#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nb4 s MET 2 N 0.00 4.75 0.36 4.33 1.00 -1.26 -1.91 119.30 126.57 1nb4 s MET 2 Ca 0.00 1.47 0.04 0.00 0.00 0.00 0.00 55.69 57.20 1nb4 s MET 2 Cb 0.00 -3.34 0.68 0.00 0.00 0.00 0.00 34.83 32.17 1nb4 s MET 2 CO 0.00 0.32 1.99 0.66 0.00 0.00 0.00 175.02 177.98 1nb4 h SER 3 N 5.07 0.70 -5.05 3.03 4.64 -1.37 -3.41 113.55 117.16 1nb4 h SER 3 Ca -0.44 -0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 60.75 1nb4 h SER 3 Cb 1.21 -0.16 -0.18 0.00 -0.31 0.00 0.00 62.40 62.95 1nb4 h SER 3 CO 0.70 0.48 -0.43 -0.31 -0.87 0.00 0.00 176.83 176.41 1nb4 s TYR 4 N -5.71 0.06 -0.02 4.77 1.51 -1.26 -1.25 117.35 115.45 1nb4 s TYR 4 Ca -0.10 -0.24 0.05 0.00 -1.01 0.00 0.00 57.07 55.77 1nb4 s TYR 4 Cb 0.18 -0.04 -0.01 0.00 -0.11 0.00 0.00 41.96 41.98 1nb4 s TYR 4 CO 0.77 -0.39 -0.17 0.99 -1.11 0.00 0.00 175.55 175.64 1nb4 s THR 5 N -2.23 1.37 0.04 -0.71 2.01 -0.36 -4.84 115.64 110.92 1nb4 s THR 5 Ca -0.08 -0.73 0.08 0.00 0.31 0.00 0.00 61.69 61.28 1nb4 s THR 5 Cb -0.03 -1.15 -0.03 0.00 0.01 0.00 0.00 72.50 71.31 1nb4 s THR 5 CO -0.02 0.39 -0.24 0.26 -0.69 0.00 0.00 174.62 174.32 1nb4 s TRP 6 N -0.30 2.10 0.01 4.92 0.52 -1.26 -0.29 118.94 124.63 1nb4 s TRP 6 Ca 0.04 -0.40 0.05 0.00 0.02 0.00 0.00 56.10 55.82 1nb4 s TRP 6 Cb -0.08 -1.26 -0.24 0.00 -1.15 0.00 0.00 33.47 30.74 1nb4 s TRP 6 CO -0.00 0.10 0.85 1.79 0.02 0.00 0.00 176.95 179.71 1nb4 h THR 7 N 4.30 1.14 0.00 2.01 1.35 -1.71 -3.48 112.91 116.52 1nb4 h THR 7 Ca -0.44 -2.88 0.00 0.00 -0.55 0.00 0.00 66.41 62.53 1nb4 h THR 7 Cb 1.15 2.64 0.00 0.00 -1.73 0.00 0.00 68.15 70.20 1nb4 h THR 7 CO 0.44 0.74 0.00 0.61 -0.25 0.00 0.00 175.52 177.06 1nb4 n GLY 8 N 1.57 2.08 3.76 5.82 0.00 -1.26 -5.09 105.19 112.06 1nb4 n GLY 8 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 1nb4 n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nb4 s ALA 9 N -2.00 2.81 0.56 4.61 0.00 -1.26 -4.99 121.76 121.49 1nb4 s ALA 9 Ca 0.00 1.18 -0.07 0.00 0.00 0.00 0.00 51.96 53.07 1nb4 s ALA 9 Cb 0.00 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 1nb4 s ALA 9 CO 0.00 -1.15 0.89 -0.51 0.00 0.00 0.00 175.76 174.98 1nb4 s LEU 10 N -3.48 3.38 -0.29 0.00 2.01 -1.26 -4.88 118.68 114.16 1nb4 s LEU 10 Ca 0.70 0.96 -0.23 0.00 0.01 0.00 0.00 54.13 55.58 1nb4 s LEU 10 Cb -0.36 -3.89 -0.00 0.00 0.01 0.00 0.00 46.19 41.96 1nb4 s LEU 10 CO 0.42 -0.83 0.77 -0.63 1.01 0.00 0.00 176.35 177.09 1nb4 s ILE 11 N -2.94 4.82 0.26 -0.59 1.01 -1.26 -4.81 121.20 117.69 1nb4 s ILE 11 Ca 0.51 1.21 0.09 0.00 0.00 0.00 0.00 60.65 62.47 1nb4 s ILE 11 Cb -0.11 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 1nb4 s ILE 11 CO 0.47 -0.20 -0.01 0.42 0.00 0.00 0.00 174.94 175.61 1nb4 s THR 12 N 2.89 3.42 0.59 2.92 -4.23 -1.26 -4.94 115.64 115.03 1nb4 s THR 12 Ca 0.32 -1.89 -0.05 0.00 -1.18 0.00 0.00 61.69 58.89 1nb4 s THR 12 Cb -0.14 -2.82 0.01 0.00 1.34 0.00 0.00 72.50 70.89 1nb4 s THR 12 CO 0.12 -0.35 0.89 -2.16 -0.54 0.00 0.00 174.62 172.58 1nb4 s PRO 13 N -3.58 2.85 -0.16 3.99 0.04 -1.26 -4.37 135.00 132.51 1nb4 s PRO 13 Ca 0.31 -0.09 0.17 0.00 0.04 0.00 0.00 61.00 61.42 1nb4 s PRO 13 Cb -0.07 -2.29 0.34 0.00 0.04 0.00 0.00 34.50 32.52 1nb4 s PRO 13 CO 0.19 -0.72 1.18 0.00 0.04 0.00 0.00 177.00 177.70 1nb4 n ALA 15 N -1.32 0.00 -1.62 0.00 0.00 -1.26 -5.15 120.51 111.16 1nb4 n ALA 15 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.26 1nb4 n ALA 15 Cb 0.67 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.16 1nb4 n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nb4 s ALA 16 N -2.00 2.46 -0.21 0.00 0.00 -1.26 -5.02 121.76 115.74 1nb4 s ALA 16 Ca 0.00 0.85 0.02 0.00 0.00 0.00 0.00 51.96 52.82 1nb4 s ALA 16 Cb 0.00 -3.41 0.04 0.00 0.00 0.00 0.00 23.12 19.75 1nb4 s ALA 16 CO 0.00 -1.27 -0.16 -1.21 0.00 0.00 0.00 175.76 173.13 1nb4 s GLU 17 N -3.61 2.58 0.32 0.00 2.02 -1.26 -5.11 118.70 113.63 1nb4 s GLU 17 Ca 0.74 -0.97 -0.28 0.00 0.02 0.00 0.00 54.97 54.48 1nb4 s GLU 17 Cb -0.27 -2.62 -0.09 0.00 0.10 0.00 0.00 34.13 31.25 1nb4 s GLU 17 CO 0.36 -0.35 1.08 -1.21 0.02 0.00 0.00 175.26 175.16 1nb4 s GLU 18 N 1.26 4.50 0.00 1.61 8.01 -1.26 -4.96 118.70 127.86 1nb4 s GLU 18 Ca -0.00 1.71 0.00 0.00 0.01 0.00 0.00 54.97 56.69 1nb4 s GLU 18 Cb -0.16 -3.00 0.00 0.00 -4.31 0.00 0.00 34.13 26.67 1nb4 s GLU 18 CO -0.10 0.11 0.00 -1.13 0.01 0.00 0.00 175.26 174.15 1nb4 n SER 19 N 0.82 0.41 -4.54 -0.19 3.41 -1.26 -4.67 113.62 107.59 1nb4 n SER 19 Ca 0.01 -0.21 -0.28 0.00 -0.26 0.00 0.00 58.87 58.13 1nb4 n SER 19 Cb 0.46 0.50 -0.10 0.00 -0.26 0.00 0.00 64.21 64.81 1nb4 n SER 19 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1nb4 s LYS 20 N -0.58 1.97 -0.10 4.33 1.02 -1.26 -2.21 119.74 122.91 1nb4 s LYS 20 Ca 0.00 -1.24 -0.28 0.00 0.02 0.00 0.00 55.97 54.47 1nb4 s LYS 20 Cb 0.00 -2.14 -0.02 0.00 -0.52 0.00 0.00 37.83 35.15 1nb4 s LYS 20 CO 0.00 0.45 0.93 -1.17 -0.92 0.00 0.00 175.35 174.64 1nb4 s LEU 21 N -2.60 4.26 0.65 3.17 2.96 -1.25 -4.96 118.68 120.91 1nb4 s LEU 21 Ca 0.23 1.44 -0.16 0.00 -0.22 0.00 0.00 54.13 55.41 1nb4 s LEU 21 Cb -0.09 -3.44 -0.00 0.00 0.50 0.00 0.00 46.19 43.15 1nb4 s LEU 21 CO 0.14 -0.38 1.16 -2.84 -1.32 0.00 0.00 176.35 173.11 1nb4 s PRO 22 N 1.78 2.71 -0.48 0.98 0.02 -1.26 -4.91 135.00 133.84 1nb4 s PRO 22 Ca 0.46 1.62 -0.25 0.00 0.02 0.00 0.00 61.00 62.84 1nb4 s PRO 22 Cb -0.18 -1.92 0.03 0.00 0.02 0.00 0.00 34.50 32.45 1nb4 s PRO 22 CO 0.18 -1.36 0.91 -1.50 -0.33 0.00 0.00 177.00 174.90 1nb4 s ILE 23 N -2.01 4.48 0.01 2.83 2.07 -1.26 -4.92 121.20 122.40 1nb4 s ILE 23 Ca 0.72 0.61 0.02 0.00 -1.41 0.00 0.00 60.65 60.59 1nb4 s ILE 23 Cb -0.25 -4.44 -0.01 0.00 0.13 0.00 0.00 42.46 37.89 1nb4 s ILE 23 CO 0.39 -0.87 -0.08 0.21 -1.91 0.00 0.00 174.94 172.68 1nb4 s ASN 24 N 2.36 0.89 0.18 4.50 2.47 -1.26 -5.06 114.94 119.02 1nb4 s ASN 24 Ca 0.35 -0.23 -0.13 0.00 0.42 0.00 0.00 52.86 53.26 1nb4 s ASN 24 Cb -0.11 -0.07 0.11 0.00 -1.45 0.00 0.00 41.25 39.74 1nb4 s ASN 24 CO 0.24 0.02 1.81 -0.65 -3.72 0.00 0.00 177.10 174.81 1nb4 h PRO 25 N 5.60 0.57 -0.03 0.43 0.11 -1.98 0.87 132.00 137.57 1nb4 h PRO 25 Ca -0.31 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.76 1nb4 h PRO 25 Cb 1.19 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1nb4 h PRO 25 CO 0.48 0.38 0.00 -0.07 -0.21 0.00 0.00 178.00 178.57 1nb4 h LEU 26 N 0.59 0.04 -0.75 2.35 3.38 -1.97 -2.55 115.31 116.40 1nb4 h LEU 26 Ca 0.22 -0.31 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 1nb4 h LEU 26 Cb 0.06 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1nb4 h LEU 26 CO -0.11 0.34 -0.29 0.77 0.09 0.00 0.00 178.44 179.24 1nb4 h SER 27 N -0.26 0.65 0.06 -0.43 4.64 -1.83 -2.85 113.55 113.53 1nb4 h SER 27 Ca 0.01 -0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 61.07 1nb4 h SER 27 Cb 0.32 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1nb4 h SER 27 CO 0.00 0.90 -0.04 -1.13 -0.87 0.00 0.00 176.83 175.70 1nb4 h ASN 28 N 0.54 0.00 1.26 4.97 -1.24 -0.79 0.43 115.58 120.76 1nb4 h ASN 28 Ca 0.07 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.08 1nb4 h ASN 28 Cb 0.77 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.82 1nb4 h ASN 28 CO 0.06 0.04 0.00 0.77 -1.29 0.00 0.00 177.43 177.01 1nb4 h SER 29 N 0.00 0.00 0.07 1.15 4.64 -1.20 -3.26 113.55 114.94 1nb4 h SER 29 Ca -0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1nb4 h SER 29 Cb 0.08 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.13 1nb4 h SER 29 CO 0.00 0.00 -2.16 -0.11 -0.87 0.00 0.00 176.83 173.69 1nb4 n LEU 30 N -2.66 2.69 -3.65 5.97 7.94 -0.39 -4.75 117.00 122.16 1nb4 n LEU 30 Ca 0.03 0.10 -0.12 0.00 -1.11 0.00 0.00 56.01 54.90 1nb4 n LEU 30 Cb 0.36 -1.02 -0.12 0.00 0.53 0.00 0.00 43.42 43.17 1nb4 n LEU 30 CO 0.27 0.84 -0.10 -0.22 -1.11 0.00 0.00 177.39 177.08 1nb4 s LEU 31 N -6.92 -0.38 -0.06 -1.96 0.20 0.01 -4.21 118.68 105.35 1nb4 s LEU 31 Ca -0.28 0.67 0.15 0.00 0.69 0.00 0.00 54.13 55.36 1nb4 s LEU 31 Cb 0.08 0.85 -0.22 0.00 -0.43 0.00 0.00 46.19 46.47 1nb4 s LEU 31 CO 0.68 -0.24 0.53 0.54 -0.29 0.00 0.00 176.35 177.57 1nb4 n ARG 32 N 5.36 0.65 -1.58 1.98 3.00 -0.74 -4.11 116.66 121.22 1nb4 n