#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b4y s SER 37 N 0.00 3.77 -0.02 3.54 0.15 -0.71 -4.54 113.70 115.89 2b4y s SER 37 Ca 0.00 0.95 0.03 0.00 0.70 0.00 0.00 55.95 57.62 2b4y s SER 37 Cb 0.00 -1.52 0.04 0.00 -1.71 0.00 0.00 66.02 62.83 2b4y s SER 37 CO 0.00 -2.38 0.83 -1.20 1.20 0.00 0.00 173.24 171.69 2b4y n SER 38 N -3.65 1.02 -4.41 5.45 7.64 -1.26 -1.77 113.62 116.64 2b4y n SER 38 Ca 0.07 -1.77 -0.29 0.00 1.01 0.00 0.00 58.87 57.89 2b4y n SER 38 Cb 0.59 -0.08 0.19 0.00 -1.01 0.00 0.00 64.21 63.90 2b4y n SER 38 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2b4y s SER 39 N -0.88 2.17 0.00 6.43 0.15 -1.26 -4.99 113.70 115.32 2b4y s SER 39 Ca 0.04 0.94 0.00 0.00 0.70 0.00 0.00 55.95 57.63 2b4y s SER 39 Cb 0.04 -1.45 0.00 0.00 -1.71 0.00 0.00 66.02 62.90 2b4y s SER 39 CO 0.00 -3.39 0.00 0.00 1.20 0.00 0.00 173.24 171.06 2b4y n ALA 41 N -4.31 0.00 -0.32 5.45 0.00 -1.26 -0.18 120.51 119.89 2b4y n ALA 41 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.48 2b4y n ALA 41 Cb 0.58 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.12 2b4y n ALA 41 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2b4y h ASP 42 N 0.00 1.08 0.10 0.00 3.32 -1.99 0.15 116.42 119.08 2b4y h ASP 42 Ca 0.00 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 2b4y h ASP 42 Cb 0.00 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.28 2b4y h ASP 42 CO 0.00 0.86 -0.05 0.15 -1.72 0.00 0.00 179.24 178.48 2b4y h PHE 43 N 1.21 -0.12 -0.26 4.55 3.57 -0.96 -2.84 116.94 122.10 2b4y h PHE 43 Ca 0.31 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.86 2b4y h PHE 43 Cb 0.01 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 2b4y h PHE 43 CO 0.01 0.08 0.18 0.00 -2.23 0.00 0.00 178.31 176.35 2b4y h ARG 44 N -0.31 0.12 0.14 1.11 2.47 -1.73 0.51 114.38 116.70 2b4y h ARG 44 Ca -0.01 -0.01 0.02 0.00 -1.26 0.00 0.00 59.98 58.72 2b4y h ARG 44 Cb 0.26 -0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 28.52 2b4y h ARG 44 CO 0.02 0.08 -0.28 0.87 0.56 0.00 0.00 179.97 181.22 2b4y h LYS 45 N 0.13 -0.49 -0.31 0.04 1.79 -0.48 -0.63 116.57 116.62 2b4y h LYS 45 Ca 0.12 0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.61 2b4y h LYS 45 Cb 0.30 0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 2b4y h LYS 45 CO -0.01 -0.33 0.14 0.74 -1.08 0.00 0.00 179.45 178.91 2b4y h PHE 46 N -0.51 0.45 -0.97 -1.35 0.04 -0.88 -2.86 116.94 110.87 2b4y h PHE 46 Ca 0.03 -0.03 0.20 0.00 2.80 0.00 0.00 57.97 60.96 2b4y h PHE 46 Cb 0.53 -0.14 -0.09 0.00 2.20 0.00 0.00 35.95 38.45 2b4y h PHE 46 CO -0.24 0.42 0.61 0.35 -0.60 0.00 0.00 178.31 178.85 2b4y h PHE 47 N 0.35 0.84 -0.73 -0.55 3.57 -0.80 -2.66 116.94 116.97 2b4y h PHE 47 Ca 0.10 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.65 2b4y h PHE 47 Cb 0.14 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.59 2b4y h PHE 47 CO -0.01 0.20 0.48 0.00 -2.23 0.00 0.00 178.31 176.75 2b4y h ALA 48 N 1.62 1.51 -0.01 2.41 0.00 -0.86 -3.22 119.26 120.72 2b4y h ALA 48 Ca 0.53 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.40 2b4y h ALA 48 Cb 1.02 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2b4y h ALA 48 CO -0.28 0.44 -0.11 1.63 0.00 0.00 0.00 179.25 180.92 2b4y n LYS 49 N -4.44 1.72 -1.65 0.00 4.76 -1.06 -5.03 118.16 112.46 2b4y n LYS 49 Ca 0.08 -0.62 -0.47 0.00 -2.87 0.00 0.00 58.31 54.44 2b4y n LYS 49 Cb 0.06 -1.03 -0.04 0.00 -1.84 0.00 0.00 35.03 32.18 2b4y n LYS 49 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2b4y n ALA 50 N -0.13 1.11 0.59 7.82 0.00 -1.03 -4.86 120.51 124.01 2b4y n ALA 50 Ca 0.03 0.18 0.12 0.00 0.00 0.00 0.00 53.44 53.78 2b4y n ALA 50 Cb 0.16 -2.58 0.26 0.00 0.00 0.00 0.00 19.45 17.29 2b4y n ALA 50 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2b4y n LYS 51 N 7.19 0.28 -3.29 0.00 2.85 -1.26 -4.67 118.16 119.26 2b4y n LYS 51 Ca 0.25 0.14 -0.08 0.00 -1.05 0.00 0.00 58.31 57.56 2b4y n LYS 51 Cb 0.32 -1.73 -0.05 0.00 -0.65 0.00 0.00 35.03 32.92 2b4y n LYS 51 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 2b4y s HIS 52 N -3.14 -1.04 -0.19 5.58 5.04 -1.25 -0.24 115.29 120.05 2b4y s HIS 52 Ca 0.08 0.19 -0.08 0.00 -1.54 0.00 0.00 55.06 53.71 2b4y s HIS 52 Cb 0.13 -0.11 -0.04 0.00 0.04 0.00 0.00 32.58 32.60 2b4y s HIS 52 CO 0.67 -1.01 0.07 0.42 -2.34 0.00 0.00 174.74 172.55 2b4y s ILE 53 N 2.31 4.78 -0.19 0.89 1.01 0.13 -1.18 121.20 128.95 2b4y s ILE 53 Ca 0.12 -0.03 -0.04 0.00 0.00 0.00 0.00 60.65 60.69 2b4y s ILE 53 Cb -0.12 -3.17 -0.02 0.00 0.01 0.00 0.00 42.46 39.16 2b4y s ILE 53 CO -0.23 0.44 -0.02 -0.69 0.00 0.00 0.00 174.94 174.44 2b4y s VAL 54 N 0.54 3.80 -0.20 2.92 1.01 -0.40 -1.21 120.40 126.87 2b4y s VAL 54 Ca 0.04 -0.37 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 2b4y s VAL 54 Cb -0.13 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 2b4y s VAL 54 CO 0.01 0.44 -0.00 -0.63 0.00 0.00 0.00 175.10 174.92 2b4y s ILE 55 N 0.97 3.97 -0.24 2.22 1.01 0.28 -0.50 121.20 128.91 2b4y s ILE 55 Ca 0.01 -0.31 -0.06 0.00 0.00 0.00 0.00 60.65 60.29 2b4y s ILE 55 Cb -0.14 -2.79 -0.02 0.00 0.01 0.00 0.00 42.46 39.52 2b4y s ILE 55 CO 0.01 0.43 0.02 -0.63 0.00 0.00 0.00 174.94 174.77 2b4y s ILE 56 N 0.92 3.84 0.09 2.92 1.01 0.85 0.23 121.20 131.06 2b4y s ILE 56 Ca 0.01 -0.35 0.10 0.00 0.00 0.00 0.00 60.65 60.41 2b4y s ILE 56 Cb -0.14 -2.78 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 2b4y s ILE 56 CO 0.02 0.37 -0.26 -0.94 0.00 0.00 0.00 174.94 174.13 2b4y s SER 57 N 1.54 3.32 0.00 3.58 1.04 -0.47 -0.31 113.70 122.40 2b4y s SER 57 Ca 0.06 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 55.83 2b4y s SER 57 Cb -0.15 -0.29 0.00 0.00 0.10 0.00 0.00 66.02 65.69 2b4y s SER 57 CO 0.00 0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.05 2b4y n GLY 58 N 1.26 5.59 0.21 7.32 0.00 -0.45 -0.97 105.19 118.15 2b4y n GLY 58 Ca -0.17 -2.02 0.06 0.00 0.00 0.00 0.00 46.02 43.89 2b4y n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b4y h ALA 59 N 1.00 1.26 -0.92 4.61 0.00 -1.72 -2.25 119.26 121.25 2b4y h ALA 59 Ca 0.00 -0.27 0.27 0.00 0.00 0.00 0.00 54.91 54.91 2b4y h ALA 59 Cb 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 2b4y h ALA 59 CO 0.00 0.37 0.67 0.78 0.00 0.00 0.00 179.25 181.07 2b4y h GLY 60 N 1.27 0.00 2.00 0.00 0.00 -1.11 -1.55 103.07 103.68 2b4y h GLY 60 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2b4y h GLY 60 CO 0.04 0.00 0.00 -0.24 0.00 0.00 0.00 176.54 176.34 2b4y h VAL 61 N 0.00 0.00 -0.01 4.60 3.04 -1.56 -3.02 116.25 119.30 2b4y h VAL 61 Ca 0.44 -0.48 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 2b4y h VAL 61 Cb 1.77 1.39 0.00 0.00 -2.01 0.00 0.00 31.29 32.44 2b4y h VAL 61 CO -0.00 0.00 -0.29 -1.20 -1.01 0.00 0.00 177.57 175.07 2b4y n SER 62 N -2.73 1.44 -0.09 3.17 7.64 -0.61 -4.59 113.62 117.85 2b4y n SER 62 Ca 0.02 -1.22 0.02 0.00 1.01 0.00 0.00 58.87 58.70 2b4y n SER 62 Cb 0.32 0.48 0.34 0.00 -1.01 0.00 0.00 64.21 64.34 2b4y n SER 62 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b4y h ALA 63 N 2.35 1.58 -0.05 -0.43 0.00 -1.35 0.18 119.26 121.54 2b4y h ALA 63 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2b4y h ALA 63 Cb 0.46 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2b4y h ALA 63 CO 0.00 0.38 0.00 0.39 0.00 0.00 0.00 179.25 180.02 2b4y n GLU 64 N -4.44 1.16 0.00 0.00 1.02 -1.26 -1.90 120.64 115.22 2b4y n GLU 64 Ca 0.05 -0.24 0.12 0.00 -0.02 0.00 0.00 57.16 57.07 2b4y n GLU 64 Cb 0.06 -1.22 0.14 0.00 -0.02 0.00 0.00 31.44 30.40 2b4y n GLU 64 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2b4y n SER 65 N -0.47 2.63 0.00 1.62 7.64 0.62 -4.87 113.62 120.80 2b4y n SER 65 Ca 0.10 -1.84 0.00 0.00 1.01 0.00 0.00 58.87 58.14 2b4y n SER 65 Cb 0.10 0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 2b4y n SER 65 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b4y n GLY 66 N 1.34 0.50 3.69 0.23 0.00 -0.80 -4.55 105.19 105.60 2b4y n GLY 66 Ca 0.14 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 2b4y n GLY 66 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b4y s VAL 67 N -2.00 4.97 0.66 1.61 1.01 -1.13 -5.03 120.40 120.50 2b4y s VAL 67 Ca 0.00 1.50 -0.15 0.00 0.00 0.00 0.00 61.98 63.33 2b4y s VAL 67 Cb 0.00 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.31 2b4y s VAL 67 CO 0.00 0.13 1.11 -2.84 0.00 0.00 0.00 175.10 173.50 2b4y s PRO 68 N 1.56 2.77 0.71 2.72 0.02 -1.26 -3.99 135.00 137.53 2b4y s PRO 68 Ca 0.37 1.41 -0.00 0.00 0.02 0.00 0.00 61.00 62.79 2b4y s PRO 68 Cb -0.17 -1.95 0.12 0.00 0.02 0.00 0.00 34.50 32.53 2b4y s PRO 68 CO 0.15 -1.28 0.98 0.95 -0.33 0.00 0.00 177.00 177.48 2b4y s THR 69 N -2.32 2.14 -0.21 