s ILE 182 Cb -0.13 -1.68 -0.07 0.00 0.01 0.00 0.00 42.46 40.59 1t2p s ILE 182 CO 0.03 0.50 0.76 0.42 0.00 0.00 0.00 174.94 176.65 1t2p s THR 183 N 1.36 4.47 0.06 2.92 -4.23 -0.49 -0.85 115.64 118.88 1t2p s THR 183 Ca 0.05 1.65 0.05 0.00 -1.18 0.00 0.00 61.69 62.25 1t2p s THR 183 Cb -0.13 -4.11 -0.03 0.00 1.34 0.00 0.00 72.50 69.57 1t2p s THR 183 CO -0.12 0.50 -0.15 0.00 -0.54 0.00 0.00 174.62 174.31 1t2p s ASP 185 N -1.41 -0.56 -0.83 0.00 3.68 -0.32 -2.56 116.67 114.67 1t2p s ASP 185 Ca 0.01 0.39 -0.02 0.00 2.13 0.00 0.00 52.55 55.06 1t2p s ASP 185 Cb -0.09 0.51 -0.02 0.00 -1.45 0.00 0.00 42.92 41.86 1t2p s ASP 185 CO 0.02 -0.67 0.76 0.47 0.13 0.00 0.00 175.17 175.87 1t2p n ASP 186 N 0.39 -7.31 -4.76 -0.34 9.92 -1.26 -0.98 116.55 112.21 1t2p n ASP 186 Ca -0.16 -0.28 -0.41 0.00 -0.53 0.00 0.00 54.79 53.41 1t2p n ASP 186 Cb 0.60 -5.20 -0.03 0.00 -0.64 0.00 0.00 41.12 35.85 1t2p n ASP 186 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1t2p s TYR 187 N -3.13 3.37 -0.35 1.24 5.04 -1.26 -0.53 117.35 121.73 1t2p s TYR 187 Ca 0.15 1.53 -0.04 0.00 -2.44 0.00 0.00 57.07 56.28 1t2p s TYR 187 Cb -0.02 -3.45 0.06 0.00 0.35 0.00 0.00 41.96 38.90 1t2p s TYR 187 CO 0.73 -1.15 0.10 1.21 -1.34 0.00 0.00 175.55 175.11 1t2p s ASN 188 N -0.51 5.18 0.43 4.32 3.84 0.11 -4.89 114.94 123.42 1t2p s ASN 188 Ca 0.48 -1.41 0.11 0.00 0.21 0.00 0.00 52.86 52.25 1t2p s ASN 188 Cb -0.35 -1.81 0.98 0.00 -0.55 0.00 0.00 41.25 39.52 1t2p s ASN 188 CO 0.44 -0.37 2.05 -0.33 -2.79 0.00 0.00 177.10 176.09 1t2p h GLU 189 N 8.12 0.41 0.00 0.43 5.08 -1.95 0.13 114.58 126.81 1t2p h GLU 189 Ca -0.20 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.07 1t2p h GLU 189 Cb 1.07 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1t2p h GLU 189 CO 0.61 0.27 -0.28 0.87 -1.00 0.00 0.00 179.01 179.48 1t2p h LYS 190 N 0.43 0.00 -0.00 2.33 1.57 -1.96 -3.24 116.57 115.69 1t2p h LYS 190 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1t2p h LYS 190 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1t2p h LYS 190 CO -0.04 0.28 -0.26 0.25 -0.57 0.00 0.00 179.45 179.12 1t2p n THR 191 N -4.16 0.00 -2.41 -0.16 -2.24 -1.03 -5.01 114.28 99.27 1t2p n THR 191 Ca -0.02 -0.37 -0.13 0.00 -2.27 0.00 0.00 64.05 61.25 1t2p n THR 191 Cb 0.34 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.57 1t2p n THR 191 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t2p n GLY 192 N 1.11 -0.14 3.12 3.38 0.00 0.44 -5.02 105.19 108.08 1t2p n GLY 192 Ca 0.01 -0.30 -0.17 0.00 0.00 0.00 0.00 46.02 45.56 1t2p n GLY 192 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1t2p s VAL 193 N -2.74 0.91 -0.39 1.61 -7.23 -1.16 -4.96 120.40 106.44 1t2p s VAL 193 Ca 0.06 -1.05 -0.26 0.00 -1.81 0.00 0.00 61.98 58.93 1t2p s VAL 193 Cb -0.03 -0.87 0.02 0.00 0.56 0.00 0.00 36.38 36.06 1t2p s VAL 193 CO 0.08 -0.15 0.93 0.26 -0.31 0.00 0.00 175.10 175.90 1t2p s TRP 194 N -1.05 3.04 0.26 2.82 0.52 -1.26 -0.71 118.94 122.56 1t2p s TRP 194 Ca -0.02 0.69 -0.03 0.00 0.02 0.00 0.00 56.10 56.76 1t2p s TRP 194 Cb -0.09 -3.73 0.39 0.00 -1.15 0.00 0.00 33.47 28.90 1t2p s TRP 194 CO 0.01 -0.89 1.89 