ARG 32 Ca -0.07 0.18 -0.40 0.00 -0.01 0.00 0.00 57.85 57.55 1nb4 n ARG 32 Cb 0.50 -1.71 -0.02 0.00 0.00 0.00 0.00 32.46 31.23 1nb4 n ARG 32 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1nb4 n HIS 33 N -2.91 2.79 0.23 -1.55 8.25 -0.96 -4.78 115.22 116.29 1nb4 n HIS 33 Ca -0.19 -3.01 0.16 0.00 -0.26 0.00 0.00 57.72 54.42 1nb4 n HIS 33 Cb 1.02 -2.39 0.84 0.00 1.12 0.00 0.00 29.99 30.58 1nb4 n HIS 33 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 1nb4 h HIS 34 N 5.28 0.00 0.00 4.41 2.07 -1.86 -1.14 115.15 123.91 1nb4 h HIS 34 Ca 0.74 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.26 1nb4 h HIS 34 Cb 0.41 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.39 1nb4 h HIS 34 CO 1.69 0.00 0.00 0.09 -3.07 0.00 0.00 177.93 176.64 1nb4 n ASN 35 N -3.89 0.00 0.06 3.10 5.03 -1.26 -1.87 115.26 116.43 1nb4 n ASN 35 Ca -0.00 0.11 0.12 0.00 0.87 0.00 0.00 54.58 55.68 1nb4 n ASN 35 Cb 0.23 -0.34 0.17 0.00 -1.02 0.00 0.00 39.78 38.83 1nb4 n ASN 35 CO 0.00 0.00 0.00 0.23 -1.83 0.00 0.00 177.26 175.66 1nb4 n MET 36 N -1.34 0.28 -3.55 3.52 2.81 -0.43 -4.86 117.12 113.56 1nb4 n MET 36 Ca 0.09 0.08 -0.36 0.00 -1.81 0.00 0.00 57.70 55.70 1nb4 n MET 36 Cb 0.19 -1.68 -0.07 0.00 -0.71 0.00 0.00 33.22 30.95 1nb4 n MET 36 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1nb4 s VAL 37 N -3.16 5.31 0.05 2.03 1.01 -0.78 -1.37 120.40 123.49 1nb4 s VAL 37 Ca 0.06 0.52 -0.03 0.00 0.00 0.00 0.00 61.98 62.53 1nb4 s VAL 37 Cb 0.13 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.87 1nb4 s VAL 37 CO 0.72 0.39 0.04 -0.72 0.00 0.00 0.00 175.10 175.53 1nb4 s TYR 38 N 0.48 0.34 -0.00 5.22 -0.85 -0.60 -3.76 117.35 118.18 1nb4 s TYR 38 Ca 0.16 -0.77 0.05 0.00 -0.52 0.00 0.00 57.07 55.99 1nb4 s TYR 38 Cb -0.13 -0.25 -0.03 0.00 0.38 0.00 0.00 41.96 41.94 1nb4 s TYR 38 CO 0.03 -0.38 -0.15 0.00 -1.52 0.00 0.00 175.55 173.54 1nb4 s ALA 39 N -3.25 2.69 0.62 9.51 0.00 -0.94 -0.59 121.76 129.81 1nb4 s ALA 39 Ca 0.01 -1.08 -0.14 0.00 0.00 0.00 0.00 51.96 50.75 1nb4 s ALA 39 Cb 0.03 -0.90 -0.02 0.00 0.00 0.00 0.00 23.12 22.23 1nb4 s ALA 39 CO -0.08 0.57 1.06 0.95 0.00 0.00 0.00 175.76 178.26 1nb4 s THR 40 N -0.86 3.88 0.25 0.00 -4.23 -0.44 -4.57 115.64 109.67 1nb4 s THR 40 Ca 0.14 0.80 -0.05 0.00 -1.18 0.00 0.00 61.69 61.41 1nb4 s THR 40 Cb -0.11 -3.39 -0.02 0.00 1.34 0.00 0.00 72.50 70.33 1nb4 s THR 40 CO 0.04 -0.61 0.33 0.42 -0.54 0.00 0.00 174.62 174.25 1nb4 s THR 41 N -2.63 0.00 0.47 3.99 -4.23 -1.26 -4.29 115.64 107.69 1nb4 s THR 41 Ca 0.62 -1.72 0.24 0.00 -1.18 0.00 0.00 61.69 59.65 1nb4 s THR 41 Cb -0.15 -2.42 0.43 0.00 1.34 0.00 0.00 72.50 71.69 1nb4 s THR 41 CO 0.42 0.00 1.86 0.28 -0.54 0.00 0.00 174.62 176.64 1nb4 h SER 42 N 2.36 0.23 -0.66 3.99 0.02 -1.89 -2.38 113.55 115.22 1nb4 h SER 42 Ca -0.30 0.03 0.19 0.00 -0.84 0.00 0.00 61.79 60.87 1nb4 h SER 42 Cb 1.25 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.75 1nb4 h SER 42 CO 0.43 0.08 0.61 0.03 -1.14 0.00 0.00 176.83 176.84 1nb4 h ARG 43 N 0.22 0.00 -0.18 3.45 3.08 -1.95 -0.68 114.38 118.32 1nb4 h ARG 43 Ca 0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.51 1nb4 h ARG 43 Cb 1.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.51 1nb4 h ARG 43 CO -0.11 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.66 1nb4 n SER 44 N -3.83 2.69 -0.22 7.04 3.41 -0.89 -4.66 113.62 117.16 1nb4 n SER 44 Ca 0.13 -1.79 0.01 0.00 -0.26 0.00 0.00 58.87 56.96 1nb4 n SER 44 Cb 0.85 -0.11 0.09 0.00 -0.26 0.00 0.00 64.21 64.79 1nb4 n SER 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nb4 h ALA 45 N 3.17 0.54 -0.32 7.33 0.00 -1.25 -0.20 119.26 128.55 1nb4 h ALA 45 Ca 0.00 0.23 0.05 0.00 0.00 0.00 0.00 54.91 55.18 1nb4 h ALA 45 Cb 0.74 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1nb4 h ALA 45 CO 0.00 -0.42 0.22 0.66 0.00 0.00 0.00 179.25 179.71 1nb4 h SER 46 N 0.05 0.19 -0.58 0.00 4.64 -1.83 0.32 113.55 116.35 1nb4 h SER 46 Ca 0.33 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.56 1nb4 h SER 46 Cb 0.53 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 1nb4 h SER 46 CO -0.61 0.13 0.02 -0.07 -0.87 0.00 0.00 176.83 175.43 1nb4 h LEU 47 N 0.22 0.99 -0.50 5.97 4.07 -1.38 -1.96 115.31 122.73 1nb4 h LEU 47 Ca 0.14 -0.30 -0.16 0.00 0.08 0.00 0.00 57.88 57.64 1nb4 h LEU 47 Cb 0.27 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.74 1nb4 h LEU 47 CO -0.03 1.04 -0.51 -0.09 -1.08 0.00 0.00 178.44 177.78 1nb4 h ARG 48 N 0.91 0.64 -0.75 1.13 9.65 -0.48 -2.87 114.38 122.62 1nb4 h ARG 48 Ca 0.17 -0.39 0.10 0.00 -1.10 0.00 0.00 59.98 58.76 1nb4 h ARG 48 Cb 0.52 0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 29.09 1nb4 h ARG 48 CO 0.03 1.00 0.49 1.96 2.80 0.00 0.00 179.97 186.24 1nb4 h GLN 49 N 0.50 0.62 0.33 0.20 4.20 -0.15 -1.46 115.11 119.35 1nb4 h GLN 49 Ca 0.02 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 1nb4 h GLN 49 Cb 1.06 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.71 1nb4 h GLN 49 CO 0.10 0.41 -0.16 0.87 -0.67 0.00 0.00 178.83 179.38 1nb4 h LYS 50 N 0.64 -0.43 -0.69 1.46 1.79 -1.14 -2.74 116.57 115.46 1nb4 h LYS 50 Ca 0.34 0.03 0.04 0.00 -2.18 0.00 0.00 60.65 58.89 1nb4 h LYS 50 Cb 0.49 0.10 -0.04 0.00 -1.58 0.00 0.00 32.23 31.20 1nb4 h LYS 50 CO -0.12 -0.19 0.46 0.87 -1.08 0.00 0.00 179.45 179.38 1nb4 h LYS 51 N -0.60 0.77 -0.00 3.15 1.57 -1.29 -2.34 116.57 117.83 1nb4 h LYS 51 Ca -0.05 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1nb4 h LYS 51 Cb 0.44 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1nb4 h LYS 51 CO 0.07 0.51 -0.11 1.55 -0.57 0.00 0.00 179.45 180.91 1nb4 n VAL 52 N -4.47 0.00 -3.56 0.50 3.14 -0.61 -4.76 118.33 108.57 1nb4 n VAL 52 Ca 0.09 -0.01 -0.40 0.00 -2.96 0.00 0.00 64.34 61.05 1nb4 n VAL 52 Cb 0.16 -0.29 -0.11 0.00 -1.06 0.00 0.00 33.84 32.54 1nb4 n VAL 52 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1nb4 s THR 53 N -2.80 4.98 0.12 1.55 2.01 -0.88 -4.69 115.64 115.92 1nb4 s THR 53 Ca 0.20 -0.46 -0.25 0.00 0.31 0.00 0.00 61.69 61.49 1nb4 s THR 53 Cb 0.19 -3.63 0.07 0.00 0.01 0.00 0.00 72.50 69.14 1nb4 s THR 53 CO 0.53 -0.08 0.74 0.72 -0.69 0.00 0.00 174.62 175.84 1nb4 s PHE 54 N 1.66 -0.40 0.21 4.92 -0.12 -1.26 -4.97 117.98 118.01 1nb4 s PHE 54 Ca 0.05 0.17 -0.24 0.00 -0.05 0.00 0.00 56.93 56.86 1nb4 s PHE 54 Cb -0.18 0.58 -0.08 0.00 -0.63 0.00 0.00 43.02 42.71 1nb4 s PHE 54 CO 0.09 -0.80 0.80 0.34 -0.05 0.00 0.00 175.22 175.60 1nb4 s ASP 55 N -2.71 7.32 0.06 1.98 2.15 -1.26 -1.01 116.67 123.20 1nb4 s ASP 55 Ca 0.04 1.64 0.02 0.00 0.43 0.00 0.00 52.55 54.69 1nb4 s ASP 55 Cb -0.02 -2.50 -0.04 0.00 -0.30 0.00 0.00 42.92 40.06 1nb4 s ASP 55 CO -0.08 0.12 0.09 -0.13 -0.17 0.00 0.00 175.17 175.00 1nb4 s ARG 56 N -1.49 2.95 -0.13 4.34 3.00 -0.80 -4.96 118.95 121.85 1nb4 s ARG 56 Ca 0.40 -0.64 -0.02 0.00 0.00 0.00 0.00 55.73 55.47 1nb4 s ARG 56 Cb -0.21 -2.77 -0.03 0.00 0.00 0.00 0.00 34.95 31.94 1nb4 s ARG 56 CO 0.25 0.58 -0.06 -0.51 0.00 0.00 0.00 175.30 175.56 1nb4 s LEU 57 N -2.29 3.12 -0.15 2.53 2.01 -1.26 -4.30 118.68 118.34 1nb4 s LEU 57 Ca 0.29 -0.15 -0.06 0.00 0.01 0.00 0.00 54.13 54.22 1nb4 s LEU 57 Cb -0.12 -1.72 0.07 0.00 0.01 0.00 0.00 46.19 44.42 1nb4 s LEU 57 CO 0.21 0.21 0.32 -1.58 1.01 0.00 0.00 176.35 176.52 1nb4 s GLN 58 N 0.09 0.22 -0.12 1.70 0.74 -1.26 -3.18 119.66 117.86 1nb4 s GLN 58 Ca -0.02 0.83 -0.01 0.00 0.05 0.00 0.00 55.36 56.21 1nb4 s GLN 58 Cb -0.14 0.08 0.03 0.00 1.10 0.00 0.00 33.01 34.08 1nb4 s GLN 58 CO 0.03 -0.26 -0.04 0.08 -0.55 0.00 0.00 175.29 174.56 1nb4 s VAL 59 N 2.34 0.78 -0.05 1.34 1.01 -0.17 -5.03 120.40 120.63 1nb4 s VAL 59 Ca -0.01 -0.25 -0.06 0.00 0.00 0.00 0.00 61.98 61.66 1nb4 s VAL 59 Cb -0.12 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 1nb4 s VAL 59 CO -0.10 0.23 0.20 -0.76 0.00 0.00 0.00 175.10 174.67 1nb4 s LEU 60 N 1.79 4.38 0.00 3.92 1.43 -1.26 -4.34 118.68 124.61 1nb4 s LEU 60 Ca 0.04 0.48 0.01 0.00 -1.03 0.00 0.00 54.13 53.63 1nb4 s LEU 60 Cb -0.13 -2.41 -0.00 0.00 0.03 0.00 0.00 46.19 43.67 1nb4 s LEU 60 CO -0.07 0.32 0.03 -0.90 0.23 0.00 0.00 176.35 175.97 1nb4 n ASP 61 N 1.45 1.39 -0.17 2.29 5.75 -1.26 -5.03 116.55 120.97 1nb4 n ASP 