0.99 -4.23 -1.26 -4.95 115.64 105.80 2b4y s THR 69 Ca 0.67 -0.61 -0.14 0.00 -1.18 0.00 0.00 61.69 60.44 2b4y s THR 69 Cb -0.21 -2.53 -0.04 0.00 1.34 0.00 0.00 72.50 71.06 2b4y s THR 69 CO 0.42 0.00 0.29 -0.36 -0.54 0.00 0.00 174.62 174.43 2b4y s PHE 70 N -3.12 3.37 0.00 3.99 0.08 -1.26 -5.13 117.98 115.91 2b4y s PHE 70 Ca 0.66 0.47 0.00 0.00 0.12 0.00 0.00 56.93 58.18 2b4y s PHE 70 Cb -0.05 -2.40 0.00 0.00 -0.57 0.00 0.00 43.02 40.00 2b4y s PHE 70 CO 0.44 0.06 0.00 2.48 -0.10 0.00 0.00 175.22 178.10 2b4y n TYR 76 N 4.25 0.00 -3.82 0.36 0.18 -1.24 -5.21 117.16 111.68 2b4y n TYR 76 Ca -0.11 0.00 -0.28 0.00 1.88 0.00 0.00 57.90 59.39 2b4y n TYR 76 Cb 0.52 0.00 -0.16 0.00 -0.38 0.00 0.00 39.34 39.31 2b4y n TYR 76 CO 0.00 0.00 0.00 -0.46 -2.08 0.00 0.00 176.86 174.32 2b4y s TRP 77 N 0.00 1.47 0.00 -3.48 -0.00 -0.58 -5.00 118.94 111.35 2b4y s TRP 77 Ca 0.00 -1.08 0.00 0.00 -0.00 0.00 0.00 56.10 55.02 2b4y s TRP 77 Cb 0.00 -1.20 0.00 0.00 -0.00 0.00 0.00 33.47 32.27 2b4y s TRP 77 CO 0.00 -0.63 0.00 0.54 -0.00 0.00 0.00 176.95 176.86 2b4y n ARG 78 N 4.93 0.00 0.00 5.86 1.74 0.11 -1.23 116.66 128.07 2b4y n ARG 78 Ca -0.10 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.12 2b4y n ARG 78 Cb 0.47 0.00 0.62 0.00 -1.02 0.00 0.00 32.46 32.53 2b4y n ARG 78 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 2b4y n LYS 79 N 14.00 0.22 -4.06 5.56 2.85 -1.26 -4.55 118.16 130.92 2b4y n LYS 79 Ca 0.00 -0.03 -0.22 0.00 -1.05 0.00 0.00 58.31 57.01 2b4y n LYS 79 Cb 0.00 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 32.84 2b4y n LYS 79 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 2b4y s TRP 80 N -2.80 3.23 0.35 5.58 0.51 -0.36 -5.07 118.94 120.38 2b4y s TRP 80 Ca 0.20 -0.07 0.08 0.00 -2.12 0.00 0.00 56.10 54.19 2b4y s TRP 80 Cb 0.19 -1.47 -0.03 0.00 -0.81 0.00 0.00 33.47 31.35 2b4y s TRP 80 CO 0.52 0.50 0.28 -0.65 -0.51 0.00 0.00 176.95 177.09 2b4y s GLN 81 N -3.81 2.61 0.33 4.98 -0.21 -1.26 -1.53 119.66 120.77 2b4y s GLN 81 Ca 0.33 -1.40 0.08 0.00 0.02 0.00 0.00 55.36 54.39 2b4y s GLN 81 Cb -0.08 -2.39 0.80 0.00 1.00 0.00 0.00 33.01 32.33 2b4y s GLN 81 CO 0.26 0.03 1.82 0.00 -2.12 0.00 0.00 175.29 175.28 2b4y h ALA 82 N 1.26 1.79 0.00 6.09 0.00 -1.98 0.22 119.26 126.64 2b4y h ALA 82 Ca -0.44 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2b4y h ALA 82 Cb 1.26 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2b4y h ALA 82 CO 0.59 -0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.74 2b4y n GLN 83 N -4.65 0.16 0.04 0.00 0.00 -1.26 0.07 117.38 111.73 2b4y n GLN 83 Ca 0.21 0.60 0.11 0.00 0.00 0.00 0.00 57.00 57.92 2b4y n GLN 83 Cb 0.55 -1.96 0.03 0.00 0.00 0.00 0.00 30.24 28.86 2b4y n GLN 83 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2b4y n ASP 84 N -2.28 0.62 -0.01 2.61 8.00 0.75 -4.64 116.55 121.59 2b4y n ASP 84 Ca -0.01 -0.07 -0.01 0.00 0.71 0.00 0.00 54.79 55.41 2b4y n ASP 84 Cb 0.08 0.74 -0.01 0.00 -0.02 0.00 0.00 41.12 41.91 2b4y n ASP 84 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2b4y n LEU 85 N -2.11 2.23 -3.83 0.64 4.77 -0.31 -4.78 117.00 113.63 2b4y n LEU 85 Ca 0.01 -0.01 -0.42 0.00 -0.03 0.00 0.00 56.01 55.57 2b4y n LEU 85 Cb 0.46 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.53 2b4y n LEU 85 CO 0.40 0.40 1.71 0.00 -1.33 0.00 0.00 177.39 178.57 2b4y n ALA 86 N -2.42 5.61 -3.32 -1.18 0.00 0.11 -4.52 120.51 114.79 2b4y n ALA 86 Ca -0.03 -4.47 -0.14 0.00 0.00 0.00 0.00 53.44 48.80 2b4y n ALA 86 Cb 0.53 -2.66 -0.09 0.00 0.00 0.00 0.00 19.45 17.23 2b4y n ALA 86 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2b4y s THR 87 N -1.37 0.02 0.42 0.00 -4.23 -1.26 -1.18 115.64 108.04 2b4y s THR 87 Ca 0.39 -0.18 0.08 0.00 -1.18 0.00 0.00 61.69 60.80 2b4y s THR 87 Cb 0.10 -0.66 0.27 0.00 1.34 0.00 0.00 72.50 73.55 2b4y s THR 87 CO 0.01 -0.10 2.07 -0.65 -0.54 0.00 0.00 174.62 175.41 2b4y h PRO 88 N 4.53 0.48 -0.14 3.99 0.11 -1.91 -2.06 132.00 137.00 2b4y h PRO 88 Ca -0.28 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 2b4y h PRO 88 Cb 1.17 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2b4y h PRO 88 CO 0.32 0.32 0.05 1.25 -0.21 0.00 0.00 178.00 179.72 2b4y h LEU 89 N 0.49 0.20 -0.62 2.35 5.85 -1.97 -1.16 115.31 120.47 2b4y h LEU 89 Ca 0.13 -0.19 0.04 0.00 0.84 0.00 0.00 57.88 58.70 2b4y h LEU 89 Cb -0.05 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 2b4y h LEU 89 CO -0.03 0.35 0.36 0.00 -0.34 0.00 0.00 178.44 178.78 2b4y h ALA 90 N 0.87 0.81 -0.55 1.25 0.00 -1.81 -1.72 119.26 118.11 2b4y h ALA 90 Ca 0.05 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2b4y h ALA 90 Cb 0.21 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2b4y h ALA 90 CO -0.00 0.08 -0.11 0.35 0.00 0.00 0.00 179.25 179.56 2b4y h PHE 91 N 0.70 1.16 -0.40 0.00 3.57 -1.32 0.11 116.94 120.76 2b4y h PHE 91 Ca 0.26 -0.24 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 2b4y h PHE 91 Cb 0.08 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 2b4y h PHE 91 CO -0.07 1.07 0.14 0.00 -2.23 0.00 0.00 178.31 177.22 2b4y h ALA 92 N 0.94 0.53 0.00 2.41 0.00 -1.02 -2.48 119.26 119.64 2b4y h ALA 92 Ca 0.14 -0.16 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 2b4y h ALA 92 Cb 0.68 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2b4y h ALA 92 CO 0.05 0.16 -0.89 0.45 0.00 0.00 0.00 179.25 179.02 2b4y h HIS 93 N 0.51 0.00 -1.29 0.00 3.86 -1.13 -3.40 115.15 113.69 2b4y h HIS 93 Ca 0.13 0.00 -0.36 0.00 -1.16 0.00 0.00 60.37 58.98 2b4y h HIS 93 Cb 0.24 0.00 -0.26 0.00 1.06 0.00 0.00 27.41 28.45 2b4y h HIS 93 CO 0.01 0.89 -0.74 -1.71 0.86 0.00 0.00 177.93 177.23 2b4y n ASN 94 N -3.47 -1.83 0.13 2.45 2.85 0.38 -5.00 115.26 110.77 2b4y n ASN 94 Ca -0.00 -2.83 0.01 0.00 -0.11 0.00 0.00 54.58 51.65 2b4y n ASN 94 Cb 0.85 0.71 0.35 0.00 1.24 0.00 0.00 39.78 42.93 2b4y n ASN 94 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2b4y h PRO 95 N 4.69 0.18 -0.51 1.20 0.13 -1.61 -2.63 132.00 133.45 2b4y h PRO 95 Ca 0.06 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2b4y h PRO 95 Cb 0.99 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.08 2b4y h PRO 95 CO 0.27 0.42 0.32 1.03 -0.23 0.00 0.00 178.00 179.82 2b4y h SER 96 N 0.16 0.60 -0.13 1.44 0.87 -1.88 -0.06 113.55 114.54 2b4y h SER 96 Ca 0.03 -0.04 -0.13 0.00 -1.23 0.00 0.00 61.79 60.42 2b4y h SER 96 Cb 0.54 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 2b4y h SER 96 CO 0.04 0.46 -0.36 -0.09 -0.53 0.00 0.00 176.83 176.35 2b4y h ARG 97 N 0.68 0.65 -0.39 2.24 2.43 -1.87 -1.17 114.38 116.95 2b4y h ARG 97 Ca 0.18 -0.31 -0.02 0.00 -0.81 0.00 0.00 59.98 59.03 2b4y h ARG 97 Cb -0.04 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 2b4y h ARG 97 CO -0.04 0.91 0.18 0.28 -1.51 0.00 0.00 179.97 179.79 2b4y h VAL 98 N 0.54 1.18 -0.59 0.20 2.07 -1.32 -2.13 116.25 116.20 2b4y h VAL 98 Ca 0.05 -0.53 -0.07 0.00 0.82 0.00 0.00 66.70 66.98 2b4y h VAL 98 Cb 0.87 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 2b4y h VAL 98 CO 0.07 0.19 0.09 -0.50 0.02 0.00 0.00 177.57 177.45 2b4y h TRP 99 N 0.49 1.00 -0.66 1.57 4.06 -0.87 -2.20 115.95 119.34 2b4y h TRP 99 Ca 0.13 -0.12 0.05 0.00 2.06 0.00 0.00 58.89 61.01 2b4y h TRP 99 Cb 0.14 -0.28 -0.05 0.00 -1.00 0.00 0.00 29.16 27.97 2b4y h TRP 99 CO -0.01 0.85 0.38 0.93 -3.56 0.00 0.00 178.44 177.03 2b4y h GLU 100 N 0.90 0.69 -0.29 0.49 5.08 -1.10 0.24 114.58 120.59 2b4y h GLU 100 Ca 0.18 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.53 2b4y h GLU 100 Cb 0.39 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 2b4y h GLU 100 CO 0.01 0.46 0.10 0.35 -1.00 0.00 0.00 179.01 178.93 2b4y h PHE 101 N 0.71 0.19 -0.02 4.33 3.57 -1.07 -1.20 116.94 123.45 2b4y h PHE 101 Ca 0.29 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.66 2b4y h PHE 101 Cb 0.14 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 2b4y h PHE 101 CO -0.07 0.08 -0.62 1.88 -2.23 0.00 0.00 178.31 177.35 2b4y h TYR 102 N 0.24 0.10 -0.09 0.41 -1.99 -1.04 -1.96 116.97 112.64 2b4y h TYR 102 Ca 0.13 -0.04 -0.00 0.00 2.00 0.00 0.00 58.73 60.82 2b4y h TYR 102 Cb 0.10 -0.02 -0.00 0.00 2.00 0.00 0.00 36.73 38.81 2b4y h TYR 102 CO -0.13 0.68 0.04 1.25 -0.00 0.00 0.00 178.16 180.00 2b4y h HIS 103 N 0.06 0.12 -0.03 4.88 2.76 -0.42 -0.00 115.15 122.52 2b4y h HIS 103 Ca -0.01 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.19 2b4y h HIS 103 Cb 1.12 -0.04 -0.06 0.00 1.55 0.00 0.00 27.41 29.98 2b4y h HIS 103 CO 0.01 0.18 -0.39 -0.92 -1.30 0.00 0.00 177.93 175.51 2b4y h TYR 104 N 0.03 -1.09 -0.70 5.26 3.20 -1.10 -0.38 116.97 122.20 2b4y h TYR 104 Ca 0.03 0.04 0.11 0.00 3.14 0.00 0.00 58.73 62.04 2b4y h TYR 