0.93 0.02 0.00 0.00 176.95 178.91 1t2p h GLU 195 N 8.61 1.17 -4.67 4.98 4.39 -0.67 -3.39 114.58 125.00 1t2p h GLU 195 Ca -0.23 -0.07 -0.69 0.00 0.34 0.00 0.00 59.36 58.71 1t2p h GLU 195 Cb 1.08 -0.26 -0.22 0.00 -0.10 0.00 0.00 28.75 29.24 1t2p h GLU 195 CO 0.99 0.77 -0.51 0.15 -1.16 0.00 0.00 179.01 179.25 1t2p s LYS 196 N -6.05 3.16 0.00 2.33 1.02 -0.15 -5.01 119.74 115.04 1t2p s LYS 196 Ca -0.13 -0.86 0.00 0.00 0.02 0.00 0.00 55.97 55.01 1t2p s LYS 196 Cb 0.20 -3.72 -0.00 0.00 -0.52 0.00 0.00 37.83 33.79 1t2p s LYS 196 CO 0.81 -0.55 -0.01 1.03 -0.92 0.00 0.00 175.35 175.71 1t2p s ARG 197 N 1.63 0.06 -0.07 1.68 0.52 -1.26 -1.17 118.95 120.34 1t2p s ARG 197 Ca 0.04 -0.04 0.03 0.00 -0.52 0.00 0.00 55.73 55.25 1t2p s ARG 197 Cb -0.18 -0.05 0.01 0.00 0.52 0.00 0.00 34.95 35.25 1t2p s ARG 197 CO 0.08 0.01 -0.15 0.15 0.02 0.00 0.00 175.30 175.41 1t2p s LYS 198 N -0.05 1.96 -0.03 3.54 3.01 -1.04 -4.32 119.74 122.82 1t2p s LYS 198 Ca -0.00 -0.54 -0.04 0.00 -1.01 0.00 0.00 55.97 54.37 1t2p s LYS 198 Cb -0.00 -1.60 -0.04 0.00 -1.01 0.00 0.00 37.83 35.18 1t2p s LYS 198 CO -0.00 0.11 0.19 0.42 0.51 0.00 0.00 175.35 176.58 1t2p s ILE 199 N 0.46 5.43 -0.04 2.17 -1.09 0.15 -1.39 121.20 126.88 1t2p s ILE 199 Ca -0.13 -0.02 -0.02 0.00 -2.23 0.00 0.00 60.65 58.25 1t2p s ILE 199 Cb -0.15 -3.52 0.03 0.00 -1.58 0.00 0.00 42.46 37.24 1t2p s ILE 199 CO 0.04 0.39 0.05 -0.36 -1.23 0.00 0.00 174.94 173.84 1t2p s PHE 200 N -1.26 0.12 -0.18 3.97 0.40 0.32 0.07 117.98 121.42 1t2p s PHE 200 Ca 0.25 0.21 -0.03 0.00 -0.60 0.00 0.00 56.93 56.76 1t2p s PHE 200 Cb -0.13 -0.50 -0.02 0.00 0.51 0.00 0.00 43.02 42.88 1t2p s PHE 200 CO 0.15 -0.20 -0.05 0.08 0.70 0.00 0.00 175.22 175.90 1t2p s VAL 201 N 2.11 3.60 -0.07 -0.44 1.01 0.90 0.67 120.40 128.18 1t2p s VAL 201 Ca 0.05 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 61.63 1t2p s VAL 201 Cb -0.12 -2.60 -0.00 0.00 0.00 0.00 0.00 36.38 33.66 1t2p s VAL 201 CO -0.03 0.46 -0.23 0.00 0.00 0.00 0.00 175.10 175.30 1t2p s ALA 202 N 0.82 2.03 -0.10 5.51 0.00 -0.06 -0.71 121.76 129.25 1t2p s ALA 202 Ca -0.01 -0.93 -0.03 0.00 0.00 0.00 0.00 51.96 50.98 1t2p s ALA 202 Cb -0.15 -0.70 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 1t2p s ALA 202 CO 0.02 0.33 0.03 0.95 0.00 0.00 0.00 175.76 177.09 1t2p s THR 203 N 0.11 4.57 0.53 0.00 -4.23 -0.60 -0.43 115.64 115.59 1t2p s THR 203 Ca -0.10 -0.14 -0.21 0.00 -1.18 0.00 0.00 61.69 60.05 1t2p s THR 203 Cb -0.15 -2.95 -0.06 0.00 1.34 0.00 0.00 72.50 70.68 1t2p s THR 203 CO 0.06 0.60 1.15 1.21 -0.54 0.00 0.00 174.62 177.10 1t2p n GLU 204 N 2.21 1.38 -2.88 3.99 2.13 -0.77 -0.80 120.64 125.89 1t2p n GLU 204 Ca -0.19 0.51 -0.39 0.00 0.66 0.00 0.00 57.16 57.75 1t2p n GLU 204 Cb 0.54 -2.32 -0.06 0.00 0.27 0.00 0.00 31.44 29.87 1t2p n GLU 204 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1t2p s VAL 205 N -1.35 4.25 0.00 6.31 -7.23 -0.39 -4.80 120.40 117.19 1t2p s VAL 205 Ca 0.70 1.85 0.00 0.00 -1.81 0.00 0.00 61.98 62.72 1t2p s VAL 205 Cb -0.45 -4.20 0.00 0.00 0.56 0.00 0.00 36.38 32.29 1t2p s VAL 205 CO 0.51 0.48 0.00 0.29 -0.31 0.00 0.00 175.10 176.07