61 Ca -0.15 -1.69 0.01 0.00 -0.01 0.00 0.00 54.79 52.95 1nb4 n ASP 61 Cb 0.54 0.27 0.27 0.00 -1.03 0.00 0.00 41.12 41.17 1nb4 n ASP 61 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 1nb4 h ASP 62 N 0.48 0.78 -0.48 -1.12 3.32 -1.99 -1.94 116.42 115.48 1nb4 h ASP 62 Ca -0.11 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 1nb4 h ASP 62 Cb 0.39 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1nb4 h ASP 62 CO 0.17 0.59 0.21 0.45 -1.72 0.00 0.00 179.24 178.95 1nb4 h HIS 63 N 0.91 0.70 -0.25 4.55 3.86 -1.96 0.12 115.15 123.08 1nb4 h HIS 63 Ca 0.24 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.41 1nb4 h HIS 63 Cb -0.06 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.18 1nb4 h HIS 63 CO 0.00 0.58 0.16 -0.92 0.86 0.00 0.00 177.93 178.60 1nb4 h TYR 64 N 0.62 0.32 -0.71 2.45 3.20 -1.76 -1.99 116.97 119.10 1nb4 h TYR 64 Ca 0.16 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.98 1nb4 h TYR 64 Cb 0.15 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 1nb4 h TYR 64 CO -0.00 0.22 0.24 0.00 -1.64 0.00 0.00 178.16 176.98 1nb4 h ARG 65 N 0.32 1.08 0.02 1.82 3.08 -1.05 -1.57 114.38 118.08 1nb4 h ARG 65 Ca 0.09 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 1nb4 h ARG 65 Cb -0.01 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.87 1nb4 h ARG 65 CO -0.02 0.90 -0.01 -0.44 -1.07 0.00 0.00 179.97 179.33 1nb4 h ASP 66 N 1.04 -0.03 -0.80 7.04 3.32 -0.50 -2.01 116.42 124.48 1nb4 h ASP 66 Ca 0.23 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 1nb4 h ASP 66 Cb 0.26 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.78 1nb4 h ASP 66 CO -0.01 -0.01 0.42 0.58 -1.72 0.00 0.00 179.24 178.50 1nb4 h VAL 67 N -0.05 1.24 -0.51 -1.35 2.07 -1.18 -2.33 116.25 114.15 1nb4 h VAL 67 Ca -0.00 -0.64 0.05 0.00 0.82 0.00 0.00 66.70 66.92 1nb4 h VAL 67 Cb 0.04 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 29.96 1nb4 h VAL 67 CO 0.01 0.28 0.24 0.25 0.02 0.00 0.00 177.57 178.37 1nb4 h LEU 68 N 1.12 0.32 -0.84 2.57 6.46 -1.05 -0.30 115.31 123.59 1nb4 h LEU 68 Ca 0.28 0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 58.03 1nb4 h LEU 68 Cb 0.07 -0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 39.95 1nb4 h LEU 68 CO -0.04 0.22 0.32 0.11 -0.62 0.00 0.00 178.44 178.43 1nb4 h LYS 69 N 0.46 1.17 -0.65 1.25 1.57 -1.01 -0.17 116.57 119.19 1nb4 h LYS 69 Ca 0.23 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1nb4 h LYS 69 Cb 0.17 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 1nb4 h LYS 69 CO -0.18 0.94 0.39 0.93 -0.57 0.00 0.00 179.45 180.96 1nb4 h GLU 70 N 1.14 0.89 -0.29 3.15 5.08 -0.89 -0.43 114.58 123.23 1nb4 h GLU 70 Ca 0.26 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 1nb4 h GLU 70 Cb 0.21 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1nb4 h GLU 70 CO -0.02 0.64 0.07 0.52 -1.00 0.00 0.00 179.01 179.22 1nb4 h MET 71 N 0.89 0.46 -1.00 2.33 2.86 -0.67 -2.95 114.93 116.84 1nb4 h MET 71 Ca 0.23 -0.11 0.01 0.00 -2.06 0.00 0.00 59.70 57.78 1nb4 h MET 71 Cb -0.02 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.53 1nb4 h MET 71 CO -0.04 0.54 0.66 0.87 1.06 0.00 0.00 176.91 180.00 1nb4 h LYS 72 N 0.30 1.31 -0.56 1.72 1.57 -0.72 -1.28 116.57 118.91 1nb4 h LYS 72 Ca 0.09 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1nb4 h LYS 72 Cb 0.29 -0.30 -0.03 0.00 0.08 0.00 0.00 32.23 32.27 1nb4 h LYS 72 CO 0.00 0.87 0.32 0.00 -0.57 0.00 0.00 179.45 180.07 1nb4 h ALA 73 N 1.38 1.51 -0.25 3.86 0.00 -0.97 -1.81 119.26 122.98 1nb4 h ALA 73 Ca 0.37 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 55.10 1nb4 h ALA 73 Cb -0.15 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 1nb4 h ALA 73 CO -0.08 0.41 -0.26 0.87 0.00 0.00 0.00 179.25 180.19 1nb4 h LYS 74 N 0.77 0.62 -0.07 0.00 1.79 -1.19 -3.17 116.57 115.31 1nb4 h LYS 74 Ca 0.20 -0.33 -0.01 0.00 -2.18 0.00 0.00 60.65 58.33 1nb4 h LYS 74 Cb -0.00 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1nb4 h LYS 74 CO -0.04 0.93 -0.02 0.00 -1.08 0.00 0.00 179.45 179.25 1nb4 h ALA 75 N 0.67 1.85 0.00 3.86 0.00 -0.82 -2.47 119.26 122.36 1nb4 h ALA 75 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1nb4 h ALA 75 Cb 0.82 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1nb4 h ALA 75 CO 0.06 0.12 0.00 -1.13 0.00 0.00 0.00 179.25 178.30 1nb4 n SER 76 N -4.46 0.00 0.04 0.00 3.41 -0.72 -1.17 113.62 110.72 1nb4 n SER 76 Ca -0.02 0.20 0.12 0.00 -0.26 0.00 0.00 58.87 58.91 1nb4 n SER 76 Cb 0.14 -0.30 0.25 0.00 -0.26 0.00 0.00 64.21 64.04 1nb4 n SER 76 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1nb4 n THR 77 N -1.30 0.25 -3.28 6.66 -1.04 -0.93 -4.83 114.28 109.82 1nb4 n THR 77 Ca 0.03 -0.18 -0.38 0.00 -2.04 0.00 0.00 64.05 61.49 1nb4 n THR 77 Cb 0.06 -0.10 -0.06 0.00 -1.82 0.00 0.00 70.33 68.41 1nb4 n THR 77 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1nb4 s VAL 78 N -3.10 4.75 -0.11 12.58 1.01 -0.32 -5.01 120.40 130.19 1nb4 s VAL 78 Ca 0.09 1.15 0.02 0.00 0.00 0.00 0.00 61.98 63.24 1nb4 s VAL 78 Cb 0.15 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.67 1nb4 s VAL 78 CO 0.69 0.48 -0.16 -0.75 0.00 0.00 0.00 175.10 175.35 1nb4 s LYS 79 N -1.31 2.34 0.14 2.72 2.20 -1.26 -0.72 119.74 123.84 1nb4 s LYS 79 Ca 0.31 -0.60 0.10 0.00 -0.36 0.00 0.00 55.97 55.42 1nb4 s LYS 79 Cb -0.19 -1.98 -0.04 0.00 -1.51 0.00 0.00 37.83 34.12 1nb4 s LYS 79 CO 0.19 -0.06 -0.23 0.00 -0.36 0.00 0.00 175.35 174.89 1nb4 s ALA 80 N 0.98 2.53 0.20 3.13 0.00 -0.83 -4.92 121.76 122.85 1nb4 s ALA 80 Ca -0.06 -1.46 0.07 0.00 0.00 0.00 0.00 51.96 50.50 1nb4 s ALA 80 Cb -0.15 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 1nb4 s ALA 80 CO -0.02 0.53 0.10 -1.59 0.00 0.00 0.00 175.76 174.78 1nb4 s LYS 81 N -2.23 2.69 0.27 0.00 -2.85 -1.26 -4.55 119.74 111.82 1nb4 s LYS 81 Ca 0.17 -1.05 -0.11 0.00 -1.00 0.00 0.00 55.97 53.97 1nb4 s LYS 81 Cb -0.10 -2.48 -0.08 0.00 -2.06 0.00 0.00 37.83 33.11 1nb4 s LYS 81 CO 0.08 0.44 0.62 -0.48 0.10 0.00 0.00 175.35 176.12 1nb4 s LEU 82 N -3.32 4.11 0.36 2.77 0.05 -1.26 -4.53 118.68 116.85 1nb4 s LEU 82 Ca 0.31 1.05 -0.13 0.00 0.05 0.00 0.00 54.13 55.40 1nb4 s LEU 82 Cb -0.09 -3.83 -0.08 0.00 -2.05 0.00 0.00 46.19 40.14 1nb4 s LEU 82 CO 0.22 -0.14 0.75 -0.76 -0.55 0.00 0.00 176.35 175.87 1nb4 s LEU 83 N -2.96 3.96 0.67 1.48 1.02 -0.48 -5.04 118.68 117.33 1nb4 s LEU 83 Ca 0.50 1.20 -0.12 0.00 0.02 0.00 0.00 54.13 55.73 1nb4 s LEU 83 Cb -0.11 -4.04 0.00 0.00 0.02 0.00 0.00 46.19 42.06 1nb4 s LEU 83 CO 0.21 -0.29 1.06 -0.94 0.02 0.00 0.00 176.35 176.41 1nb4 s SER 84 N -2.68 5.39 0.33 2.29 1.04 -1.26 -4.73 113.70 114.07 1nb4 s SER 84 Ca 0.53 1.70 0.05 0.00 0.48 0.00 0.00 55.95 58.70 1nb4 s SER 84 Cb -0.10 -2.51 0.67 0.00 0.10 0.00 0.00 66.02 64.18 1nb4 s SER 84 CO 0.24 -1.43 1.88 0.40 0.98 0.00 0.00 173.24 175.31 1nb4 h ILE 85 N -0.43 0.94 0.09 -1.02 2.04 -1.99 -2.27 117.51 114.87 1nb4 h ILE 85 Ca -0.45 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.11 1nb4 h ILE 85 Cb 1.22 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1nb4 h ILE 85 CO 0.56 0.16 -0.04 -0.08 0.00 0.00 0.00 178.15 178.75 1nb4 h GLU 86 N 0.86 -0.11 -0.66 2.37 4.81 -1.99 -0.61 114.58 119.24 1nb4 h GLU 86 Ca 0.43 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.76 1nb4 h GLU 86 Cb 0.47 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.80 1nb4 h GLU 86 CO -0.19 0.09 0.29 0.93 -0.73 0.00 0.00 179.01 179.40 1nb4 h GLU 87 N -0.30 0.49 -0.53 1.92 5.08 -1.84 -1.09 114.58 118.31 1nb4 h GLU 87 Ca -0.01 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 1nb4 h GLU 87 Cb 0.25 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1nb4 h GLU 87 CO 0.02 0.32 0.02 0.00 -1.00 0.00 0.00 179.01 178.38 1nb4 h ALA 88 N 1.43 0.71 -0.68 3.43 0.00 -1.33 -2.81 119.26 120.01 1nb4 h ALA 88 Ca 0.33 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1nb4 h ALA 88 Cb 0.38 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1nb4 h ALA 88 CO -0.29 0.51 0.33 0.00 0.00 0.00 0.00 179.25 179.81 1nb4 h LYS 90 N 0.96 0.00 -0.01 0.00 1.57 -1.03 -1.89 116.57 116.18 1nb4 h LYS 90 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1nb4 h LYS 90 