104 Cb 0.10 0.48 -0.08 0.00 1.54 0.00 0.00 36.73 38.77 2b4y h TYR 104 CO -0.04 -0.47 0.31 0.00 -1.64 0.00 0.00 178.16 176.33 2b4y h ARG 105 N -0.52 0.50 -0.09 1.82 3.08 -1.25 -0.83 114.38 117.08 2b4y h ARG 105 Ca 0.06 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2b4y h ARG 105 Cb 0.62 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 2b4y h ARG 105 CO -0.32 0.33 0.05 0.00 -1.07 0.00 0.00 179.97 178.96 2b4y h ARG 106 N 0.52 0.10 -0.37 0.04 3.08 -0.75 -3.22 114.38 113.78 2b4y h ARG 106 Ca 0.36 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 60.31 2b4y h ARG 106 Cb 0.44 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2b4y h ARG 106 CO -0.31 0.07 -0.14 0.93 -1.07 0.00 0.00 179.97 179.44 2b4y h GLU 107 N 0.11 0.75 -1.64 0.04 4.39 -0.49 -3.01 114.58 114.73 2b4y h GLU 107 Ca 0.04 -0.31 0.00 0.00 0.34 0.00 0.00 59.36 59.42 2b4y h GLU 107 Cb -0.00 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2b4y h GLU 107 CO -0.02 0.92 0.00 0.28 -1.16 0.00 0.00 179.01 179.03 2b4y n VAL 108 N -4.32 0.00 0.00 3.13 0.31 -0.37 -4.02 118.33 113.06 2b4y n VAL 108 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2b4y n VAL 108 Cb 0.39 -0.33 0.00 0.00 -0.91 0.00 0.00 33.84 32.99 2b4y n VAL 108 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2b4y n GLY 110 N 0.93 0.00 0.52 2.92 0.00 -1.14 -4.03 105.19 104.40 2b4y n GLY 110 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 2b4y n GLY 110 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b4y n SER 111 N 0.00 2.18 -4.89 1.61 3.41 -1.26 -5.01 113.62 109.66 2b4y n SER 111 Ca 0.00 -1.59 -0.34 0.00 -0.26 0.00 0.00 58.87 56.68 2b4y n SER 111 Cb 0.00 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 63.85 2b4y n SER 111 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2b4y s LYS 112 N -1.00 3.59 0.13 4.33 -0.14 -1.26 -5.10 119.74 120.28 2b4y s LYS 112 Ca 0.16 -0.09 0.09 0.00 -1.36 0.00 0.00 55.97 54.78 2b4y s LYS 112 Cb 0.11 -3.03 -0.04 0.00 -1.68 0.00 0.00 37.83 33.18 2b4y s LYS 112 CO 0.15 0.61 -0.22 -1.21 -0.76 0.00 0.00 175.35 173.92 2b4y s GLU 113 N -1.97 1.25 0.48 1.68 2.02 -1.26 -5.12 118.70 115.77 2b4y s GLU 113 Ca 0.31 -1.28 -0.24 0.00 0.02 0.00 0.00 54.97 53.78 2b4y s GLU 113 Cb -0.13 -1.54 -0.08 0.00 0.10 0.00 0.00 34.13 32.49 2b4y s GLU 113 CO 0.19 0.35 1.36 -2.30 0.02 0.00 0.00 175.26 174.87 2b4y n PRO 114 N 0.85 1.97 -2.15 0.39 -0.02 -1.26 -4.70 135.00 130.07 2b4y n PRO 114 Ca -0.18 0.71 -0.11 0.00 -2.02 0.00 0.00 63.50 61.90 2b4y n PRO 114 Cb 0.54 -2.54 0.03 0.00 -0.02 0.00 0.00 33.50 31.51 2b4y n PRO 114 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2b4y n ASN 115 N -0.35 1.24 -0.25 2.55 0.23 -1.26 -4.90 115.26 112.52 2b4y n ASN 115 Ca 0.07 -1.85 0.02 0.00 -0.53 0.00 0.00 54.58 52.29 2b4y n ASN 115 Cb 0.42 -0.21 0.15 0.00 -2.08 0.00 0.00 39.78 38.07 2b4y n ASN 115 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2b4y h ALA 116 N 0.34 0.99 -0.05 -2.53 0.00 -1.94 -1.82 119.26 114.26 2b4y h ALA 116 Ca -0.15 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2b4y h ALA 116 Cb 0.68 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2b4y h ALA 116 CO 0.22 -0.11 -0.16 0.78 0.00 0.00 0.00 179.25 179.99 2b4y h GLY 117 N 0.54 -0.16 0.65 0.00 0.00 -1.76 0.04 103.07 102.38 2b4y h GLY 117 Ca 0.37 0.19 0.06 0.00 0.00 0.00 0.00 47.33 47.94 2b4y h GLY 117 CO -0.31 -0.15 0.32 0.45 0.00 0.00 0.00 176.54 176.85 2b4y h HIS 118 N -0.23 0.59 0.27 5.60 3.86 -1.76 -1.74 115.15 121.73 2b4y h HIS 118 Ca 0.07 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 2b4y h HIS 118 Cb 0.33 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.63 2b4y h HIS 118 CO -0.23 0.27 -0.13 0.00 0.86 0.00 0.00 177.93 178.70 2b4y h ARG 119 N 0.60 -0.35 -0.93 2.45 3.08 -1.13 -1.10 114.38 117.00 2b4y h ARG 119 Ca 0.28 0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.44 2b4y h ARG 119 Cb 0.20 0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.26 2b4y h ARG 119 CO -0.19 -0.22 0.57 0.00 -1.07 0.00 0.00 179.97 179.07 2b4y h ALA 120 N 0.35 1.33 -0.29 0.04 0.00 -0.96 0.18 119.26 119.92 2b4y h ALA 120 Ca -0.04 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2b4y h ALA 120 Cb 0.29 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2b4y h ALA 120 CO 0.06 0.25 0.11 0.82 0.00 0.00 0.00 179.25 180.50 2b4y h ILE 121 N 0.98 1.18 -0.49 0.00 2.04 -1.10 0.89 117.51 121.01 2b4y h ILE 121 Ca 0.43 -0.54 -0.12 0.00 1.00 0.00 0.00 64.86 65.63 2b4y h ILE 121 Cb 0.32 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 2b4y h ILE 121 CO -0.22 0.18 -0.17 0.00 0.00 0.00 0.00 178.15 177.94 2b4y h ALA 122 N 0.96 0.76 -0.14 1.87 0.00 -0.68 -2.49 119.26 119.55 2b4y h ALA 122 Ca 0.09 -0.37 -0.21 0.00 0.00 0.00 0.00 54.91 54.42 2b4y h ALA 122 Cb 0.18 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.80 2b4y h ALA 122 CO -0.01 0.67 -0.76 1.05 0.00 0.00 0.00 179.25 180.19 2b4y h GLU 123 N 0.85 0.69 -0.39 0.00 4.11 -0.60 -2.40 114.58 116.84 2b4y h GLU 123 Ca 0.12 -0.56 0.08 0.00 0.07 0.00 0.00 59.36 59.07 2b4y h GLU 123 Cb 0.73 0.12 -0.09 0.00 0.50 0.00 0.00 28.75 30.01 2b4y h GLU 123 CO 0.06 1.18 -0.32 0.00 0.07 0.00 0.00 179.01 179.99 2b4y h GLU 125 N -0.25 1.05 -0.01 0.00 4.81 -1.32 -2.60 114.58 116.27 2b4y h GLU 125 Ca 0.17 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2b4y h GLU 125 Cb 0.54 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 2b4y h GLU 125 CO -0.53 0.70 -0.00 1.15 -0.73 0.00 0.00 179.01 179.59 2b4y h THR 126 N 1.09 1.28 0.00 0.32 2.02 -1.06 -2.56 112.91 114.00 2b4y h THR 126 Ca 0.40 -0.82 0.00 0.00 0.77 0.00 0.00 66.41 66.76 2b4y h THR 126 Cb 0.16 1.82 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 2b4y h THR 126 CO -0.15 0.21 0.00 -2.11 0.37 0.00 0.00 175.52 173.85 2b4y n ARG 127 N -4.92 0.00 0.00 6.66 1.85 -1.11 -2.57 116.66 116.57 2b4y n ARG 127 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.77 2b4y n ARG 127 Cb 0.19 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.60 2b4y n ARG 127 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2b4y n LEU 128 N 0.00 0.00 0.22 2.89 4.32 -0.98 0.38 117.00 123.83 2b4y n LEU 128 Ca 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 56.01 56.08 2b4y n LEU 128 Cb 0.00 0.00 0.48 0.00 -1.62 0.00 0.00 43.42 42.28 2b4y n LEU 128 CO 0.00 0.00 0.80 1.23 -1.22 0.00 0.00 177.39 178.20 2b4y h GLY 129 N 0.00 0.00 1.00 -0.72 0.00 -1.00 -0.61 103.07 101.74 2b4y h GLY 129 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2b4y h GLY 129 CO 0.00 0.00 0.29 0.50 0.00 0.00 0.00 176.54 177.33 2b4y h LYS 130 N 0.00 0.93 0.00 4.80 1.57 0.74 -3.41 116.57 121.20 2b4y h LYS 130 Ca -0.00 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2b4y h LYS 130 Cb 0.71 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.86 2b4y h LYS 130 CO 0.03 0.76 0.00 0.00 -0.57 0.00 0.00 179.45 179.67 2b4y n GLN 131 N -4.47 2.21 0.00 3.15 0.00 -0.92 -4.92 117.38 112.43 2b4y n GLN 131 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 57.00 57.17 2b4y n GLN 131 Cb 0.14 0.00 0.64 0.00 0.00 0.00 0.00 30.24 31.02 2b4y n GLN 131 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2b4y n GLY 132 N 3.62 -1.14 3.73 2.61 0.00 -1.25 -4.99 105.19 107.77 2b4y n GLY 132 Ca 0.00 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 2b4y n GLY 132 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b4y s ARG 133 N -2.60 2.89 -0.21 1.61 0.52 -0.28 -4.95 118.95 115.93 2b4y s ARG 133 Ca 0.23 -0.59 -0.09 0.00 -0.52 0.00 0.00 55.73 54.76 2b4y s ARG 133 Cb 0.17 -2.74 -0.05 0.00 0.52 0.00 0.00 34.95 32.85 2b4y s ARG 133 CO 0.39 0.62 0.12 0.50 0.02 0.00 0.00 175.30 176.95 2b4y s ARG 134 N -1.80 4.11 -0.10 3.54 3.52 0.67 -2.24 118.95 126.64 2b4y s ARG 134 Ca 0.23 -0.26 0.02 0.00 -0.13 0.00 0.00 55.73 55.58 2b4y s ARG 134 Cb -0.12 -3.40 -0.01 0.00 -1.56 0.00 0.00 34.95 29.86 2b4y s ARG 134 CO 0.14 0.23 -0.16 0.08 -0.81 0.00 0.00 175.30 174.78 2b4y s VAL 135 N 0.55 2.80 -0.02 7.11 1.01 -1.26 0.21 120.40 130.79 2b4y s VAL 135 Ca 0.07 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.29 2b4y s VAL 135 Cb -0.12 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.14 2b4y s VAL 135 CO 0.00 0.55 -0.06 0.54 0.00 0.00 0.00 175.10 176.13 2b4y s VAL 136 N 0.09 0.54 -0.22 2.92 0.11 -0.35 -4.65 120.40 118.84 2b4y s VAL 136 Ca -0.07 -0.22 -0.09 0.00 -2.93 0.00 0.00 61.98 58.67 2b4y s VAL 136 Cb -0.15 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.15 2b4y s VAL 136 CO 0.05 0.18 0.11 -0.69 -3.33 0.00 0.00 175.10 171.43 2b4y s VAL 137 N 0.31 5.01 -0.39 2.04 1.01 0.20 -0.55 120.40 128.03 2b4y s VAL 137 Ca -0.04 0.06 -0.05 0.00 