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1nb4 h LYS 90 CO -0.03 0.03 -0.06 1.28 -0.57 0.00 0.00 179.45 180.10 1nb4 n LEU 91 N -3.16 0.67 -4.67 2.94 4.77 -0.79 -4.84 117.00 111.92 1nb4 n LEU 91 Ca -0.01 -0.15 -0.42 0.00 -0.03 0.00 0.00 56.01 55.40 1nb4 n LEU 91 Cb 0.25 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 1nb4 n LEU 91 CO 0.26 0.12 0.81 -0.89 -1.33 0.00 0.00 177.39 176.36 1nb4 s THR 92 N -2.22 4.76 0.35 -5.08 2.01 -0.71 -0.92 115.64 113.83 1nb4 s THR 92 Ca 0.36 1.94 -0.29 0.00 0.31 0.00 0.00 61.69 64.02 1nb4 s THR 92 Cb 0.21 -4.27 -0.11 0.00 0.01 0.00 0.00 72.50 68.33 1nb4 s THR 92 CO 0.41 -0.08 1.50 -0.81 -0.69 0.00 0.00 174.62 174.95 1nb4 n PRO 93 N 5.69 2.62 -0.29 4.92 -0.04 -1.26 -4.83 135.00 141.81 1nb4 n PRO 93 Ca 0.09 0.92 0.21 0.00 -0.04 0.00 0.00 63.50 64.68 1nb4 n PRO 93 Cb 0.47 -2.66 0.50 0.00 -0.04 0.00 0.00 33.50 31.78 1nb4 n PRO 93 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1nb4 h PRO 94 N 3.49 0.41 -0.60 0.54 0.11 -1.95 -2.15 132.00 131.84 1nb4 h PRO 94 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1nb4 h PRO 94 Cb 1.24 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1nb4 h PRO 94 CO 0.69 0.27 0.00 0.72 -0.21 0.00 0.00 178.00 179.47 1nb4 n HIS 95 N -4.57 1.42 -1.51 0.65 8.25 -1.26 -4.35 115.22 113.84 1nb4 n HIS 95 Ca 0.23 -0.63 -0.40 0.00 -0.26 0.00 0.00 57.72 56.66 1nb4 n HIS 95 Cb 0.79 -0.25 0.02 0.00 1.12 0.00 0.00 29.99 31.68 1nb4 n HIS 95 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1nb4 n SER 96 N 0.96 -0.26 -4.71 0.41 7.64 -0.81 -4.85 113.62 112.00 1nb4 n SER 96 Ca 0.25 0.87 -0.43 0.00 1.01 0.00 0.00 58.87 60.56 1nb4 n SER 96 Cb 0.88 -1.22 -0.03 0.00 -1.01 0.00 0.00 64.21 62.83 1nb4 n SER 96 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nb4 n ALA 97 N -1.16 2.22 -1.20 -0.43 0.00 -1.26 -4.40 120.51 114.29 1nb4 n ALA 97 Ca 0.11 0.40 -0.32 0.00 0.00 0.00 0.00 53.44 53.63 1nb4 n ALA 97 Cb 0.43 -2.44 0.10 0.00 0.00 0.00 0.00 19.45 17.54 1nb4 n ALA 97 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1nb4 s LYS 98 N 0.34 2.07 0.55 0.00 -2.85 -1.26 -4.59 119.74 113.99 1nb4 s LYS 98 Ca 0.71 1.40 -0.19 0.00 -1.00 0.00 0.00 55.97 56.89 1nb4 s LYS 98 Cb -0.56 -1.86 -0.06 0.00 -2.06 0.00 0.00 37.83 33.30 1nb4 s LYS 98 CO 0.41 -1.82 1.09 0.45 0.10 0.00 0.00 175.35 175.58 1nb4 s SER 99 N -2.84 5.84 0.00 0.03 0.15 -0.52 -4.65 113.70 111.71 1nb4 s SER 99 Ca 0.66 2.04 0.27 0.00 0.70 0.00 0.00 55.95 59.62 1nb4 s SER 99 Cb -0.21 -2.57 1.38 0.00 -1.71 0.00 0.00 66.02 62.92 1nb4 s SER 99 CO 0.52 -1.13 1.93 0.29 1.20 0.00 0.00 173.24 176.05 1nb4 n LYS 100 N -1.42 0.40 -1.41 5.44 5.02 -1.26 -3.75 118.16 121.19 1nb4 n LYS 100 Ca 0.10 0.03 -0.32 0.00 -2.02 0.00 0.00 58.31 56.10 1nb4 n LYS 100 Cb 0.52 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 34.11 1nb4 n LYS 100 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1nb4 n PHE 101 N -1.28 3.11 0.00 2.13 3.01 -1.26 -5.00 117.46 118.17 1nb4 n PHE 101 Ca 0.13 -2.80 0.00 0.00 1.01 0.00 0.00 57.45 55.79 1nb4 n PHE 101 Cb 0.21 -1.24 0.00 0.00 -0.01 0.00 0.00 39.48 38.44 1nb4 n PHE 101 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1nb4 n GLY 102 N -0.91 1.03 2.49 1.37 0.00 -1.25 -5.05 105.19 102.87 1nb4 n GLY 102 Ca 0.59 -0.88 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 1nb4 n GLY 102 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1nb4 n TYR 103 N 0.00 -3.39 -4.21 1.61 0.18 -1.26 -4.54 117.16 105.56 1nb4 n TYR 103 Ca 0.00 0.14 -0.11 0.00 1.88 0.00 0.00 57.90 59.82 1nb4 n TYR 103 Cb 0.00 -1.18 -0.03 0.00 -0.38 0.00 0.00 39.34 37.75 1nb4 n TYR 103 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1nb4 n GLY 104 N 2.91 3.72 0.38 -7.48 0.00 -1.26 -1.44 105.19 102.01 1nb4 n GLY 104 Ca -0.02 -1.98 -0.01 0.00 0.00 0.00 0.00 46.02 44.01 1nb4 n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nb4 h ALA 105 N 1.30 1.31 -0.89 4.61 0.00 -1.85 -2.07 119.26 121.68 1nb4 h ALA 105 Ca -0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1nb4 h ALA 105 Cb 0.52 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1nb4 h ALA 105 CO 0.21 0.61 0.53 1.57 0.00 0.00 0.00 179.25 182.17 1nb4 h LYS 106 N 1.32 1.21 -0.40 0.00 2.10 -1.89 -0.68 116.57 118.22 1nb4 h LYS 106 Ca 0.38 -0.12 0.04 0.00 -2.00 0.00 0.00 60.65 58.96 1nb4 h LYS 106 Cb -0.08 -0.25 -0.04 0.00 -0.90 0.00 0.00 32.23 30.96 1nb4 h LYS 106 CO -0.10 0.86 0.16 -0.44 -2.00 0.00 0.00 179.45 177.92 1nb4 h ASP 107 N 1.23 0.19 -0.49 7.07 3.45 -1.82 -0.21 116.42 125.84 1nb4 h ASP 107 Ca 0.32 0.04 -0.01 0.00 0.43 0.00 0.00 57.03 57.81 1nb4 h ASP 107 Cb -0.04 0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 38.72 1nb4 h ASP 107 CO -0.06 0.15 0.27 0.58 -1.57 0.00 0.00 179.24 178.61 1nb4 h VAL 108 N 0.33 1.17 -0.38 -1.35 2.07 -0.87 -1.28 116.25 115.94 1nb4 h VAL 108 Ca 0.18 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1nb4 h VAL 108 Cb 0.14 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 1nb4 h VAL 108 CO -0.17 0.18 0.18 -0.09 0.02 0.00 0.00 177.57 177.70 1nb4 h ARG 109 N 0.66 0.53 -0.06 1.57 2.43 -0.64 -1.85 114.38 117.02 1nb4 h ARG 109 Ca 0.17 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1nb4 h ARG 109 Cb 0.05 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1nb4 h ARG 109 CO -0.03 0.42 0.00 0.09 -1.51 0.00 0.00 179.97 178.94 1nb4 n ASN 110 N -4.41 1.43 -3.64 -3.80 3.02 -0.14 -4.87 115.26 102.85 1nb4 n ASN 110 Ca 0.03 -1.53 -0.26 0.00 -0.03 0.00 0.00 54.58 52.78 1nb4 n ASN 110 Cb 0.12 -0.03 0.05 0.00 -0.61 0.00 0.00 39.78 39.31 1nb4 n ASN 110 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1nb4 n LEU 111 N 0.13 -2.94 -4.70 3.41 4.77 -0.57 -4.92 117.00 112.18 1nb4 n LEU 111 Ca 0.18 -0.59 -0.33 0.00 -0.03 0.00 0.00 56.01 55.24 1nb4 n LEU 111 Cb 0.33 -2.82 0.13 0.00 -2.33 0.00 0.00 43.42 38.73 1nb4 n LEU 111 CO 0.15 0.52 0.74 -0.94 -1.33 0.00 0.00 177.39 176.54 1nb4 s SER 112 N -3.22 3.51 0.15 -1.43 1.04 -0.68 -4.78 113.70 108.29 1nb4 s SER 112 Ca 0.58 2.29 -0.16 0.00 0.48 0.00 0.00 55.95 59.13 1nb4 s SER 112 Cb -0.27 -2.58 0.05 0.00 0.10 0.00 0.00 66.02 63.32 1nb4 s SER 112 CO 0.72 -2.72 1.76 -1.28 0.98 0.00 0.00 173.24 172.70 1nb4 h SER 113 N -1.13 0.18 0.36 7.02 0.87 -1.91 -2.13 113.55 116.81 1nb4 h SER 113 Ca -0.45 0.03 -0.16 0.00 -1.23 0.00 0.00 61.79 59.98 1nb4 h SER 113 Cb 1.28 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.24 1nb4 h SER 113 CO 0.45 0.14 -0.65 0.08 -0.53 0.00 0.00 176.83 176.32 1nb4 h ARG 114 N 0.30 0.27 -0.06 2.24 0.11 -1.97 -1.65 114.38 113.62 1nb4 h ARG 114 Ca 0.15 -0.20 -0.01 0.00 0.10 0.00 0.00 59.98 60.03 1nb4 h ARG 114 Cb 0.11 0.04 -0.00 0.00 1.11 0.00 0.00 29.97 31.22 1nb4 h ARG 114 CO -0.14 0.83 0.02 0.00 0.10 0.00 0.00 179.97 180.78 1nb4 h ALA 115 N 1.12 0.08 -0.16 0.08 0.00 -1.86 -1.23 119.26 117.28 1nb4 h ALA 115 Ca -0.01 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 1nb4 h ALA 115 Cb 1.18 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1nb4 h ALA 115 CO 0.10 -0.30 -0.41 -0.39 0.00 0.00 0.00 179.25 178.25 1nb4 h VAL 116 N -0.11 1.31 -0.51 0.00 -1.51 -1.36 -1.75 116.25 112.31 1nb4 h VAL 116 Ca 0.02 -1.56 -0.07 0.00 -1.23 0.00 0.00 66.70 63.86 1nb4 h VAL 116 Cb 0.23 1.64 -0.02 0.00 -2.13 0.00 0.00 31.29 31.02 1nb4 h VAL 116 CO 0.00 0.48 0.05 0.78 -1.23 0.00 0.00 177.57 177.65 1nb4 h ASN 117 N 0.31 0.85 -0.53 4.19 2.35 -1.25 -0.80 115.58 120.70 1nb4 h ASN 117 Ca 0.03 -0.28 -0.06 0.00 -0.55 0.00 0.00 56.30 55.44 1nb4 h ASN 117 Cb 0.87 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.99 1nb4 h ASN 117 CO 0.07 0.92 0.12 -0.74 -1.65 0.00 0.00 177.43 176.14 1nb4 h HIS 118 N 0.75 0.91 -0.93 1.19 2.76 -1.09 -2.46 115.15 116.28 1nb4 h HIS 118 Ca 0.15 -0.11 0.06 0.00 -2.20 0.00 0.00 60.37 58.26 1nb4 h HIS 118 Cb 0.45 -0.25 -0.06 0.00 1.55 0.00 0.00 27.41 29.10 1nb4 h HIS 118 CO 0.03 0.80 0.59 0.82 -1.30 0.00 0.00 177.93 178.87 1nb4 h ILE 119 N 0.75 1.09 -0.83 6.26 2.04 -1.13 -0.74 117.51 124.96 1nb4 h ILE 119 Ca 0.17 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 1nb4 h ILE 119 Cb 0.36 -0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.29 1nb4 h ILE 119 CO 0.00 0.20 0.46 0.03 0.00 0.00 0.00 178.15 178.85 1nb4 h ARG 120 N 1.10 1.16 0.00 2.37 3.08 -0.92 -1.86 114.38 119.31 1nb4 h ARG 120 Ca 0.39 -0.13 -0.14 0.00 0.07 0.00 0.00 59.98 60.17 1nb4 h ARG 120 Cb 0.13 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 1nb4 h ARG 120 CO -0.16 0.85 -0.67 0.66 -1.07 0.00 0.00 179.97 179.58 1nb4 h SER 121 N 1.16 0.00 -0.61 7.04 4.64 -0.85 -1.73 113.55 123.20 1nb4 h SER 121 Ca 0.29 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.53 1nb4 h SER 121 Cb 0.02 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.09 1nb4 h SER 121 CO -0.05 0.67 0.06 0.58 -0.87 0.00 0.00 176.83 177.22 1nb4 h VAL 122 N 0.00 1.26 -0.46 0.95 2.07 -0.87 -0.46 116.25 118.74 1nb4 h VAL 122 Ca -0.01 -1.06 -0.08 0.00 0.82 0.00 0.00 66.70 66.38 1nb4 h VAL 122 Cb 1.27 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 1nb4 h VAL 122 CO 0.09 0.39 -0.00 -0.25 0.02 0.00 0.00 177.57 177.81 1nb4 h TRP 123 N 0.93 0.89 -0.15 1.57 2.91 -1.12 -1.02 115.95 119.95 1nb4 h TRP 123 Ca 0.18 -0.16 -0.11 0.00 1.13 0.00 0.00 58.89 59.94 1nb4 h TRP 123 Cb 0.47 -0.23 -0.01 0.00 -0.51 0.00 0.00 29.16 28.88 1nb4 h TRP 123 CO 0.03 0.86 -0.37 0.93 -1.03 0.00 0.00 178.44 178.87 1nb4 h GLU 124 N 0.67 0.32 -0.08 2.65 4.39 -1.20 -1.96 114.58 119.37 1nb4 h GLU 124 Ca 0.13 -0.15 -0.10 0.00 0.34 0.00 0.00 59.36 59.58 1nb4 h GLU 124 Cb 0.51 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1nb4 h GLU 124 CO 0.02 0.65 -0.42 0.22 -1.16 0.00 0.00 179.01 178.33 1nb4 h ASP 125 N 0.28 0.18 -0.19 1.42 1.82 -0.60 -2.15 116.42 117.17 1nb4 h ASP 125 Ca 0.03 -0.08 -0.11 0.00 -0.39 0.00 0.00 57.03 56.49 1nb4 h ASP 125 Cb 0.79 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 40.73 1nb4 h ASP 125 CO 0.06 0.59 -0.24 -0.07 -1.61 0.00 0.00 179.24 177.97 1nb4 h LEU 126 N 0.15 0.66 -0.84 2.28 4.07 -0.49 -1.22 115.31 119.91 1nb4 h LEU 126 Ca 0.01 -0.24 -0.11 0.00 0.08 0.00 0.00 57.88 57.63 1nb4 h LEU 126 Cb 0.81 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.35 1nb4 h LEU 126 CO 0.06 0.89 -0.53 -0.07 -1.08 0.00 0.00 178.44 177.71 1nb4 h LEU 127 N 0.57 0.00 0.05 1.67 3.38 -1.00 -3.37 115.31 116.61 1nb4 h LEU 127 Ca 0.08 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.69 1nb4 h LEU 127 Cb 0.72 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 1nb4 h LEU 127 CO 0.06 0.53 -2.13 -0.62 0.09 0.00 0.00 178.44 176.37 1nb4 n GLU 128 N -3.73 0.70 -3.75 1.13 1.02 -0.84 -4.89 120.64 110.28 1nb4 n GLU 128 Ca -0.01 0.21 -0.37 0.00 -0.02 0.00 0.00 57.16 56.97 1nb4 n GLU 128 Cb 0.57 -1.65 -0.13 0.00 -0.02 0.00 0.00 31.44 30.21 1nb4 n GLU 128 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1nb4 s ASP 129 N -6.55 5.13 -0.04 1.62 3.68 -0.47 -4.98 116.67 115.06 1nb4 s ASP 129 Ca -0.21 -0.40 0.17 0.00 2.13 0.00 0.00 52.55 54.23 1nb4 s ASP 129 Cb 0.07 -1.91 0.52 0.00 -1.45 0.00 0.00 42.92 40.16 1nb4 s ASP 129 CO 0.74 -0.10 1.44 0.41 0.13 0.00 0.00 175.17 177.79 1nb4 n THR 130 N 4.91 1.26 0.00 1.71 -1.04 -1.26 -4.66 114.28 115.20 1nb4 n THR 130 Ca -0.16 -1.11 0.00 0.00 -2.04 0.00 0.00 64.05 60.75 1nb4 n THR 130 Cb 0.50 0.37 0.00 0.00 -1.82 0.00 0.00 70.33 69.38 1nb4 n THR 130 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1nb4 n GLU 131 N 0.94 0.55 -1.65 -2.82 1.02 -1.26 -4.69 120.64 112.73 1nb4 n GLU 131 Ca 0.20 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.91 1nb4 n GLU 131 Cb 0.62 -0.68 -0.03 0.00 -0.02 0.00 0.00 31.44 31.33 1nb4 n GLU 131 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1nb4 n THR 132 N -1.56 0.69 -1.73 2.62 -1.04 -1.26 -4.74 114.28 107.27 1nb4 n THR 132 Ca 0.00 -0.20 -0.42 0.00 -2.04 0.00 0.00 64.05 61.39 1nb4 n THR 132 Cb 0.18 -2.36 -0.01 0.00 -1.82 0.00 0.00 70.33 66.33 1nb4 n THR 132 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1nb4 n PRO 133 N 7.75 2.33 -3.23 -2.82 -0.02 -1.26 -4.76 135.00 133.00 1nb4 n PRO 133 Ca 0.22 0.82 -0.39 0.00 -2.02 0.00 0.00 63.50 62.13 1nb4 n PRO 133 Cb 0.41 -2.46 -0.06 0.00 -0.02 0.00 0.00 33.50 31.37 1nb4 n PRO 133 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1nb4 s ILE 134 N -1.02 5.13 0.63 4.25 1.01 -0.52 -4.96 121.20 125.73 1nb4 s ILE 134 Ca 0.55 1.09 -0.18 0.00 0.00 0.00 0.00 60.65 62.11 1nb4 s ILE 134 Cb -0.54 -3.88 -0.02 0.00 0.01 0.00 0.00 42.46 38.03 1nb4 s ILE 134 CO 0.62 0.27 1.20 -0.67 0.00 0.00 0.00 174.94 176.36 1nb4 n ASP 135 N 3.95 1.71 -4.06 3.58 4.64 -1.26 -4.44 116.55 120.66 1nb4 n ASP 135 Ca -0.05 0.83 -0.08 0.00 -1.38 0.00 0.00 54.79 54.11 1nb4 n ASP 135 Cb 0.51 -1.51 -0.10 0.00 -1.04 0.00 0.00 41.12 38.98 1nb4 n ASP 135 CO 0.00 0.00 0.00 0.42 -0.82 0.00 0.00 177.20 176.80 1nb4 s THR 136 N -1.42 0.23 -0.08 5.18 -4.23 -1.07 -4.46 115.64 109.79 1nb4 s THR 136 Ca 0.80 -1.47 -0.03 0.00 -1.18 0.00 0.00 61.69 59.81 1nb4 s THR 136 Cb -0.39 -1.05 -0.04 0.00 1.34 0.00 0.00 72.50 72.36 1nb4 s THR 136 CO 0.43 -0.79 0.07 -0.89 -0.54 0.00 0.00 174.62 172.90 1nb4 s THR 137 N -2.93 4.83 -0.09 3.99 2.01 0.12 -0.95 115.64 122.61 1nb4 s THR 137 Ca -0.01 -0.13 0.01 0.00 0.31 0.00 0.00 61.69 61.87 1nb4 s THR 137 Cb 0.01 -3.10 -0.02 0.00 0.01 0.00 0.00 72.50 69.40 1nb4 s THR 137 CO -0.06 0.55 -0.12 -0.51 -0.69 0.00 0.00 174.62 173.79 1nb4 s ILE 138 N -1.01 3.18 0.04 1.82 2.07 -0.41 -1.74 121.20 125.15 1nb4 s ILE 138 Ca 0.16 -0.65 0.00 0.00 -1.41 0.00 0.00 60.65 58.76 1nb4 s ILE 138 Cb -0.12 -2.30 -0.03 0.00 0.13 0.00 0.00 42.46 40.14 1nb4 s ILE 138 CO 0.06 0.56 -0.04 -0.04 -1.91 0.00 0.00 174.94 173.56 1nb4 s MET 139 N -0.20 0.51 -0.12 3.50 -1.94 -0.73 -4.37 119.30 115.95 1nb4 s MET 139 Ca 0.01 -0.92 -0.21 0.00 -1.71 0.00 0.00 55.69 52.86 1nb4 s MET 139 Cb -0.13 0.02 -0.03 0.00 2.01 0.00 0.00 34.83 36.69 1nb4 s MET 139 CO 0.03 -0.04 0.62 0.00 -0.01 0.00 0.00 175.02 175.62 1nb4 s ALA 140 N -2.46 3.44 0.39 3.03 0.00 -1.26 -1.34 121.76 123.56 1nb4 s ALA 140 Ca -0.04 -0.08 -0.23 0.00 0.00 0.00 0.00 51.96 51.61 1nb4 s ALA 140 Cb -0.03 -2.88 -0.11 0.00 0.00 0.00 0.00 23.12 20.11 1nb4 s ALA 140 CO -0.04 -0.22 0.95 0.21 0.00 0.00 0.00 175.76 176.66 1nb4 s LYS 141 N 1.10 4.36 -0.41 0.00 2.20 0.24 -4.78 119.74 122.45 1nb4 s LYS 141 Ca 0.32 1.20 -0.09 0.00 -0.36 0.00 0.00 55.97 57.03 1nb4 s LYS 141 Cb -0.16 -2.41 0.07 0.00 -1.51 0.00 0.00 37.83 33.82 1nb4 s LYS 141 CO 0.13 0.08 0.24 0.45 -0.36 0.00 0.00 175.35 175.90 1nb4 s SER 142 N -1.97 5.61 0.06 1.43 0.15 -1.26 -4.31 113.70 113.41 1nb4 s SER 142 Ca 0.58 -1.45 0.06 0.00 0.70 0.00 0.00 55.95 55.83 1nb4 s SER 142 Cb -0.13 -1.98 -0.03 0.00 -1.71 0.00 0.00 66.02 62.18 1nb4 s SER 142 CO 0.17 -0.51 -0.16 -1.61 1.20 0.00 0.00 173.24 172.33 1nb4 s GLU 143 N 1.42 0.96 -0.08 5.44 2.02 -1.26 -4.87 118.70 122.34 1nb4 s GLU 143 Ca 0.03 -0.92 -0.05 0.00 0.02 0.00 0.00 54.97 54.05 1nb4 s GLU 143 Cb -0.22 -1.02 -0.04 0.00 0.10 0.00 0.00 34.13 32.94 1nb4 s GLU 143 CO 0.02 0.24 0.13 0.14 0.02 0.00 0.00 175.26 175.82 1nb4 s VAL 144 N -1.06 5.30 0.26 2.63 -7.23 -1.26 -1.33 120.40 117.71 1nb4 s VAL 144 Ca 0.02 0.02 0.03 0.00 -1.81 0.00 0.00 61.98 60.23 1nb4 s VAL 144 Cb -0.09 -3.35 -0.04 0.00 0.56 0.00 0.00 36.38 33.46 1nb4 s VAL 144 CO 0.02 0.52 0.20 -0.36 -0.31 0.00 0.00 175.10 175.17 1nb4 s PHE 145 N -1.10 1.44 -0.10 2.82 0.40 0.24 -4.75 117.98 116.92 1nb4 s PHE 145 Ca 0.19 -1.51 -0.06 0.00 -0.60 0.00 0.00 56.93 54.95 1nb4 s PHE 145 Cb -0.12 -0.63 -0.04 0.00 0.51 0.00 0.00 43.02 42.74 1nb4 s PHE 145 CO 0.08 -0.74 0.12 0.00 0.70 0.00 0.00 175.22 175.38 1nb4 n VAL 147 N 1.89 2.41 -2.35 0.00 0.24 -0.47 -4.97 118.33 115.09 1nb4 n VAL 147 Ca -0.19 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.34 61.28 1nb4 n VAL 147 Cb 0.54 -1.54 -0.02 0.00 -1.47 0.00 0.00 33.84 31.36 1nb4 n VAL 147 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nb4 s GLN 148 N -2.11 3.65 0.00 7.34 -2.07 -1.06 -4.96 119.66 120.45 1nb4 s GLN 148 Ca 0.60 1.24 0.00 0.00 -1.82 0.00 0.00 55.36 55.37 1nb4 s GLN 148 Cb -0.53 -2.08 0.00 0.00 -1.09 0.00 0.00 33.01 29.31 1nb4 s GLN 148 CO 0.59 -0.54 0.30 -2.30 -1.32 0.00 0.00 175.29 172.02 1nb4 n PRO 149 N -1.44 0.00 -1.56 9.60 -0.02 -1.26 -3.74 135.00 136.58 1nb4 n PRO 149 Ca 0.09 0.30 -0.46 0.00 -2.02 0.00 0.00 63.50 61.41 1nb4 n