0.00 0.00 0.00 61.98 61.95 2b4y s VAL 137 Cb -0.08 -3.31 0.08 0.00 0.00 0.00 0.00 36.38 33.07 2b4y s VAL 137 CO -0.00 0.38 0.18 -0.63 0.00 0.00 0.00 175.10 175.03 2b4y s ILE 138 N 0.90 3.60 -0.04 2.22 1.01 0.13 -0.56 121.20 128.46 2b4y s ILE 138 Ca 0.06 -1.63 0.02 0.00 0.00 0.00 0.00 60.65 59.10 2b4y s ILE 138 Cb -0.13 -3.26 -0.03 0.00 0.01 0.00 0.00 42.46 39.04 2b4y s ILE 138 CO 0.03 -0.48 -0.08 0.28 0.00 0.00 0.00 174.94 174.69 2b4y s THR 139 N 1.28 3.60 -1.20 2.92 -1.32 0.21 -1.37 115.64 119.75 2b4y s THR 139 Ca 0.03 -0.63 0.27 0.00 -1.21 0.00 0.00 61.69 60.15 2b4y s THR 139 Cb -0.22 -2.50 0.21 0.00 -1.51 0.00 0.00 72.50 68.48 2b4y s THR 139 CO -0.01 0.52 1.71 0.00 -2.21 0.00 0.00 174.62 174.62 2b4y n GLN 140 N 1.97 0.22 -3.00 7.08 6.02 -0.14 -1.74 117.38 127.78 2b4y n GLN 140 Ca -0.17 -0.08 -0.37 0.00 -0.01 0.00 0.00 57.00 56.37 2b4y n GLN 140 Cb 0.53 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.23 2b4y n GLN 140 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2b4y s ASN 141 N -2.84 7.19 0.00 1.08 0.01 -1.26 -4.56 114.94 114.56 2b4y s ASN 141 Ca 0.17 1.57 0.13 0.00 -0.71 0.00 0.00 52.86 54.03 2b4y s ASN 141 Cb 0.19 -2.48 0.24 0.00 0.41 0.00 0.00 41.25 39.61 2b4y s ASN 141 CO 0.58 0.04 1.12 2.30 -1.51 0.00 0.00 177.10 179.63 2b4y n ILE 142 N 0.84 0.48 0.70 0.60 -5.35 -1.26 -4.59 119.36 110.79 2b4y n ILE 142 Ca -0.02 -0.74 0.10 0.00 -0.27 0.00 0.00 62.75 61.82 2b4y n ILE 142 Cb 0.50 0.91 0.44 0.00 -1.74 0.00 0.00 39.64 39.75 2b4y n ILE 142 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2b4y n ASP 143 N 0.76 0.03 -0.98 7.28 5.68 -1.26 -1.33 116.55 126.74 2b4y n ASP 143 Ca 0.11 0.51 -0.11 0.00 -0.50 0.00 0.00 54.79 54.79 2b4y n ASP 143 Cb 0.40 -0.51 -0.05 0.00 -1.14 0.00 0.00 41.12 39.82 2b4y n ASP 143 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2b4y n GLU 144 N -1.53 -1.59 0.02 0.11 1.02 -1.26 -4.90 120.64 112.51 2b4y n GLU 144 Ca 0.05 0.80 -0.01 0.00 -0.02 0.00 0.00 57.16 57.98 2b4y n GLU 144 Cb 0.25 -5.05 0.28 0.00 -0.02 0.00 0.00 31.44 26.90 2b4y n GLU 144 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2b4y h LEU 145 N 0.00 0.45 -0.31 -4.62 3.38 -1.94 -0.80 115.31 111.46 2b4y h LEU 145 Ca -0.23 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.66 2b4y h LEU 145 Cb 1.01 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2b4y h LEU 145 CO 0.33 0.58 0.15 0.45 0.09 0.00 0.00 178.44 180.05 2b4y h HIS 146 N 0.44 0.27 -0.60 1.13 3.86 -1.94 -0.78 115.15 117.54 2b4y h HIS 146 Ca 0.09 0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.28 2b4y h HIS 146 Cb 0.44 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 28.80 2b4y h HIS 146 CO 0.01 0.15 0.25 -0.09 0.86 0.00 0.00 177.93 179.10 2b4y h ARG 147 N 0.31 0.89 -0.78 2.45 2.43 -1.70 -1.40 114.38 116.59 2b4y h ARG 147 Ca 0.13 -0.16 0.04 0.00 -0.81 0.00 0.00 59.98 59.18 2b4y h ARG 147 Cb 0.06 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.41 2b4y h ARG 147 CO -0.10 0.75 0.49 -0.22 -1.51 0.00 0.00 179.97 179.39 2b4y h LYS 148 N 0.83 0.92 0.00 0.20 1.63 -1.01 -2.25 116.57 116.88 2b4y h LYS 148 Ca 0.20 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 2b4y h LYS 148 Cb 0.19 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.61 2b4y h LYS 148 CO -0.02 0.61 0.00 0.00 -3.45 0.00 0.00 179.45 176.59 2b4y n ALA 149 N -2.33 1.87 0.00 5.00 0.00 -0.31 -4.85 120.51 119.89 2b4y n ALA 149 Ca 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2b4y n ALA 149 Cb 0.10 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2b4y n ALA 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b4y n GLY 150 N 0.11 0.84 3.72 0.00 0.00 -0.85 -4.78 105.19 104.23 2b4y n GLY 150 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2b4y n GLY 150 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b4y s THR 151 N -2.00 2.14 -0.13 2.61 2.01 -0.55 -4.92 115.64 114.80 2b4y s THR 151 Ca 0.00 0.09 0.02 0.00 0.31 0.00 0.00 61.69 62.12 2b4y s THR 151 Cb 0.00 -3.06 -0.10 0.00 0.01 0.00 0.00 72.50 69.35 2b4y s THR 151 CO 0.00 0.01 -0.10 0.29 -0.69 0.00 0.00 174.62 174.13 2b4y n LYS 152 N 4.03 0.63 -3.02 4.92 5.02 -1.26 -4.46 118.16 124.01 2b4y n LYS 152 Ca 0.16 0.07 -0.44 0.00 -2.02 0.00 0.00 58.31 56.07 2b4y n LYS 152 Cb 0.36 -1.28 -0.01 0.00 -0.02 0.00 0.00 35.03 34.08 2b4y n LYS 152 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2b4y s ASN 153 N -5.19 6.93 -0.08 4.39 0.01 -1.26 -4.96 114.94 114.78 2b4y s ASN 153 Ca -0.17 -2.73 0.02 0.00 -0.71 0.00 0.00 52.86 49.27 2b4y s ASN 153 Cb 0.05 -2.36 0.02 0.00 0.41 0.00 0.00 41.25 39.36 2b4y s ASN 153 CO 0.34 -0.78 -0.11 -0.22 -1.51 0.00 0.00 177.10 174.81 2b4y s LEU 154 N 1.48 1.55 -0.28 0.60 2.96 -1.26 -0.63 118.68 123.11 2b4y s LEU 154 Ca 0.36 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 53.98 2b4y s LEU 154 Cb -0.05 -0.83 0.06 0.00 0.50 0.00 0.00 46.19 45.87 2b4y s LEU 154 CO -0.05 0.00 -0.06 -0.76 -1.32 0.00 0.00 176.35 174.16 2b4y s LEU 155 N 0.89 3.70 -1.06 -0.68 1.43 0.27 -4.99 118.68 118.24 2b4y s LEU 155 Ca -0.10 -1.40 -0.14 0.00 -1.03 0.00 0.00 54.13 51.46 2b4y s LEU 155 Cb -0.15 -1.62 0.19 0.00 0.03 0.00 0.00 46.19 44.65 2b4y s LEU 155 CO 0.01 -0.23 1.18 -1.61 0.23 0.00 0.00 176.35 175.93 2b4y s GLU 156 N 1.15 3.92 0.58 1.70 2.02 -1.26 -0.62 118.70 126.19 2b4y s GLU 156 Ca -0.06 -2.52 0.37 0.00 0.02 0.00 0.00 54.97 52.77 2b4y s GLU 156 Cb -0.20 -4.81 1.66 0.00 0.10 0.00 0.00 34.13 30.88 2b4y s GLU 156 CO -0.04 -1.57 2.09 -0.84 0.02 0.00 0.00 175.26 174.92 2b4y h ILE 157 N 4.73 0.02 -0.59 -1.63 3.07 -1.67 -1.80 117.51 119.62 2b4y h ILE 157 Ca 0.21 -0.38 0.00 0.00 1.55 0.00 0.00 64.86 66.24 2b4y h ILE 157 Cb 0.94 1.38 0.00 0.00 -0.27 0.00 0.00 36.82 38.86 2b4y h ILE 157 CO 1.08 0.00 0.00 1.41 -1.05 0.00 0.00 178.15 179.59 2b4y n HIS 158 N -3.10 0.79 -3.05 0.16 8.25 -1.26 -4.70 115.22 112.31 2b4y n HIS 158 Ca -0.00 -0.43 0.00 0.00 -0.26 0.00 0.00 57.72 57.03 2b4y n HIS 158 Cb 0.24 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.35 2b4y n HIS 158 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2b4y n GLY 159 N 1.47 -1.08 3.09 -1.41 0.00 -0.68 -0.59 105.19 105.99 2b4y n GLY 159 Ca 0.22 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 2b4y n GLY 159 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b4y s SER 160 N -4.00 -0.28 0.55 1.61 0.15 -0.38 -4.41 113.70 106.93 2b4y s SER 160 Ca 0.00 0.54 0.33 0.00 0.70 0.00 0.00 55.95 57.52 2b4y s SER 160 Cb 0.00 0.46 1.50 0.00 -1.71 0.00 0.00 66.02 66.27 2b4y s SER 160 CO 0.00 -0.14 1.85 -0.07 1.20 0.00 0.00 173.24 176.07 2b4y h LEU 161 N 6.76 0.00 -3.65 3.45 3.38 -1.49 -2.67 115.31 121.10 2b4y h LEU 161 Ca -0.36 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.21 2b4y h LEU 161 Cb 1.17 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.69 2b4y h LEU 161 CO 0.36 0.00 0.07 0.49 0.09 0.00 0.00 178.44 179.46 2b4y n PHE 162 N -4.16 2.10 -4.10 1.13 3.72 -1.26 -4.91 117.46 109.98 2b4y n PHE 162 Ca 0.20 -2.03 -0.14 0.00 -0.05 0.00 0.00 57.45 55.43 2b4y n PHE 162 Cb 1.06 -0.72 -0.13 0.00 -0.94 0.00 0.00 39.48 38.75 2b4y n PHE 162 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2b4y s LYS 163 N -3.44 0.49 0.27 -1.08 1.02 -1.01 -1.47 119.74 114.52 2b4y s LYS 163 Ca 0.52 -0.53 0.11 0.00 0.02 0.00 0.00 55.97 56.09 2b4y s LYS 163 Cb 0.44 -0.34 -0.05 0.00 -0.52 0.00 0.00 37.83 37.36 2b4y s LYS 163 CO 0.02 0.08 -0.13 0.95 -0.92 0.00 0.00 175.35 175.35 2b4y s THR 164 N -0.88 2.86 -0.04 2.17 -4.23 0.08 -1.22 115.64 114.38 2b4y s THR 164 Ca -0.05 -2.19 0.02 0.00 -1.18 0.00 0.00 61.69 58.29 2b4y s THR 164 Cb -0.07 -2.50 0.01 0.00 1.34 0.00 0.00 72.50 71.28 2b4y s THR 164 CO 0.00 -0.37 -0.08 -0.60 -0.54 0.00 0.00 174.62 173.03 2b4y s ARG 165 N -3.51 1.04 0.03 3.99 3.52 -0.28 -1.53 118.95 122.20 2b4y s ARG 165 Ca 0.30 -0.26 -0.30 0.00 -0.13 0.00 0.00 55.73 55.34 2b4y s ARG 165 Cb -0.06 -0.96 -0.04 0.00 -1.56 0.00 0.00 34.95 32.33 2b4y s ARG 165 CO 0.17 0.03 1.06 0.00 -0.81 0.00 0.00 175.30 175.75 2b4y n THR 167 N 3.86 0.52 -0.10 0.00 -2.24 0.13 -0.91 114.28 115.54 2b4y n THR 167 Ca 0.07 0.13 -0.15 0.00 -2.27 0.00 0.00 64.05 61.83 2b4y n THR 167 Cb 0.49 -0.77 -0.05 0.00 -2.10 0.00 0.00 70.33 67.91 2b4y n THR 167 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2b4y n SER 168 N -1.47 1.94 0.03 3.42 7.64 -1.26 -4.76 113.62 119.17 2b4y n SER 168 Ca 0.06 0.34 0.11 0.00 1.01 0.00 0.00 58.87 60.39 2b4y n SER 168 Cb 0.24 -0.76 -0.00 0.00 -1.01 0.00 0.00 64.21 62.67 2b4y n SER 168 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b4y n GLY 170 N 1.34 0.45 3.73 0.00 0.00 -0.08 -4.99 105.19 105.63 2b4y n GLY 170 Ca 0.01 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 2b4y n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b4y s VAL 171 N -1.86 3.53 -0.15 1.61 1.01 -1.26 -4.63 120.40 118.65 2b4y s VAL 171 Ca 0.00 1.24 -0.05 0.00 0.00 0.00 0.00 61.98 63.16 2b4y s VAL 171 Cb 0.00 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 2b4y s VAL 171 CO 0.00 0.17 0.04 -0.69 0.00 0.00 0.00 175.10 174.62 2b4y s VAL 172 N 0.24 4.61 -0.00 2.92 1.01 -1.26 -1.44 120.40 126.48 2b4y s VAL 172 Ca 0.55 -0.11 -0.00 0.00 0.00 0.00 0.00 61.98 62.42 2b4y s VAL 172 Cb -0.33 -3.03 -0.00 0.00 0.00 0.00 0.00 36.38 33.02 2b4y s VAL 172 CO 0.35 0.52 0.01 0.00 0.00 0.00 0.00 175.10 175.98 2b4y s ALA 173 N -0.07 -0.01 0.35 5.51 0.00 -0.58 -4.98 121.76 121.97 2b4y s ALA 173 Ca 0.05 -0.04 -0.28 0.00 0.00 0.00 0.00 51.96 51.69 2b4y s ALA 173 Cb -0.12 0.00 -0.11 0.00 0.00 0.00 0.00 23.12 22.89 2b4y s ALA 173 CO 0.01 -0.02 1.38 -1.21 0.00 0.00 0.00 175.76 175.92 2b4y s GLU 174 N -0.17 4.26 -0.26 0.00 2.02 -1.26 -0.75 118.70 122.54 2b4y s GLU 174 Ca -0.02 2.36 -0.02 0.00 0.02 0.00 0.00 54.97 57.31 2b4y s GLU 174 Cb -0.01 -3.03 0.12 0.00 0.10 0.00 0.00 34.13 31.31 2b4y s GLU 174 CO -0.00 -0.33 0.30 1.21 0.02 0.00 0.00 175.26 176.46 2b4y s ASN 175 N -0.33 1.23 0.00 -0.19 3.04 -0.54 -4.85 114.94 113.30 2b4y s ASN 175 Ca 0.51 -0.39 0.14 0.00 0.04 0.00 0.00 52.86 53.16 2b4y s ASN 175 Cb -0.42 0.63 0.22 0.00 -1.54 0.00 0.00 41.25 40.13 2b4y s ASN 175 CO 0.57 -0.35 1.09 -1.22 -3.04 0.00 0.00 177.10 174.15 2b4y n TYR 176 N 5.33 0.23 -1.73 0.43 4.01 -1.26 -4.40 117.16 119.76 2b4y n TYR 176 Ca -0.03 -0.20 -0.42 0.00 -0.16 0.00 0.00 57.90 57.09 2b4y n TYR 176 Cb 0.48 -0.01 -0.01 0.00 -0.31 0.00 0.00 39.34 39.49 2b4y n TYR 176 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2b4y n LYS 177 N 0.79 2.49 -3.83 -0.72 5.02 -1.26 -5.00 118.16 115.64 2b4y n LYS 177 Ca 0.11 0.88 -0.30 0.00 -2.02 0.00 0.00 58.31 56.98 2b4y n LYS 177 Cb 0.40 -2.59 -0.15 0.00 -0.02 0.00 0.00 35.03 32.66 2b4y n LYS 177 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2b4y s SER 178 N 0.17 3.91 0.58 4.39 0.15 -1.26 -2.72 113.70 118.91 2b4y s SER 178 Ca 0.61 -1.46 -0.08 0.00 0.70 0.00 0.00 55.95 55.72 2b4y s SER 178 Cb -0.53 -1.01 -0.02 0.00 -1.71 0.00 0.00 66.02 62.75 2b4y s SER 178 CO 0.55 -0.35 0.92 -2.16 1.20 0.00 0.00 173.24 173.40 2b4y s PRO 179 N 1.50 3.31 0.21 5.44 0.04 -1.26 -5.09 135.00 139.15 2b4y s PRO 179 Ca 0.04 0.34 -0.09 0.00 0.04 0.00 0.00 61.00 61.32 2b4y s PRO 179 Cb -0.18 -2.22 0.22 0.00 0.04 0.00 0.00 34.50 32.36 2b4y s PRO 179 CO -0.15 -0.54 1.84 0.97 0.04 0.00 0.00 177.00 179.16 2b4y h ILE 180 N -0.14 1.06 -3.85 0.56 2.10 -1.89 -3.43 117.51 111.91 2b4y h ILE 180 Ca -0.45 -0.28 -0.23 0.00 1.08 0.00 0.00 64.86 64.98 2b4y h ILE 180 Cb 1.22 0.16 -0.15 0.00 -1.09 0.00 0.00 36.82 36.96 2b4y h ILE 180 CO 0.62 0.15 -0.69 0.00 -1.08 0.00 0.00 178.15 177.15 2b4y h PRO 182 N 2.93 0.94 -0.41 0.00 0.11 -1.88 -2.46 132.00 131.23 2b4y h PRO 182 Ca -0.35 -0.14 0.12 0.00 0.11 0.00 0.00 66.00 65.73 2b4y h PRO 182 Cb 1.17 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 2b4y h PRO 182 CO 0.64 0.75 0.63 0.00 -0.21 0.00 0.00 178.00 179.81 2b4y h ALA 183 N 1.14 2.10 -0.02 -0.75 0.00 -1.99 -0.67 119.26 119.07 2b4y h ALA 183 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2b4y h ALA 183 Cb 0.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2b4y h ALA 183 CO -0.03 -0.84 -0.05 1.28 0.00 0.00 0.00 179.25 179.62 2b4y n LEU 184 N -3.31 2.39 -4.68 0.00 4.77 -0.93 -4.87 117.00 110.37 2b4y n LEU 184 Ca 0.08 -0.80 -0.45 0.00 -0.03 0.00 0.00 56.01 54.80 2b4y n LEU 184 Cb 0.78 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.83 2b4y n LEU 184 CO 0.21 0.40 1.36 -0.24 -1.33 0.00 0.00 177.39 177.79 2b4y n SER 185 N 0.80 3.48 0.00 -1.43 2.88 -0.26 -1.31 113.62 117.78 2b4y n SER 185 Ca 0.15 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 2b4y n SER 185 Cb 0.51 -1.45 0.00 0.00 -0.75 0.00 0.00 64.21 62.52 2b4y n SER 185 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2b4y n GLY 186 N 3.92 0.29 1.81 0.46 0.00 -1.26 -5.00 105.19 105.41 2b4y n GLY 186 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 2b4y n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b4y n LYS 187 N -1.24 0.84 -0.98 1.61 4.76 -0.42 -4.68 118.16 118.04 2b4y n LYS 187 Ca 0.00 -1.46 0.00 0.00 -2.87 0.00 0.00 58.31 53.98 2b4y n LYS 187 Cb 0.21 -0.09 0.00 0.00 -1.84 0.00 0.00 35.03 33.31 2b4y n LYS 187 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2b4y n GLY 188 N 1.73 0.47 3.70 0.72 0.00 -1.26 -4.72 105.19 105.84 2b4y n GLY 188 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2b4y n GLY 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b4y n ALA 189 N 1.00 1.62 1.34 4.61 0.00 -1.26 -4.57 120.51 123.24 2b4y n ALA 189 Ca 0.00 0.39 0.13 0.00 0.00 0.00 0.00 53.44 53.96 2b4y n ALA 189 Cb 0.08 -2.33 0.42 0.00 0.00 0.00 0.00 19.45 17.62 2b4y n ALA 189 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2b4y n PRO 190 N 1.67 1.20 -2.23 0.00 -0.04 -1.26 -4.79 135.00 129.56 2b4y n PRO 190 Ca 0.09 -0.72 -0.41 0.00 -0.04 0.00 0.00 63.50 62.41 2b4y n PRO 190 Cb 0.34 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 32.29 2b4y n PRO 190 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2b4y s GLU 191 N -2.29 4.39 0.29 0.54 8.01 -1.26 0.06 118.70 128.44 2b4y s GLU 191 Ca 0.30 2.04 -0.28 0.00 0.01 0.00 0.00 54.97 57.04 2b4y s GLU 191 Cb 0.20 -3.20 -0.14 0.00 -4.31 0.00 0.00 34.13 26.67 2b4y s GLU 191 CO 0.44 -0.25 0.91 -0.35 0.01 0.00 0.00 175.26 176.03 2b4y n PRO 192 N 2.69 1.11 0.00 0.39 -0.04 -1.26 -2.30 135.00 135.59 2b4y n PRO 192 Ca 0.06 0.39 0.00 0.00 -0.04 0.00 0.00 63.50 63.91 2b4y n PRO 192 Cb 0.43 -1.71 0.00 0.00 -0.04 0.00 0.00 33.50 32.18 2b4y n PRO 192 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b4y n GLY 193 N 1.36 2.75 3.63 0.55 0.00 -1.26 -5.02 105.19 107.21 2b4y n GLY 193 Ca 0.11 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.67 2b4y n GLY 193 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2b4y n THR 194 N -2.00 1.27 -3.16 2.61 -1.04 -0.97 -4.98 114.28 106.01 2b4y n THR 194 Ca 0.00 -0.32 -0.31 0.00 -2.04 0.00 0.00 64.05 61.39 2b4y n THR 194 Cb 0.00 -1.23 -0.04 0.00 -1.82 0.00 0.00 70.33 67.24 2b4y n THR 194 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2b4y s GLN 195 N -0.81 3.79 0.07 -2.82 -1.52 -1.26 -5.02 119.66 112.08 2b4y s GLN 195 Ca 0.66 0.35 -0.31 0.00 -1.95 0.00 0.00 55.36 54.11 2b4y s GLN 195 Cb -0.70 -2.52 -0.08 0.00 -0.22 0.00 0.00 33.01 29.48 2b4y s GLN 195 CO 0.54 0.15 1.71 -0.51 -0.25 0.00 0.00 175.29 176.93 2b4y s ASP 196 N -2.79 6.56 0.41 5.90 1.01 -1.26 -4.90 116.67 121.59 2b4y s ASP 196 Ca 0.49 2.53 0.24 0.00 0.71 0.00 0.00 52.55 56.52 2b4y s ASP 196 Cb -0.11 -2.56 1.27 0.00 1.01 0.00 0.00 42.92 42.53 2b4y s ASP 196 CO 0.26 -0.93 1.68 0.00 0.21 0.00 0.00 175.17 176.39 2b4y h ALA 197 N 8.68 2.43 -6.58 5.23 0.00 -1.95 -3.46 119.26 123.61 2b4y h ALA 197 Ca -0.44 0.11 -0.52 0.00 0.00 0.00 0.00 54.91 54.07 2b4y h ALA 197 Cb 1.21 0.14 -0.12 0.00 0.00 0.00 0.00 17.79 19.02 2b4y h ALA 197 CO 0.94 -1.00 -0.85 0.43 0.00 0.00 0.00 179.25 178.77 2b4y n SER 198 N -4.75 -2.12 -4.71 0.00 7.64 -1.26 -4.93 113.62 103.50 2b4y n SER 198 Ca 0.33 -0.98 -0.42 0.00 1.01 0.00 0.00 58.87 58.80 2b4y n SER 198 Cb 1.18 -3.02 -0.03 0.00 -1.01 0.00 0.00 64.21 61.33 2b4y n SER 198 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2b4y s ILE 199 N -3.60 2.83 0.62 0.44 1.01 -1.26 -4.99 121.20 116.25 2b4y s ILE 199 Ca 0.40 0.52 -0.18 0.00 0.00 0.00 0.00 60.65 61.38 2b4y s ILE 199 Cb -0.21 -3.33 -0.02 0.00 0.01 0.00 0.00 42.46 38.90 2b4y s ILE 199 CO 0.90 0.03 1.21 -2.16 0.00 0.00 0.00 174.94 174.92 2b4y s PRO 200 N 1.60 2.82 0.42 2.79 0.04 -1.26 -4.59 135.00 136.82 2b4y s PRO 200 Ca 0.70 1.83 0.19 0.00 0.04 0.00 0.00 61.00 63.76 2b4y s PRO 200 Cb -0.42 -1.91 1.12 0.00 0.04 0.00 0.00 34.50 33.33 2b4y s PRO 200 CO 0.31 -1.33 1.82 -0.39 0.04 0.00 0.00 177.00 177.45 2b4y h VAL 201 N 0.67 0.60 -0.01 -0.36 -1.51 -1.97 0.39 116.25 114.06 2b4y h VAL 201 Ca -0.50 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 64.84 2b4y h VAL 201 Cb 1.30 0.19 -0.00 0.00 -2.13 0.00 0.00 31.29 30.65 2b4y h VAL 201 CO 0.54 0.07 0.01 -0.33 -1.23 0.00 0.00 177.57 176.63 2b4y h GLU 202 N 0.38 0.00 -0.18 5.19 5.08 -1.99 -2.32 114.58 120.74 2b4y h GLU 202 Ca 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.89 2b4y h GLU 202 Cb 1.