PRO 149 Cb 0.53 -0.54 -0.04 0.00 -0.02 0.00 0.00 33.50 33.43 1nb4 n PRO 149 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1nb4 n GLU 150 N -1.15 1.72 -0.30 -0.52 0.00 -1.26 -4.65 120.64 114.47 1nb4 n GLU 150 Ca 0.00 0.48 -0.13 0.00 0.00 0.00 0.00 57.16 57.51 1nb4 n GLU 150 Cb 0.00 -2.97 -0.02 0.00 0.00 0.00 0.00 31.44 28.44 1nb4 n GLU 150 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1nb4 n LYS 151 N 8.49 0.00 0.00 3.44 5.02 -1.25 -3.45 118.16 130.41 1nb4 n LYS 151 Ca 0.33 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.62 1nb4 n LYS 151 Cb 0.37 -0.31 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 1nb4 n LYS 151 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nb4 n GLY 152 N 1.25 1.06 3.84 0.72 0.00 -1.25 -4.94 105.19 105.87 1nb4 n GLY 152 Ca 0.09 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 1nb4 n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nb4 n GLY 153 N 0.00 -0.45 3.74 -0.02 0.00 -1.22 -2.58 105.19 104.65 1nb4 n GLY 153 Ca 0.00 0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1nb4 n GLY 153 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nb4 s ARG 154 N -6.50 2.65 -0.03 1.61 0.52 -1.26 -4.45 118.95 111.48 1nb4 s ARG 154 Ca 0.58 1.92 -0.20 0.00 -0.52 0.00 0.00 55.73 57.52 1nb4 s ARG 154 Cb -0.32 -1.88 -0.05 0.00 0.52 0.00 0.00 34.95 33.22 1nb4 s ARG 154 CO 0.71 -1.48 0.56 0.15 0.02 0.00 0.00 175.30 175.26 1nb4 s LYS 155 N -3.44 4.30 0.73 3.54 1.02 -1.26 -5.07 119.74 119.55 1nb4 s LYS 155 Ca 0.79 0.65 -0.11 0.00 0.02 0.00 0.00 55.97 57.32 1nb4 s LYS 155 Cb -0.33 -3.36 0.03 0.00 -0.52 0.00 0.00 37.83 33.64 1nb4 s LYS 155 CO 0.38 0.32 1.09 -1.25 -0.92 0.00 0.00 175.35 174.97 1nb4 s PRO 156 N -0.00 2.65 0.65 -1.68 0.04 -1.26 -4.88 135.00 130.51 1nb4 s PRO 156 Ca 0.30 0.57 -0.17 0.00 0.04 0.00 0.00 61.00 61.74 1nb4 s PRO 156 Cb -0.17 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 1nb4 s PRO 156 CO 0.15 -1.21 1.17 0.00 0.04 0.00 0.00 177.00 177.16 1nb4 s ALA 157 N -3.26 2.41 0.40 8.56 0.00 -1.26 -4.95 121.76 123.66 1nb4 s ALA 157 Ca 0.59 0.83 -0.08 0.00 0.00 0.00 0.00 51.96 53.30 1nb4 s ALA 157 Cb -0.12 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.53 1nb4 s ALA 157 CO 0.53 -1.37 0.73 1.03 0.00 0.00 0.00 175.76 176.68 1nb4 s ARG 158 N -3.70 3.69 -0.03 0.00 0.52 -1.26 -4.64 118.95 113.53 1nb4 s ARG 158 Ca 0.73 0.31 0.01 0.00 -0.52 0.00 0.00 55.73 56.26 1nb4 s ARG 158 Cb -0.27 -2.44 -0.03 0.00 0.52 0.00 0.00 34.95 32.73 1nb4 s ARG 158 CO 0.38 -0.03 -0.02 -0.51 0.02 0.00 0.00 175.30 175.14 1nb4 s LEU 159 N -4.00 3.41 -0.05 2.53 1.43 -1.26 0.79 118.68 121.53 1nb4 s LEU 159 Ca 0.49 -0.01 0.05 0.00 -1.03 0.00 0.00 54.13 53.63 1nb4 s LEU 159 Cb -0.10 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1nb4 s LEU 159 CO 0.34 0.31 -0.20 -0.51 0.23 0.00 0.00 176.35 176.52 1nb4 s ILE 160 N -0.99 1.67 -0.12 -0.59 1.10 -0.45 -4.86 121.20 116.96 1nb4 s ILE 160 Ca 0.17 -0.86 0.02 0.00 -0.51 0.00 0.00 60.65 59.47 1nb4 s ILE 160 Cb -0.11 -1.42 0.01 0.00 0.15 0.00 0.00 42.46 41.09 1nb4 s ILE 160 CO 0.07 0.47 -0.18 -0.69 -2.11 0.00 0.00 174.94 172.50 1nb4 s VAL 161 N -0.09 1.75 -0.07 4.00 1.01 -1.26 -1.78 120.40 123.97 1nb4 s VAL 161 Ca -0.03 -0.79 -0.14 0.00 0.00 0.00 0.00 61.98 61.02 1nb4 s VAL 161 Cb -0.12 -1.58 0.03 0.00 0.00 0.00 0.00 36.38 34.71 1nb4 s VAL 161 CO 0.02 0.49 0.35 0.72 0.00 0.00 0.00 175.10 176.68 1nb4 s PHE 162 N 0.93 -0.30 0.74 5.22 -0.12 -0.71 -0.57 117.98 123.18 1nb4 s PHE 162 Ca -0.06 0.62 -0.06 0.00 -0.05 0.00 0.00 56.93 57.38 1nb4 s PHE 162 Cb -0.15 0.13 0.10 0.00 -0.63 0.00 0.00 43.02 42.46 1nb4 s PHE 162 CO -0.02 -0.31 1.05 -1.25 -0.05 0.00 0.00 175.22 174.64 1nb4 s PRO 163 N -0.63 1.83 0.72 1.99 0.04 -1.26 0.12 135.00 137.81 1nb4 s PRO 163 Ca -0.07 -0.52 -0.16 0.00 0.04 0.00 0.00 61.00 60.29 1nb4 s PRO 163 Cb -0.04 -2.17 0.03 0.00 0.04 0.00 0.00 34.50 32.36 1nb4 s PRO 163 CO 0.03 -1.46 1.23 -3.47 0.04 0.00 0.00 177.00 173.37 1nb4 n ASP 164 N -3.01 1.53 -0.24 6.66 -0.08 -1.26 -4.76 116.55 115.39 1nb4 n ASP 164 Ca 0.11 0.72 0.04 0.00 -1.51 0.00 0.00 54.79 54.15 1nb4 n ASP 164 Cb 0.60 -1.53 0.14 0.00 2.34 0.00 0.00 41.12 42.68 1nb4 n ASP 164 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1nb4 h LEU 165 N -0.11 -0.27 -0.81 -2.67 5.85 -1.82 -1.76 115.31 113.72 1nb4 h LEU 165 Ca -0.49 0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.49 1nb4 h LEU 165 Cb 1.32 0.30 -0.07 0.00 0.37 0.00 0.00 40.66 42.58 1nb4 h LEU 165 CO 0.50 -0.14 0.47 1.23 -0.34 0.00 0.00 178.44 180.16 1nb4 h GLY 166 N 0.13 1.24 1.03 3.75 0.00 -1.95 -1.44 103.07 105.83 1nb4 h GLY 166 Ca 0.38 -0.32 -0.06 0.00 0.00 0.00 0.00 47.33 47.33 1nb4 h GLY 166 CO -0.59 0.16 0.20 -2.08 0.00 0.00 0.00 176.54 174.23 1nb4 h VAL 167 N 0.82 1.25 -0.29 4.60 2.07 -1.71 -2.11 116.25 120.88 1nb4 h VAL 167 Ca 0.38 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1nb4 h VAL 167 Cb 0.29 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1nb4 h VAL 167 CO -0.22 0.34 0.15 0.03 0.02 0.00 0.00 177.57 177.89 1nb4 h ARG 168 N 0.97 0.39 -0.12 1.57 3.08 -0.53 0.19 114.38 119.93 1nb4 h ARG 168 Ca 0.21 -0.03 -0.19 0.00 0.07 0.00 0.00 59.98 60.04 1nb4 h ARG 168 Cb 0.31 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 1nb4 h ARG 168 CO -0.00 0.30 -0.71 0.28 -1.07 0.00 0.00 179.97 178.77 1nb4 h VAL 169 N 0.40 1.34 -0.32 2.04 2.07 -1.07 -2.82 116.25 117.89 1nb4 h VAL 169 Ca 0.10 -2.02 -0.08 0.00 0.82 0.00 0.00 66.70 65.53 1nb4 h VAL 169 Cb 0.03 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 1nb4 h VAL 169 CO -0.02 0.62 -0.12 0.00 0.02 0.00 0.00 177.57 178.07 1nb4 h GLU 171 N 0.50 1.19 -0.04 0.00 5.08 -0.53 -2.47 114.58 118.32 1nb4 h GLU 171 Ca 0.09 -0.12 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1nb4 h GLU 171 Cb 0.52 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1nb4 h GLU 171 CO 0.03 0.85 -0.09 0.87 -1.00 0.00 0.00 179.01 179.67 1nb4 h LYS 172 N 1.20 -0.14 -0.46 2.33 1.57 -1.14 -0.17 116.57 119.76 1nb4 h LYS 172 Ca 0.31 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.17 1nb4 h LYS 172 Cb -0.02 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.26 1nb4 h LYS 172 CO -0.06 -0.09 0.11 0.52 -0.57 0.00 0.00 179.45 179.36 1nb4 h MET 173 N -0.14 0.24 -0.33 3.15 2.86 -1.15 0.96 114.93 120.52 1nb4 h MET 173 Ca 0.05 -0.01 -0.16 0.00 -2.06 0.00 0.00 59.70 57.51 1nb4 h MET 173 Cb 0.21 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 1nb4 h MET 173 CO -0.13 0.16 -0.44 0.00 1.06 0.00 0.00 176.91 177.57 1nb4 h ALA 174 N 1.35 0.59 0.00 6.32 0.00 -1.31 -1.28 119.26 124.92 1nb4 h ALA 174 Ca 0.23 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1nb4 h ALA 174 Cb 0.28 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1nb4 h ALA 174 CO -0.29 0.68 0.00 1.28 0.00 0.00 0.00 179.25 180.92 1nb4 n LEU 175 N -4.04 0.52 -0.21 0.00 4.77 -0.09 -4.75 117.00 113.21 1nb4 n LEU 175 Ca -0.03 -0.55 -0.05 0.00 -0.03 0.00 0.00 56.01 55.35 1nb4 n LEU 175 Cb 0.57 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.71 1nb4 n LEU 175 CO 0.49 0.13 1.12 0.22 -1.33 0.00 0.00 177.39 178.01 1nb4 h TYR 176 N 0.00 0.74 -0.40 -1.77 3.20 -0.90 0.48 116.97 118.32 1nb4 h TYR 176 Ca 0.00 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 1nb4 h TYR 176 Cb 0.19 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 1nb4 h TYR 176 CO 0.00 0.44 0.11 0.22 -1.64 0.00 0.00 178.16 177.30 1nb4 h ASP 177 N 0.79 0.60 0.68 -2.11 -0.00 -1.80 -1.84 116.42 112.73 1nb4 h ASP 177 Ca 0.23 -0.22 -0.03 0.00 -0.00 0.00 0.00 57.03 57.02 1nb4 h ASP 177 Cb -0.04 -0.16 -0.01 0.00 -0.00 0.00 0.00 39.33 39.13 1nb4 h ASP 177 CO -0.07 0.66 -0.44 0.58 -0.00 0.00 0.00 179.24 179.97 1nb4 h VAL 178 N 0.51 0.11 -0.17 2.25 2.07 -1.76 -2.29 116.25 116.97 1nb4 h VAL 178 Ca 0.13 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.70 1nb4 h VAL 178 Cb 0.29 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 1nb4 h VAL 178 CO -0.00 0.00 0.20 0.58 0.02 0.00 0.00 177.57 178.37 1nb4 h VAL 179 N -1.06 0.45 -0.01 2.57 2.07 -0.88 0.57 116.25 119.96 1nb4 h VAL 179 Ca -0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1nb4 h VAL 179 Cb 0.86 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1nb4 h VAL 179 CO 0.07 0.00 -0.25 -1.54 0.02 0.00 0.00 177.57 175.87 1nb4 n SER 180 N -3.77 1.73 0.00 0.57 3.41 -0.70 -4.59 113.62 110.27 1nb4 n SER 180 Ca 0.01 -1.36 0.00 0.00 -0.26 0.00 0.00 58.87 57.26 1nb4 n SER 180 Cb 0.32 0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1nb4 n SER 180 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1nb4 n THR 181 N -0.01 0.00 -0.15 6.66 -1.04 -0.74 -4.76 114.28 114.24 1nb4 n THR 181 Ca 0.13 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 62.03 1nb4 n THR 181 Cb 0.43 -0.56 -0.01 0.00 -1.82 0.00 0.00 70.33 68.37 1nb4 n THR 181 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1nb4 h LEU 182 N 0.00 0.81 -0.51 -4.42 6.46 -1.12 -3.05 115.31 113.48 1nb4 h LEU 182 Ca 0.00 -0.34 0.09 0.00 -0.12 0.00 0.00 57.88 57.52 1nb4 h LEU 182 Cb 0.76 -0.22 -0.08 0.00 -0.73 0.00 0.00 40.66 40.39 1nb4 h LEU 182 CO 0.00 0.96 0.05 -0.65 -0.62 0.00 0.00 178.44 178.18 1nb4 h PRO 183 N 0.66 0.17 0.00 5.25 0.11 -1.82 -0.37 132.00 136.00 1nb4 h PRO 183 Ca 0.12 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.14 1nb4 h PRO 183 Cb 0.57 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 1nb4 h PRO 183 CO 0.03 0.11 -0.36 0.37 -0.21 0.00 0.00 178.00 177.95 1nb4 h GLN 184 N 0.18 0.00 -0.12 1.05 4.15 -1.89 0.41 115.11 118.88 1nb4 h GLN 184 Ca 0.26 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 59.53 1nb4 h GLN 184 Cb 0.37 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 1nb4 h GLN 184 CO -0.38 0.36 -0.57 0.00 -1.93 0.00 0.00 178.83 176.31 1nb4 h ALA 185 N 1.64 0.79 0.14 3.38 0.00 -1.21 -1.03 119.26 122.97 1nb4 h ALA 185 Ca -0.00 -0.52 -0.23 0.00 0.00 0.00 0.00 54.91 54.16 1nb4 h ALA 185 Cb 0.77 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.49 1nb4 h ALA 185 CO 0.05 0.70 -1.08 0.28 0.00 0.00 0.00 179.25 179.20 1nb4 h VAL 186 N 0.29 1.31 -0.00 0.00 2.07 -0.66 -3.40 116.25 115.86 1nb4 h VAL 186 Ca 0.00 -2.49 0.00 0.00 0.82 0.00 0.00 66.70 65.03 1nb4 h VAL 186 Cb 1.08 3.00 0.00 0.00 -1.52 0.00 0.00 31.29 33.86 1nb4 h VAL 186 CO 0.10 0.71 -0.82 0.23 0.02 0.00 0.00 177.57 177.81 1nb4 n MET 187 N -4.03 0.55 0.00 1.57 2.81 0.09 -4.92 117.12 113.19 1nb4 n MET 187 Ca -0.18 -0.27 0.00 0.00 -1.81 0.00 0.00 57.70 55.44 1nb4 n MET 187 Cb 0.87 -1.46 0.00 0.00 -0.71 0.00 0.00 33.22 31.92 1nb4 n MET 187 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nb4 n GLY 188 N 1.45 2.93 0.09 3.03 0.00 -0.39 -2.13 105.19 110.17 1nb4 n GLY 188 Ca 0.05 -0.13 0.07 0.00 0.00 0.00 0.00 46.02 46.01 1nb4 n GLY 188 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1nb4 n SER 189 N 2.34 0.34 0.10 1.61 3.41 -1.26 -2.03 113.62 118.13 1nb4 n SER 189 Ca 0.00 0.64 0.13 0.00 -0.26 0.00 0.00 58.87 59.38 1nb4 n SER 189 Cb 0.00 -0.69 0.43 0.00 -0.26 0.00 0.00 64.21 63.68 1nb4 n SER 189 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1nb4 n SER 190 N -1.94 0.75 -4.57 4.04 7.64 -0.90 -4.76 113.62 113.87 1nb4 n SER 190 Ca -0.00 0.58 -0.42 0.00 1.01 0.00 0.00 58.87 60.05 1nb4 n SER 190 Cb 0.06 -0.78 -0.03 0.00 -1.01 0.00 0.00 64.21 62.45 1nb4 n SER 190 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1nb4 s TYR 191 N -3.12 2.27 0.46 1.43 5.04 -0.86 -0.85 117.35 121.71 1nb4 s TYR 191 Ca 0.10 0.46 0.19 0.00 -2.44 0.00 0.00 57.07 55.38 1nb4 s TYR 191 Cb 0.12 -4.39 1.19 0.00 0.35 0.00 0.00 41.96 39.23 1nb4 s TYR 191 CO 0.56 -1.98 2.04 0.78 -1.34 0.00 0.00 175.55 175.61 1nb4 h GLY 192 N 13.14 0.00 1.22 8.97 0.00 -1.31 -3.15 103.07 121.93 1nb4 h GLY 192 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1nb4 h GLY 192 CO 1.18 0.00 0.00 0.69 0.00 0.00 0.00 176.54 178.41 1nb4 n PHE 193 N -4.13 0.00 0.88 5.60 3.01 -1.26 -2.68 117.46 118.88 1nb4 n PHE 193 Ca -0.02 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.57 1nb4 n PHE 193 Cb 0.22 -0.11 0.44 0.00 -0.01 0.00 0.00 39.48 40.02 1nb4 n PHE 193 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1nb4 n GLN 194 N -1.11 0.08 -3.87 -1.08 10.64 -1.19 -3.21 117.38 117.64 1nb4 n GLN 194 Ca 0.16 0.05 -0.34 0.00 -1.83 0.00 0.00 57.00 55.04 1nb4 n GLN 194 Cb 0.13 -1.58 -0.05 0.00 -0.86 0.00 0.00 30.24 27.88 1nb4 n GLN 194 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1nb4 s TYR 195 N -3.04 3.57 0.72 2.61 1.51 -1.09 -4.65 117.35 116.98 1nb4 s TYR 195 Ca 0.12 0.43 -0.10 0.00 -1.01 0.00 0.00 57.07 56.51 1nb4 s TYR 195 Cb 0.17 -1.88 0.04 0.00 -0.11 0.00 0.00 41.96 40.18 1nb4 s TYR 195 CO 0.61 0.66 1.07 -1.54 -1.11 0.00 0.00 175.55 175.24 1nb4 s SER 196 N -1.72 5.03 0.26 2.29 1.04 -1.26 -4.78 113.70 114.56 1nb4 s SER 196 Ca 0.25 0.80 -0.02 0.00 0.48 0.00 0.00 55.95 57.46 1nb4 s SER 196 Cb -0.13 -1.50 0.47 0.00 0.10 0.00 0.00 66.02 64.96 1nb4 s SER 196 CO 0.15 -1.53 1.81 -0.65 0.98 0.00 0.00 173.24 174.00 1nb4 h PRO 197 N -0.69 0.79 -0.51 4.02 0.11 -1.89 -1.11 132.00 132.71 1nb4 h PRO 197 Ca -0.45 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 1nb4 h PRO 197 Cb 1.29 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1nb4 h PRO 197 CO 0.63 0.52 -0.05 -0.22 -0.21 0.00 0.00 178.00 178.68 1nb4 h LYS 198 N 0.81 0.90 -0.32 1.05 3.64 -1.93 -1.96 116.57 118.77 1nb4 h LYS 198 Ca 0.44 -0.29 -0.10 0.00 -1.27 0.00 0.00 60.65 59.44 1nb4 h LYS 198 Cb 0.46 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1nb4 h LYS 198 CO -0.28 0.93 -0.21 1.96 -2.27 0.00 0.00 179.45 179.59 1nb4 h GLN 199 N 0.83 0.60 -0.13 1.90 4.20 -1.60 -2.26 115.11 118.64 1nb4 h GLN 199 Ca 0.15 -0.22 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 1nb4 h GLN 199 Cb 0.56 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1nb4 h GLN 199 CO 0.03 0.76 0.06 -0.09 -0.67 0.00 0.00 178.83 178.93 1nb4 h ARG 200 N 0.53 0.19 -0.77 1.46 2.43 -0.94 -0.55 114.38 116.73 1nb4 h ARG 200 Ca 0.08 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.26 1nb4 h ARG 200 Cb 0.65 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.12 1nb4 h ARG 200 CO 0.05 0.25 0.49 0.28 -1.51 0.00 0.00 179.97 179.52 1nb4 h VAL 201 N 0.08 1.10 -0.43 0.20 2.07 -1.31 -1.11 116.25 116.86 1nb4 h VAL 201 Ca 0.04 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 1nb4 h VAL 201 Cb 0.12 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.95 1nb4 h VAL 201 CO -0.01 0.17 0.17 -0.08 0.02 0.00 0.00 177.57 177.85 1nb4 h GLU 202 N 0.94 0.64 -0.45 1.57 4.81 -0.95 -1.05 114.58 120.09 1nb4 h GLU 202 Ca 0.31 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1nb4 h GLU 202 Cb 0.03 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1nb4 h GLU 202 CO -0.12 0.59 0.26 0.35 -0.73 0.00 0.00 179.01 179.36 1nb4 h PHE 203 N 0.55 0.61 -0.27 0.92 3.04 -0.76 0.38 116.94 121.42 1nb4 h PHE 203 Ca 0.14 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.06 1nb4 h PHE 203 Cb 0.19 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 38.49 1nb4 h PHE 203 CO 0.00 0.45 0.08 -0.07 -2.02 0.00 0.00 178.31 176.75 1nb4 h LEU 204 N 0.60 0.39 -0.17 0.59 3.38 -1.00 0.17 115.31 119.27 1nb4 h LEU 204 Ca 0.16 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1nb4 h LEU 204 Cb 0.04 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1nb4 h LEU 204 CO -0.03 0.50 -0.04 0.58 0.09 0.00 0.00 178.44 179.54 1nb4 h VAL 205 N 0.27 1.29 -0.39 1.22 2.07 -1.13 0.87 116.25 120.44 1nb4 h VAL 205 Ca 0.09 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.60 1nb4 h VAL 205 Cb 0.25 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1nb4 h VAL 205 CO -0.00 0.30 0.26 0.78 0.02 0.00 0.00 177.57 178.93 1nb4 h ASN 206 N 0.04 0.45 -0.21 0.57 -0.26 -0.19 0.09 115.58 116.07 1nb4 h ASN 206 Ca 0.04 -0.01 0.03 0.00 -0.56 0.00 0.00 56.30 55.81 1nb4 h ASN 206 Cb 0.48 -0.11 -0.03 0.00 -1.06 0.00 0.00 38.32 37.60 1nb4 h ASN 206 CO 0.02 0.33 0.01 0.74 -1.06 0.00 0.00 177.43 177.46 1nb4 h THR 207 N 0.53 0.86 -0.48 2.81 2.02 -0.84 -1.18 112.91 116.63 1nb4 h THR 207 Ca 0.15 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.29 1nb4 h THR 207 Cb -0.06 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 1nb4 h THR 207 CO -0.03 0.01 0.28 -0.25 0.37 0.00 0.00 175.52 175.91 1nb4 h TRP 208 N 0.08 0.64 0.00 3.16 2.91 -0.37 -2.39 115.95 