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.63 2b4y h GLU 202 CO -0.22 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.42 2b4y n LYS 203 N -3.49 1.68 -1.61 2.33 5.02 0.12 -4.93 118.16 117.27 2b4y n LYS 203 Ca -0.03 -1.60 -0.30 0.00 -2.02 0.00 0.00 58.31 54.37 2b4y n LYS 203 Cb 0.09 -1.24 0.09 0.00 -0.02 0.00 0.00 35.03 33.95 2b4y n LYS 203 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2b4y s LEU 204 N -0.97 2.54 0.10 -0.35 1.43 -0.87 -4.56 118.68 116.01 2b4y s LEU 204 Ca 0.18 1.21 -0.33 0.00 -1.03 0.00 0.00 54.13 54.16 2b4y s LEU 204 Cb 0.11 -3.80 -0.13 0.00 0.03 0.00 0.00 46.19 42.40 2b4y s LEU 204 CO 0.15 -1.97 1.71 -2.65 0.23 0.00 0.00 176.35 173.81 2b4y n PRO 205 N -3.42 2.32 -4.31 1.29 -0.02 -1.26 -4.97 135.00 124.62 2b4y n PRO 205 Ca 0.07 0.84 -0.30 0.00 -2.02 0.00 0.00 63.50 62.09 2b4y n PRO 205 Cb 0.57 -2.66 -0.10 0.00 -0.02 0.00 0.00 33.50 31.29 2b4y n PRO 205 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2b4y s ARG 206 N 2.01 2.23 0.12 -0.52 1.81 -1.26 -1.81 118.95 121.53 2b4y s ARG 206 Ca 0.82 -0.95 -0.31 0.00 -1.72 0.00 0.00 55.73 53.57 2b4y s ARG 206 Cb -0.63 -2.34 -0.09 0.00 -0.45 0.00 0.00 34.95 31.43 2b4y s ARG 206 CO 0.41 0.53 1.62 0.00 -0.68 0.00 0.00 175.30 177.18 2b4y n GLU 208 N 4.78 2.22 -1.74 0.00 1.02 -1.26 -2.73 120.64 122.93 2b4y n GLU 208 Ca 0.15 -1.82 -0.41 0.00 -0.02 0.00 0.00 57.16 55.06 2b4y n GLU 208 Cb 0.39 -1.47 0.01 0.00 -0.02 0.00 0.00 31.44 30.35 2b4y n GLU 208 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2b4y n GLU 209 N 1.08 2.26 -1.83 3.49 -0.58 -1.26 -4.85 120.64 118.95 2b4y n GLU 209 Ca 0.17 0.80 -0.42 0.00 -0.42 0.00 0.00 57.16 57.29 2b4y n GLU 209 Cb 0.52 -2.54 -0.03 0.00 -0.57 0.00 0.00 31.44 28.83 2b4y n GLU 209 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2b4y s ALA 210 N -1.16 3.83 -1.35 0.62 0.00 -1.26 -1.55 121.76 120.88 2b4y s ALA 210 Ca 0.58 1.49 0.00 0.00 0.00 0.00 0.00 51.96 54.03 2b4y s ALA 210 Cb -0.49 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 18.98 2b4y s ALA 210 CO 0.60 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.90 2b4y n GLY 211 N 3.42 0.17 0.00 0.00 0.00 -1.26 -4.95 105.19 102.56 2b4y n GLY 211 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2b4y n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b4y n GLY 213 N 3.33 0.90 3.57 0.00 0.00 -1.10 -5.02 105.19 106.86 2b4y n GLY 213 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2b4y n GLY 213 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b4y s GLY 214 N -1.96 1.58 -0.00 -0.02 0.00 -1.26 -4.43 107.32 101.22 2b4y s GLY 214 Ca 0.00 -0.05 -0.26 0.00 0.00 0.00 0.00 44.72 44.41 2b4y s GLY 214 CO 0.00 0.58 0.79 -2.27 0.00 0.00 0.00 173.10 172.20 2b4y s LEU 215 N -6.89 4.39 0.30 0.66 2.96 -1.26 -0.38 118.68 118.45 2b4y s LEU 215 Ca 0.67 1.41 -0.12 0.00 -0.22 0.00 0.00 54.13 55.87 2b4y s LEU 215 Cb -0.23 -3.26 -0.08 0.00 0.50 0.00 0.00 46.19 43.13 2b4y s LEU 215 CO 0.62 -0.09 0.66 -0.76 -1.32 0.00 0.00 176.35 175.46 2b4y s LEU 216 N 0.47 4.07 0.24 -0.68 1.43 -0.75 -0.69 118.68 122.77 2b4y s LEU 216 Ca 0.41 1.09 0.09 0.00 -1.03 0.00 0.00 54.13 54.69 2b4y s LEU 216 Cb -0.20 -3.89 -0.05 0.00 0.03 0.00 0.00 46.19 42.08 2b4y s LEU 216 CO 0.22 -0.18 -0.15 0.00 0.23 0.00 0.00 176.35 176.47 2b4y s ARG 217 N -3.08 1.47 0.37 1.70 1.70 -0.18 -4.86 118.95 116.08 2b4y s ARG 217 Ca 0.51 -1.67 -0.28 0.00 -0.47 0.00 0.00 55.73 53.81 2b4y s ARG 217 Cb -0.11 -1.34 -0.11 0.00 -0.57 0.00 0.00 34.95 32.83 2b4y s ARG 217 CO 0.21 0.21 1.47 -1.25 -1.08 0.00 0.00 175.30 174.87 2b4y s PRO 218 N -3.61 4.13 -1.33 3.89 0.04 -1.26 -1.13 135.00 135.73 2b4y s PRO 218 Ca 0.26 2.54 -0.09 0.00 0.04 0.00 0.00 61.00 63.75 2b4y s PRO 218 Cb -0.02 -2.98 0.13 0.00 0.04 0.00 0.00 34.50 31.67 2b4y s PRO 218 CO 0.10 -0.51 2.11 1.58 0.04 0.00 0.00 177.00 180.32 2b4y n HIS 219 N 0.49 2.87 -4.34 0.56 -0.00 -0.36 -4.63 115.22 109.81 2b4y n HIS 219 Ca 0.01 -2.83 -0.21 0.00 0.46 0.00 0.00 57.72 55.15 2b4y n HIS 219 Cb 0.39 -2.02 -0.11 0.00 -0.12 0.00 0.00 29.99 28.14 2b4y n HIS 219 CO 0.00 0.00 0.00 0.14 0.46 0.00 0.00 176.34 176.94 2b4y s VAL 220 N 0.41 1.80 -0.29 3.57 -7.23 -1.26 -1.25 120.40 116.14 2b4y s VAL 220 Ca 0.46 -1.99 -0.29 0.00 -1.81 0.00 0.00 61.98 58.34 2b4y s VAL 220 Cb 0.13 -1.89 0.01 0.00 0.56 0.00 0.00 36.38 35.19 2b4y s VAL 220 CO -0.03 -0.39 1.07 -0.69 -0.31 0.00 0.00 175.10 174.75 2b4y s VAL 221 N -2.29 4.55 0.48 1.32 1.01 0.24 -4.94 120.40 120.77 2b4y s VAL 221 Ca 0.17 1.81 -0.03 0.00 0.00 0.00 0.00 61.98 63.93 2b4y s VAL 221 Cb -0.04 -4.38 -0.02 0.00 0.00 0.00 0.00 36.38 31.94 2b4y s VAL 221 CO 0.07 -0.40 0.75 0.26 0.00 0.00 0.00 175.10 175.78 2b4y s TRP 222 N 3.54 3.42 0.33 5.22 0.51 -1.26 -5.01 118.94 125.69 2b4y s TRP 222 Ca 0.45 0.59 -0.27 0.00 -2.12 0.00 0.00 56.10 54.76 2b4y s TRP 222 Cb -0.13 -2.34 -0.13 0.00 -0.81 0.00 0.00 33.47 30.06 2b4y s TRP 222 CO 0.13 -0.35 0.94 1.19 -0.51 0.00 0.00 176.95 178.35 2b4y n PHE 223 N -2.22 1.00 -1.00 -1.98 3.72 -0.32 -2.15 117.46 114.50 2b4y n PHE 223 Ca 0.01 0.67 0.00 0.00 -0.05 0.00 0.00 57.45 58.08 2b4y n PHE 223 Cb 0.56 -2.21 0.00 0.00 -0.94 0.00 0.00 39.48 36.90 2b4y n PHE 223 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2b4y n GLY 224 N 1.30 0.50 3.27 1.37 0.00 -1.26 -4.09 105.19 106.28 2b4y n GLY 224 Ca 0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.97 2b4y n GLY 224 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b4y s GLU 225 N -0.06 1.19 0.39 1.61 2.02 -0.92 -4.90 118.70 118.04 2b4y s GLU 225 Ca 0.00 -1.58 0.04 0.00 0.02 0.00 0.00 54.97 53.45 2b4y s GLU 225 Cb 0.00 -0.42 -0.05 0.00 0.10 0.00 0.00 34.13 33.75 2b4y s GLU 225 CO 0.00 -0.10 0.05 -0.80 0.02 0.00 0.00 175.26 174.42 2b4y s ASN 226 N -3.22 3.11 0.51 -0.19 0.01 -1.26 -4.78 114.94 109.12 2b4y s ASN 226 Ca 0.25 -1.46 -0.23 0.00 -0.71 0.00 0.00 52.86 50.72 2b4y s ASN 226 Cb 0.06 0.00 -0.07 0.00 0.41 0.00 0.00 41.25 41.65 2b4y s ASN 226 CO 0.06 -0.65 1.25 0.18 -1.51 0.00 0.00 177.10 176.42 2b4y n LEU 227 N -0.88 4.57 -4.69 0.60 4.32 -1.26 -4.93 117.00 114.72 2b4y n LEU 227 Ca -0.06 0.99 -0.44 0.00 -0.02 0.00 0.00 56.01 56.49 2b4y n LEU 227 Cb 0.67 -1.51 -0.04 0.00 -1.62 0.00 0.00 43.42 40.92 2b4y n LEU 227 CO 0.43 -0.86 1.38 -0.67 -1.22 0.00 0.00 177.39 176.44 2b4y n ASP 228 N -0.48 3.73 0.22 -1.43 -0.08 -1.26 -4.91 116.55 112.34 2b4y n ASP 228 Ca 0.10 1.03 0.06 0.00 -1.51 0.00 0.00 54.79 54.46 2b4y n ASP 228 Cb 0.43 -1.51 0.51 0.00 2.34 0.00 0.00 41.12 42.89 2b4y n ASP 228 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2b4y h PRO 229 N 7.45 0.00 -0.41 -0.67 0.13 -2.00 -2.40 132.00 134.10 2b4y h PRO 229 Ca -0.45 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.63 2b4y h PRO 229 Cb 1.23 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.34 2b4y h PRO 229 CO 0.93 0.21 0.05 0.00 -0.23 0.00 0.00 178.00 178.96 2b4y h ALA 230 N 1.79 1.33 -0.15 -0.56 0.00 -2.01 -2.33 119.26 117.33 2b4y h ALA 230 Ca -0.00 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2b4y h ALA 230 Cb 0.39 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2b4y h ALA 230 CO 0.03 0.47 -0.13 0.82 0.00 0.00 0.00 179.25 180.43 2b4y h ILE 231 N 0.60 1.34 -0.79 0.00 2.04 -1.83 -2.78 117.51 116.09 2b4y h ILE 231 Ca 0.13 -1.28 0.04 0.00 1.00 0.00 0.00 64.86 64.75 2b4y h ILE 231 Cb 0.30 1.85 -0.05 0.00 -0.74 0.00 0.00 36.82 38.19 2b4y h ILE 231 CO 0.00 0.38 0.52 -0.07 0.00 0.00 0.00 178.15 178.98 2b4y h LEU 232 N -0.01 0.84 -0.50 1.44 3.38 -1.36 -1.11 115.31 117.99 2b4y h LEU 232 Ca 0.03 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2b4y h LEU 232 Cb 0.66 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 2b4y h LEU 232 CO 0.03 0.57 0.25 -0.33 0.09 0.00 0.00 178.44 179.06 2b4y h GLU 233 N 0.97 0.48 -0.85 1.13 5.08 -1.32 -0.00 114.58 120.07 2b4y h GLU 233 Ca 0.32 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.62 2b4y h GLU 233 Cb 0.05 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 2b4y h GLU 233 CO -0.09 0.32 0.41 0.93 -1.00 0.00 0.00 179.01 179.57 2b4y h GLU 234 N 0.50 1.23 0.11 2.33 5.08 -1.10 -1.62 114.58 121.10 2b4y h GLU 234 Ca 0.22 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2b4y h GLU 234 Cb 0.13 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2b4y h GLU 234 CO -0.15 0.94 -0.10 0.28 -1.00 0.00 0.00 179.01 178.98 2b4y h VAL 235 N 1.21 0.78 -0.90 3.13 2.07 -0.89 -1.64 116.25 120.01 2b4y h VAL 235 Ca 0.29 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.81 2b4y h VAL 235 Cb 0.12 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 2b4y h VAL 235 CO -0.04 0.00 0.56 0.44 0.02 0.00 0.00 177.57 178.56 2b4y h ASP 236 N -0.22 1.05 0.37 0.57 3.32 -0.73 0.46 116.42 121.24 2b4y h ASP 236 Ca 0.00 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 2b4y h ASP 236 Cb 0.21 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2b4y h ASP 236 CO -0.02 0.79 -0.25 0.03 -1.72 0.00 0.00 179.24 178.06 2b4y h ARG 237 N 1.23 -0.59 -0.62 3.56 3.08 -0.99 0.26 114.38 120.30 2b4y h ARG 237 Ca 0.32 0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.52 2b4y h ARG 237 Cb -0.09 0.13 -0.08 0.00 0.08 0.00 0.00 29.97 30.02 2b4y h ARG 237 CO -0.07 -0.39 0.22 0.93 -1.07 0.00 0.00 179.97 179.59 2b4y h GLU 238 N -0.61 0.37 -0.53 0.04 4.39 -1.01 -2.05 114.58 115.19 2b4y h GLU 238 Ca -0.04 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.58 2b4y h GLU 238 Cb 0.52 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 2b4y h GLU 238 CO 0.02 0.25 0.10 -0.07 -1.16 0.00 0.00 179.01 178.14 2b4y h LEU 239 N 0.39 0.78 -1.01 1.33 3.38 -0.66 -2.23 115.31 117.29 2b4y h LEU 239 Ca 0.32 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 2b4y h LEU 239 Cb 0.42 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2b4y h LEU 239 CO -0.33 0.79 -0.48 0.00 0.09 0.00 0.00 178.44 178.51 2b4y h ALA 240 N 1.31 1.15 0.00 1.53 0.00 -0.59 -3.24 119.26 119.42 2b4y h ALA 240 Ca 0.17 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2b4y h ALA 240 Cb 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2b4y h ALA 240 CO 0.00 0.60 -0.83 0.72 0.00 0.00 0.00 179.25 179.74 2b4y n HIS 241 N -3.88 0.01 -2.61 0.00 8.25 -0.80 -5.00 115.22 111.18 2b4y n HIS 241 Ca -0.01 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.09 2b4y n HIS 241 Cb 0.51 -0.10 -0.05 0.00 1.12 0.00 0.00 29.99 31.47 2b4y n HIS 241 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2b4y n ASP 243 N -0.14 0.76 -3.69 0.00 5.68 -0.33 -4.98 116.55 113.87 2b4y n ASP 243 Ca 0.05 -0.88 -0.12 0.00 -0.50 0.00 0.00 54.79 53.34 2b4y n ASP 243 Cb 0.51 0.94 -0.09 0.00 -1.14 0.00 0.00 41.12 41.33 2b4y n ASP 243 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 2b4y s LEU 244 N -2.58 -0.17 -0.07 -2.12 2.96 -1.15 -4.41 118.68 111.15 2b4y s LEU 244 Ca 0.06 1.09 0.03 0.00 -0.22 0.00 0.00 54.13 55.09 2b4y s LEU 244 Cb 0.11 1.79 0.01 0.00 0.50 0.00 0.00 46.19 48.59 2b4y s LEU 244 CO 0.55 -0.19 -0.15 0.00 -1.32 0.00 0.00 176.35 175.23 2b4y s LEU 246 N 0.45 3.22 -0.32 0.00 1.43 0.34 -1.51 118.68 122.29 2b4y s LEU 246 Ca -0.13 -0.09 -0.00 0.00 -1.03 0.00 0.00 54.13 52.88 2b4y s LEU 246 Cb -0.15 -1.75 0.07 0.00 0.03 0.00 0.00 46.19 44.39 2b4y s LEU 246 CO 0.04 0.24 0.03 0.54 0.23 0.00 0.00 176.35 177.43 2b4y s VAL 247 N -0.06 2.79 -0.16 -1.59 0.11 -0.18 -0.11 120.40 121.20 2b4y s VAL 247 Ca 0.01 -1.73 -0.01 0.00 -2.93 0.00 0.00 61.98 57.33 2b4y s VAL 247 Cb -0.13 -2.75 -0.01 0.00 -1.53 0.00 0.00 36.38 31.96 2b4y s VAL 247 CO 0.03 -0.30 -0.12 0.68 -3.33 0.00 0.00 175.10 172.06 2b4y s VAL 248 N 1.14 3.00 -1.42 2.04 -7.23 0.57 -1.18 120.40 117.32 2b4y s VAL 248 Ca -0.00 -0.66 -0.07 0.00 -1.81 0.00 0.00 61.98 59.44 2b4y s VAL 248 Cb -0.20 -2.29 0.04 0.00 0.56 0.00 0.00 36.38 34.49 2b4y s VAL 248 CO -0.04 0.50 0.85 0.61 -0.31 0.00 0.00 175.10 176.71 2b4y n GLY 249 N 4.00 -0.40 3.12 2.32 0.00 -0.32 -1.33 105.19 112.57 2b4y n GLY 249 Ca -0.18 0.16 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 2b4y n GLY 249 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2b4y s THR 250 N -3.49 1.04 -1.00 2.61 -1.32 -1.26 -0.52 115.64 111.70 2b4y s THR 250 Ca 0.34 -0.87 0.25 0.00 -1.21 0.00 0.00 61.69 60.21 2b4y s THR 250 Cb -0.17 -0.93 0.21 0.00 -1.51 0.00 0.00 72.50 70.10 2b4y s THR 250 CO 0.82 0.06 1.82 -1.54 -2.21 0.00 0.00 174.62 173.57 2b4y n SER 251 N 2.12 0.00 -3.96 8.08 3.41 -1.26 -4.93 113.62 117.08 2b4y n SER 251 Ca -0.17 0.49 -0.30 0.00 -0.26 0.00 0.00 58.87 58.63 2b4y n SER 251 Cb 0.55 -0.50 0.02 0.00 -0.26 0.00 0.00 64.21 64.02 2b4y n SER 251 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2b4y n SER 252 N -1.50 -4.07 0.00 4.04 7.64 -1.26 -4.44 113.62 114.03 2b4y n SER 252 Ca 0.06 -0.83 0.00 0.00 1.01 0.00 0.00 58.87 59.11 2b4y n SER 252 Cb 0.30 -3.66 0.00 0.00 -1.01 0.00 0.00 64.21 59.84 2b4y n SER 252 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2b4y n VAL 253 N -4.59 0.00 -2.73 0.44 0.24 -1.26 -4.64 118.33 105.79 2b4y n VAL 253 Ca 0.01 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.88 2b4y n VAL 253 Cb 0.54 -0.74 -0.03 0.00 -1.47 0.00 0.00 33.84 32.14 2b4y n VAL 253 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2b4y s VAL 254 N -1.92 4.58 0.57 3.34 1.01 -1.26 -4.88 120.40 121.85 2b4y s VAL 254 Ca 0.00 1.55 -0.16 0.00 0.00 0.00 0.00 61.98 63.36 2b4y s VAL 254 Cb 0.00 -4.34 -0.05 0.00 0.00 0.00 0.00 36.38 31.99 2b4y s VAL 254 CO 0.00 -0.43 1.05 -0.31 0.00 0.00 0.00 175.10 175.40 2b4y s TYR 255 N 3.47 3.04 -0.54 5.22 2.02 -1.26 -1.42 117.35 127.89 2b4y s TYR 255 Ca 0.42 1.51 0.24 0.00 -0.37 0.00 0.00 57.07 58.87 2b4y s TYR 255 Cb -0.13 -2.99 0.45 0.00 -0.40 0.00 0.00 41.96 38.89 2b4y s TYR 255 CO 0.15 -1.01 1.55 -1.00 -1.57 0.00 0.00 175.55 173.68 2b4y h PRO 256 N 0.61 0.00 -0.56 -1.71 0.13 -2.03 -3.45 132.00 124.99 2b4y h PRO 256 Ca -0.47 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.77 2b4y h PRO 256 Cb 1.22 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 2b4y h PRO 256 CO 0.58 0.00 0.38 0.00 -0.23 0.00 0.00 178.00 178.73 2b4y h ALA 257 N 2.24 2.15 0.00 -0.56 0.00 -1.98 -3.30 119.26 117.81 2b4y h ALA 257 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2b4y h ALA 257 Cb 0.88 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2b4y h ALA 257 CO 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 179.25 178.96 2b4y n ALA 258 N -2.55 1.07 0.00 0.00 0.00 -0.50 -4.37 120.51 114.15 2b4y n ALA 258 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2b4y n ALA 258 Cb 0.43 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.14 2b4y n ALA 258 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2b4y n PHE 260 N 0.81 0.00 -0.06 0.00 3.72 -1.24 -4.50 117.46 116.18 2b4y n PHE 260 Ca 0.00 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.25 2b4y n PHE 260 Cb 0.00 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.49 2b4y n PHE 260 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2b4y h ALA 261 N 0.00 0.39 -0.94 4.37 0.00 -1.95 -2.99 119.26 118.15 2b4y h ALA 261 Ca 0.00 -0.52 0.12 0.00 0.00 0.00 0.00 54.91 54.51 2b4y h ALA 261 Cb 0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.66 2b4y h ALA 261 CO 0.00 0.62 0.60 -1.35 0.00 0.00 0.00 179.25 179.12 2b4y h PRO 262 N 0.56 0.83 0.11 0.00 0.11 -1.93 -0.78 132.00 130.90 2b4y h PRO 262 Ca -0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 2b4y h PRO 262 Cb 1.18 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2b4y h PRO 262 CO 0.12 0.55 -0.06 1.96 -0.21 0.00 0.00 178.00 180.37 2b4y h GLN 263 N 0.86 -0.15 -0.82 1.05 4.20 -1.92 0.53 115.11 118.86 2b4y h GLN 263 Ca 0.46 0.01 -0.02 0.00 0.06 0.00 0.00 58.65 59.16 2b4y h GLN 263 Cb 0.56 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.34 2b4y h GLN 263 CO -0.22 -0.07 0.45 -0.39 -0.67 0.00 0.00 178.83 177.92 2b4y h VAL 264 N -0.19 1.24 -0.55 -0.54 -1.51 -1.32 -2.66 116.25 110.73 2b4y h VAL 264 Ca -0.02 -0.61 -0.04 0.00 -1.23 0.00 0.00 66.70 64.81 2b4y h VAL 264 Cb 0.15 0.15 -0.03 0.00 -2.13 0.00 0.00 31.29 29.43 2b4y h VAL 264 CO 0.03 0.27 0.19 0.00 -1.23 0.00 0.00 177.57 176.83 2b4y h ALA 265 N 1.24 1.30 0.00 5.19 0.00 -1.01 -2.57 119.26 123.41 2b4y h ALA 265 Ca 0.29 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2b4y h ALA 265 Cb 0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2b4y h ALA 265 CO -0.05 0.51 -0.25 0.00 0.00 0.00 0.00 179.25 179.46 2b4y h ALA 266 N 1.42 1.23 -0.62 0.00 0.00 -0.54 -2.25 119.26 118.50 2b4y h ALA 266 Ca 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2b4y h ALA 266 Cb 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2b4y h ALA 266 CO -0.01 0.32 0.00 2.89 0.00 0.00 0.00 179.25 182.44 2b4y n ARG 267 N -3.73 3.34 -0.09 0.00 1.85 -0.99 -4.95 116.66 112.08 2b4y n ARG 267 Ca -0.01 -2.61 0.00 0.00 -1.00 0.00 0.00 57.85 54.22 2b4y n ARG 267 Cb 0.36 -1.79 0.00 0.00 -1.05 0.00 0.00 32.46 29.98 2b4y n ARG 267 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2b4y n GLY 268 N 1.20 0.62 3.76 2.89 0.00 -0.84 -5.07 105.19 107.73 2b4y n GLY 268 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 2b4y n GLY 268 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b4y s VAL 269 N -2.16 4.28 0.18 1.61 1.01 -1.07 -5.03 120.40 119.23 2b4y s VAL 269 Ca 0.00 1.92 -0.30 0.00 0.00 0.00 0.00 61.98 63.60 2b4y s VAL 269 Cb 0.00 -4.25 -0.08 0.00 0.00 0.00 0.00 36.38 32.06 2b4y s VAL 269 CO 0.00 0.47 1.10 -2.16 0.00 0.00 0.00 175.10 174.51 2b4y s PRO 270 N -0.94 4.60 -0.11 2.72 0.04 -1.26 -4.04 135.00 136.01 2b4y s PRO 270 Ca 0.40 1.72 0.02 0.00 0.04 0.00 0.00 61.00 63.18 2b4y s PRO 270 Cb -0.24 -3.27 -0.00 0.00 0.04 0.00 0.00 34.50 31.02 2b4y s PRO 270 CO 0.29 0.08 -0.20 0.08 0.04 0.00 0.00 177.00 177.29 2b4y s VAL 271 N -0.28 2.39 -0.29 -0.36 1.01 -1.26 -2.20 120.40 119.42 2b4y s VAL 271 Ca 0.49 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.52 2b4y s VAL 271 Cb -0.29 -1.95 0.02 0.00 0.00 0.00 0.00 36.38 34.15 2b4y s VAL 271 CO 0.35 0.55 0.04 0.00 0.00 0.00 0.00 175.10 176.04 2b4y s ALA 272 N 0.38 2.96 -0.25 5.51 0.00 -0.57 -0.80 121.76 128.99 2b4y s ALA 272 Ca -0.15 -1.50 -0.19 0.00 0.00 0.00 0.00 51.96 50.12 2b4y s ALA 272 Cb -0.17 -2.03 -0.02 0.00 0.00 0.00 0.00 23.12 20.89 2b4y s ALA 272 CO 0.07 -0.95 0.57 -2.00 0.00 0.00 0.00 175.76 173.45 2b4y s GLU 273 N 1.43 4.10 -0.46 0.00 2.12 0.47 -1.01 118.70 125.35 2b4y s GLU 273 Ca 0.01 0.44 -0.12 0.00 0.36 0.00 0.00 54.97 55.67 2b4y s GLU 273 Cb -0.17 -3.64 0.09 0.00 0.26 0.00 0.00 34.13 30.67 2b4y s GLU 273 CO 0.01 -0.36 0.35 -0.06 -0.54 0.00 0.00 175.26 174.65 2b4y s PHE 274 N 2.34 3.32 -0.10 5.30 0.08 -0.33 -0.76 117.98 127.83 2b4y s PHE 274 Ca 0.24 -1.40 -0.12 0.00 0.12 0.00 0.00 56.93 55.78 2b4y s PHE 274 Cb -0.16 -3.25 0.03 0.00 -0.57 0.00 0.00 43.02 39.08 2b4y s PHE 274 CO 0.09 -0.89 0.32 1.21 -0.10 0.00 0.00 175.22 175.85 2b4y s ASN 275 N 2.58 -0.31 0.41 1.36 3.84 -1.11 -1.18 114.94 120.53 2b4y s ASN 275 Ca 0.04 0.56 0.28 0.00 0.21 0.00 0.00 52.86 53.94 2b4y s ASN 275 Cb -0.25 0.60 1.45 0.00 -0.55 0.00 0.00 41.25 42.51 2b4y s ASN 275 CO 0.03 -0.16 1.85 0.00 -2.79 0.00 0.00 177.10 176.03 2b4y h THR 276 N 4.53 0.00 -3.85 -5.21 1.03 -1.80 -1.53 112.91 106.07 2b4y h THR 276 Ca -0.27 -0.05 -0.23 0.00 -0.01 0.00 0.00 66.41 65.84 2b4y h THR 276 Cb 1.19 0.71 -0.05 0.00 -1.07 0.00 0.00 68.15 68.93 2b4y h THR 276 CO 0.32 0.00 -0.06 -1.84 -0.01 0.00 0.00 175.52 173.93 2b4y n GLU 277 N -2.49 0.82 -3.13 0.00 0.28 -1.26 -4.48 120.64 110.38 2b4y n GLU 277 Ca -0.01 -2.76 -0.35 0.00 -0.16 0.00 0.00 57.16 53.88 2b4y n GLU 277 Cb 0.08 2.79 -0.06 0.00 1.43 0.00 0.00 31.44 35.68 2b4y n GLU 277 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2b4y s THR 278 N -2.67 4.62 0.30 3.84 2.01 -1.26 -4.99 115.64 117.48 2b4y s THR 278 Ca 0.27 1.17 0.03 0.00 0.31 0.00 0.00 61.69 63.47 2b4y s THR 278 Cb -0.02 -3.79 -0.06 0.00 0.01 0.00 0.00 72.50 68.64 2b4y s THR 278 CO 0.19 0.12 0.06 0.42 -0.69 0.00 0.00 174.62 174.72 2b4y s THR 279 N -1.63 1.01 -1.06 -0.82 -4.23 -1.26 -5.04 115.64 102.62 2b4y s THR 279 Ca 0.45 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.02 2b4y s THR 279 Cb -0.15 -2.72 0.06 0.00 1.34 0.00 0.00 72.50 71.03 2b4y s THR 279 CO 0.20 -0.03 1.17 -2.65 -0.54 0.00 0.00 174.62 172.77 2b4y n PRO 280 N -0.61 0.01 -0.00 3.99 -0.02 -1.26 -2.44 135.00 134.67 2b4y n PRO 280 Ca -0.02 0.38 0.08 0.00 -2.02 0.00 0.00 63.50 61.92 2b4y n PRO 280 Cb 0.66 -1.50 -0.11 0.00 -0.02 0.00 0.00 33.50 32.54 2b4y n PRO 280 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b4y n ALA 281 N -1.47 3.70 -0.31 3.55 0.00 -1.26 -4.72 120.51 120.00 2b4y n ALA 281 Ca 0.02 -0.45 0.14 0.00 0.00 0.00 0.00 53.44 53.14 2b4y n ALA 281 Cb 0.07 -0.60 0.30 0.00 0.00 0.00 0.00 19.45 19.21 2b4y n ALA 281 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2b4y h THR 282 N 0.00 0.17 0.00 0.00 2.02 -1.89 0.51 112.91 113.73 2b4y h THR 282 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 2b4y h THR 282 Cb 0.52 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2b4y h THR 282 CO 0.00 0.02 0.00 0.59 0.37 0.00 0.00 175.52 176.50 2b4y n ASN 283 N -5.35 0.00 0.04 4.18 4.13 -1.26 -1.81 115.26 115.19 2b4y n ASN 283 Ca 0.23 -0.28 0.13 0.00 1.68 0.00 0.00 54.58 56.33 2b4y n ASN 283 Cb 0.74 -0.22 0.49 0.00 -1.54 0.00 0.00 39.78 39.25 2b4y n ASN 283 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2b4y n ARG 284 N -1.22 0.11 -3.87 3.52 1.74 0.17 -4.92 116.66 112.19 2b4y n ARG 284 Ca 0.15 0.08 -0.21 0.00 -0.77 0.00 0.00 57.85 57.10 2b4y n ARG 284 Cb 0.19 -1.62 -0.02 0.00 -1.02 0.00 0.00 32.46 30.00 2b4y n ARG 284 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2b4y s PHE 285 N -3.04 3.38 0.02 -1.55 0.08 -0.75 -4.84 117.98 111.28 2b4y s PHE 285 Ca 0.12 -0.06 -0.20 0.00 0.12 0.00 0.00 56.93 56.92 2b4y s PHE 285 Cb 0.16 -1.66 -0.20 0.00 -0.57 0.00 0.00 43.02 40.75 2b4y s PHE 285 CO 0.58 0.35 1.17 -0.09 -0.10 0.00 0.00 175.22 177.13 2b4y h ARG 286 N 1.11 0.42 -5.77 0.44 9.65 -1.27 -3.43 114.38 115.53 2b4y h ARG 286 Ca -0.51 -0.37 -0.54 0.00 -1.10 0.00 0.00 59.98 57.46 2b4y h ARG 286 Cb 1.24 0.09 -0.27 0.00 -1.39 0.00 0.00 29.97 29.63 2b4y h ARG 286 CO 0.59 1.02 -0.83 -0.06 2.80 0.00 0.00 179.97 183.50 2b4y s PHE 287 N -3.50 1.61 -0.19 2.20 0.08 -0.63 -1.74 117.98 115.80 2b4y s PHE 287 Ca -0.13 -0.34 -0.01 0.00 0.12 0.00 0.00 56.93 56.57 2b4y s PHE 287 Cb 0.04 -0.99 0.05 0.00 -0.57 0.00 0.00 43.02 41.56 2b4y s PHE 287 CO 0.81 0.03 -0.01 -1.58 -0.10 0.00 0.00 175.22 174.37 2b4y s HIS 288 N -0.64 1.47 -0.46 0.36 5.65 -0.73 -0.39 115.29 120.55 2b4y s HIS 288 Ca 0.06 -1.06 -0.12 0.00 0.25 0.00 0.00 55.06 54.19 2b4y s HIS 288 Cb -0.08 -1.21 0.09 0.00 -1.18 0.00 0.00 32.58 30.21 2b4y s HIS 288 CO 0.01 -0.63 0.35 -0.06 -0.65 0.00 0.00 174.74 173.76 2b4y s PHE 289 N 1.71 3.31 -0.71 3.88 0.08 0.06 -4.65 117.98 121.65 2b4y s PHE 289 Ca -0.01 -1.34 -0.20 0.00 0.12 0.00 0.00 56.93 55.50 2b4y s PHE 289 Cb -0.17 -3.23 0.11 0.00 -0.57 0.00 0.00 43.02 39.16 2b4y s PHE 289 CO -0.07 -0.88 0.90 -1.14 -0.10 0.00 0.00 175.22 173.93 2b4y s GLN 290 N 1.51 3.24 0.02 0.44 0.74 -1.26 -2.76 119.66 121.60 2b4y s GLN 290 Ca 0.04 -1.35 -0.28 0.00 0.05 0.00 0.00 55.36 53.82 2b4y s GLN 290 Cb -0.25 -4.43 0.10 0.00 1.10 0.00 0.00 33.01 29.53 2b4y s GLN 290 CO 0.03 -1.67 1.23 0.20 -0.55 0.00 0.00 175.29 174.53 2b4y s GLY 291 N 3.56 -0.20 0.13 2.59 0.00 -0.58 -4.91 107.32 107.92 2b4y s GLY 291 Ca 0.21 0.22 -0.31 0.00 0.00 0.00 0.00 44.72 44.84 2b4y s GLY 291 CO 0.03 2.83 1.35 2.56 0.00 0.00 0.00 173.10 179.86 2b4y s PRO 292 N -2.25 4.35 0.38 2.90 0.04 -1.26 -2.72 135.00 136.44 2b4y s PRO 292 Ca 0.22 2.04 0.28 0.00 0.04 0.00 0.00 61.00 63.58 2b4y s PRO 292 Cb 0.01 -3.24 1.13 0.00 0.04 0.00 0.00 34.50 32.44 2b4y s PRO 292 CO -0.01 -0.37 1.83 0.00 0.04 0.00 0.00 177.00 178.49 2b4y n GLY 294 N 0.09 -0.97 0.05 0.00 0.00 -1.26 -1.28 105.19 101.82 2b4y n GLY 294 Ca 0.02 0.12 -0.07 0.00 0.00 0.00 0.00 46.02 46.09 2b4y n GLY 294 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b4y n THR 295 N -2.11 0.59 -0.07 2.61 -2.24 -0.62 -4.30 114.28 108.14 2b4y n THR 295 Ca 0.00 -0.24 -0.12 0.00 -2.27 0.00 0.00 64.05 61.43 2b4y n THR 295 Cb 0.10 -0.86 -0.05 0.00 -2.10 0.00 0.00 70.33 67.42 2b4y n THR 295 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2b4y h THR 296 N 0.00 1.26 -0.24 4.28 1.35 -1.34 -3.26 112.91 114.97 2b4y h THR 296 Ca -0.23 -0.91 -0.00 0.00 -0.55 0.00 0.00 66.41 64.72 2b4y h THR 296 Cb 1.37 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 69.26 2b4y h THR 296 CO -0.03 0.28 0.14 -0.07 -0.25 0.00 0.00 175.52 175.59 2b4y h LEU 297 N 0.10 0.30 -0.86 3.87 3.38 -1.45 -1.30 115.31 119.34 2b4y h LEU 297 Ca 0.05 -0.07 0.19 0.00 0.09 0.00 0.00 57.88 58.15 2b4y h LEU 297 Cb 0.42 -0.08 -0.11 0.00 0.09 0.00 0.00 40.66 40.98 2b4y h LEU 297 CO 0.01 0.28 0.38 -0.65 0.09 0.00 0.00 178.44 178.55 2b4y h PRO 298 N 0.29 0.43 0.33 1.13 0.11 -1.74 0.29 132.00 132.85 2b4y h PRO 298 Ca 0.09 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 2b4y h PRO 298 Cb 0.04 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.06 2b4y h PRO 298 CO -0.02 0.28 -0.16 1.49 -0.21 0.00 0.00 178.00 179.39 2b4y h GLU 299 N 0.44 -0.43 -1.17 1.05 4.81 -1.52 -2.69 114.58 115.06 2b4y h GLU 299 Ca 0.52 0.03 0.37 0.00 -0.13 0.00 0.00 59.36 60.15 2b4y h GLU 299 Cb 0.91 0.10 -0.13 0.00 0.63 0.00 0.00 28.75 30.26 2b4y h GLU 299 CO -0.48 -0.29 0.73 0.00 -0.73 0.00 0.00 179.01 178.24 2b4y h ALA 300 N -1.63 2.42 -0.06 2.92 0.00 -1.14 -0.96 119.26 120.81 2b4y h ALA 300 Ca -0.05 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2b4y h ALA 300 Cb 0.34 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2b4y h ALA 300 CO 0.08 -1.01 0.00 1.28 0.00 0.00 0.00 179.25 179.59 2b4y n LEU 301 N -4.79 2.92 0.00 0.00 4.77 0.08 -4.84 117.00 115.15 2b4y n LEU 301 Ca 0.33 -1.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.26 2b4y n LEU 301 Cb 1.21 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 42.27 2b4y n LEU 301 CO 0.18 0.51 0.18 0.00 -1.33 0.00 0.00 177.39 176.93