119.97 1nb4 h TRP 208 Ca 0.10 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.11 1nb4 h TRP 208 Cb 0.12 -0.21 0.00 0.00 -0.51 0.00 0.00 29.16 28.56 1nb4 h TRP 208 CO -0.17 0.45 0.00 0.87 -1.03 0.00 0.00 178.44 178.56 1nb4 h LYS 209 N 0.64 0.00 -0.00 2.65 1.57 -0.58 -2.95 116.57 117.89 1nb4 h LYS 209 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1nb4 h LYS 209 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1nb4 h LYS 209 CO -0.03 0.00 -0.02 -1.13 -0.57 0.00 0.00 179.45 177.69 1nb4 n SER 210 N -2.77 0.05 -4.87 0.86 3.41 -0.48 -4.86 113.62 104.96 1nb4 n SER 210 Ca 0.00 0.04 -0.33 0.00 -0.26 0.00 0.00 58.87 58.32 1nb4 n SER 210 Cb 0.23 -0.32 -0.05 0.00 -0.26 0.00 0.00 64.21 63.80 1nb4 n SER 210 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1nb4 s LYS 211 N -2.72 3.79 0.11 4.33 -0.14 -1.12 -5.00 119.74 118.99 1nb4 s LYS 211 Ca 0.23 0.22 -0.18 0.00 -1.36 0.00 0.00 55.97 54.89 1nb4 s LYS 211 Cb 0.20 -2.86 -0.05 0.00 -1.68 0.00 0.00 37.83 33.44 1nb4 s LYS 211 CO 0.49 0.46 1.62 0.87 -0.76 0.00 0.00 175.35 178.03 1nb4 h LYS 212 N 3.20 0.48 -1.94 1.68 1.57 -1.90 -3.38 116.57 116.28 1nb4 h LYS 212 Ca -0.48 -0.11 -0.40 0.00 -1.87 0.00 0.00 60.65 57.80 1nb4 h LYS 212 Cb 1.18 -0.07 -0.31 0.00 0.08 0.00 0.00 32.23 33.11 1nb4 h LYS 212 CO 0.68 0.54 -0.73 0.00 -0.57 0.00 0.00 179.45 179.37 1nb4 s PRO 214 N 1.07 2.44 -0.16 0.00 0.04 -1.26 0.33 135.00 137.45 1nb4 s PRO 214 Ca 0.22 1.69 -0.13 0.00 0.04 0.00 0.00 61.00 62.82 1nb4 s PRO 214 Cb -0.10 -1.88 0.05 0.00 0.04 0.00 0.00 34.50 32.61 1nb4 s PRO 214 CO -0.06 -1.59 0.43 1.41 0.04 0.00 0.00 177.00 177.23 1nb4 s MET 215 N -3.84 0.47 0.06 4.56 1.75 -0.71 -4.60 119.30 117.00 1nb4 s MET 215 Ca 0.73 0.66 0.01 0.00 -1.25 0.00 0.00 55.69 55.84 1nb4 s MET 215 Cb -0.27 0.16 -0.03 0.00 2.84 0.00 0.00 34.83 37.53 1nb4 s MET 215 CO 0.42 -0.09 -0.05 0.20 -0.65 0.00 0.00 175.02 174.85 1nb4 s GLY 216 N 0.59 0.53 0.04 2.11 0.00 0.11 -0.65 107.32 110.05 1nb4 s GLY 216 Ca -0.03 -1.05 -0.17 0.00 0.00 0.00 0.00 44.72 43.48 1nb4 s GLY 216 CO -0.04 -1.13 0.38 -0.11 0.00 0.00 0.00 173.10 172.20 1nb4 s PHE 217 N -2.82 -0.22 0.13 1.90 -0.71 -0.51 -0.24 117.98 115.51 1nb4 s PHE 217 Ca 0.01 0.16 0.04 0.00 -1.04 0.00 0.00 56.93 56.10 1nb4 s PHE 217 Cb -0.00 0.18 -0.04 0.00 -1.21 0.00 0.00 43.02 41.95 1nb4 s PHE 217 CO -0.04 -0.54 0.10 -1.54 -1.34 0.00 0.00 175.22 171.86 1nb4 s SER 218 N -1.97 5.47 -0.07 1.98 1.04 -1.26 -0.66 113.70 118.23 1nb4 s SER 218 Ca -0.06 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.28 1nb4 s SER 218 Cb -0.01 -1.43 0.02 0.00 0.10 0.00 0.00 66.02 64.70 1nb4 s SER 218 CO -0.02 0.12 -0.04 -0.47 0.98 0.00 0.00 173.24 173.80 1nb4 s TYR 219 N -1.58 0.94 -0.13 5.02 5.04 -0.58 -4.56 117.35 121.50 1nb4 s TYR 219 Ca 0.30 -0.33 0.02 0.00 -2.44 0.00 0.00 57.07 54.61 1nb4 s TYR 219 Cb -0.11 -0.86 0.01 0.00 0.35 0.00 0.00 41.96 41.35 1nb4 s TYR 219 CO 0.22 -0.31 -0.18 0.34 -1.34 0.00 0.00 175.55 174.29 1nb4 s ASP 220 N 1.37 2.75 0.12 4.32 2.15 -1.26 -3.87 116.67 122.25 1nb4 s ASP 220 Ca -0.03 -0.51 -0.21 0.00 0.43 0.00 0.00 52.55 52.23 1nb4 s ASP 220 Cb -0.13 -1.25 -0.07 0.00 -0.30 0.00 0.00 42.92 41.16 1nb4 s ASP 220 CO -0.03 0.03 0.65 0.28 -0.17 0.00 0.00 175.17 175.94 1nb4 s THR 221 N 0.98 4.61 0.16 1.71 -1.32 -1.26 -0.66 115.64 119.85 1nb4 s THR 221 Ca -0.05 1.36 -0.30 0.00 -1.21 0.00 0.00 61.69 61.49 1nb4 s THR 221 Cb -0.15 -3.96 -0.07 0.00 -1.51 0.00 0.00 72.50 66.81 1nb4 s THR 221 CO -0.03 0.49 1.07 -0.13 -2.21 0.00 0.00 174.62 173.81 1nb4 s ARG 222 N -1.26 4.62 -1.09 7.08 1.81 -1.14 -3.92 118.95 125.04 1nb4 s ARG 222 Ca 0.33 1.65 -0.21 0.00 -1.72 0.00 0.00 55.73 55.79 1nb4 s ARG 222 Cb -0.20 -3.30 0.01 0.00 -0.45 0.00 0.00 34.95 31.01 1nb4 s ARG 222 CO 0.22 0.11 0.74 0.00 -0.68 0.00 0.00 175.30 175.68 1nb4 h PHE 224 N -1.75 0.22 -0.91 0.00 3.04 -1.98 -2.14 116.94 113.42 1nb4 h PHE 224 Ca -0.64 0.04 0.06 0.00 3.98 0.00 0.00 57.97 61.42 1nb4 h PHE 224 Cb 1.36 0.01 -0.06 0.00 2.56 0.00 0.00 35.95 39.81 1nb4 h PHE 224 CO 0.32 -0.07 0.57 -0.44 -2.02 0.00 0.00 178.31 176.68 1nb4 h ASP 225 N 0.25 0.91 1.00 0.41 3.32 -1.90 0.19 116.42 120.61 1nb4 h ASP 225 Ca 0.37 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.43 1nb4 h ASP 225 Cb 0.59 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 1nb4 h ASP 225 CO -0.47 0.58 -0.00 0.28 -1.72 0.00 0.00 179.24 177.91 1nb4 h SER 226 N 1.05 0.00 1.19 6.45 0.02 -1.68 -2.69 113.55 117.88 1nb4 h SER 226 Ca 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 1nb4 h SER 226 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1nb4 h SER 226 CO -0.17 0.00 -0.27 0.35 -1.14 0.00 0.00 176.83 175.59 1nb4 n THR 227 N -3.09 0.47 -2.35 -2.27 -2.24 0.65 -4.76 114.28 100.68 1nb4 n THR 227 Ca 0.01 -0.27 -0.42 0.00 -2.27 0.00 0.00 64.05 61.09 1nb4 n THR 227 Cb 0.30 -0.37 -0.03 0.00 -2.10 0.00 0.00 70.33 68.13 1nb4 n THR 227 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1nb4 s VAL 228 N -3.12 4.06 0.48 2.28 1.01 -1.03 -4.86 120.40 119.21 1nb4 s VAL 228 Ca 0.09 1.38 -0.01 0.00 0.00 0.00 0.00 61.98 63.44 1nb4 s VAL 228 Cb 0.13 -3.89 -0.00 0.00 0.00 0.00 0.00 36.38 32.62 1nb4 s VAL 228 CO 0.65 -0.04 0.71 0.42 0.00 0.00 0.00 175.10 176.84 1nb4 s THR 229 N 2.71 3.94 0.30 3.92 -4.23 -1.26 -3.93 115.64 117.09 1nb4 s THR 229 Ca 0.59 -0.40 -0.02 0.00 -1.18 0.00 0.00 61.69 60.68 1nb4 s THR 229 Cb -0.26 -3.48 0.24 0.00 1.34 0.00 0.00 72.50 70.34 1nb4 s THR 229 CO 0.22 -0.36 1.94 -0.33 -0.54 0.00 0.00 174.62 175.55 1nb4 h GLU 230 N 0.29 1.03 -0.58 3.99 5.08 -1.87 -0.88 114.58 121.65 1nb4 h GLU 230 Ca -0.46 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 57.80 1nb4 h GLU 230 Cb 1.25 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 1nb4 h GLU 230 CO 0.58 0.72 0.31 1.03 -1.00 0.00 0.00 179.01 180.65 1nb4 h SER 231 N 1.05 0.74 -0.64 1.42 0.87 -1.97 -0.77 113.55 114.26 1nb4 h SER 231 Ca 0.28 -0.11 0.06 0.00 -1.23 0.00 0.00 61.79 60.79 1nb4 h SER 231 Cb -0.05 -0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 61.67 1nb4 h SER 231 CO -0.05 0.64 0.35 0.44 -0.53 0.00 0.00 176.83 177.67 1nb4 h ASP 232 N 0.79 0.50 0.19 6.23 3.45 -1.58 -0.33 116.42 125.67 1nb4 h ASP 232 Ca 0.20 0.03 -0.12 0.00 0.43 0.00 0.00 57.03 57.58 1nb4 h ASP 232 Cb 0.07 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 38.77 1nb4 h ASP 232 CO -0.03 0.33 -0.43 0.40 -1.57 0.00 0.00 179.24 177.94 1nb4 h ILE 233 N 0.64 1.32 -0.00 0.35 2.04 -1.01 -0.82 117.51 120.03 1nb4 h ILE 233 Ca 0.29 -1.58 -0.16 0.00 1.00 0.00 0.00 64.86 64.41 1nb4 h ILE 233 Cb 0.19 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 1nb4 h ILE 233 CO -0.18 0.48 -0.75 0.03 0.00 0.00 0.00 178.15 177.72 1nb4 h ARG 234 N 0.25 0.03 -0.46 2.37 3.08 -0.71 -1.95 114.38 117.00 1nb4 h ARG 234 Ca 0.02 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 1nb4 h ARG 234 Cb 0.87 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 1nb4 h ARG 234 CO 0.07 0.76 -0.09 0.28 -1.07 0.00 0.00 179.97 179.92 1nb4 h VAL 235 N 0.02 1.27 -0.11 2.04 2.07 -0.79 -0.88 116.25 119.87 1nb4 h VAL 235 Ca -0.01 -1.20 0.02 0.00 0.82 0.00 0.00 66.70 66.33 1nb4 h VAL 235 Cb 1.32 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 1nb4 h VAL 235 CO 0.10 0.41 -0.04 -0.08 0.02 0.00 0.00 177.57 177.98 1nb4 h GLU 236 N 0.71 -0.02 -0.90 1.57 4.81 -1.04 -1.55 114.58 118.15 1nb4 h GLU 236 Ca 0.12 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.41 1nb4 h GLU 236 Cb 0.63 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.95 1nb4 h GLU 236 CO 0.04 -0.01 0.57 1.49 -0.73 0.00 0.00 179.01 180.37 1nb4 h GLU 237 N -0.02 1.01 -0.13 1.92 4.81 -1.10 -1.40 114.58 119.67 1nb4 h GLU 237 Ca 0.06 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.26 1nb4 h GLU 237 Cb 0.10 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1nb4 h GLU 237 CO -0.12 0.67 0.11 0.66 -0.73 0.00 0.00 179.01 179.59 1nb4 h SER 238 N 1.04 0.00 0.04 1.04 4.64 -0.17 -0.17 113.55 119.96 1nb4 h SER 238 Ca 0.39 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.58 1nb4 h SER 238 Cb 0.17 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1nb4 h SER 238 CO -0.17 0.00 -0.54 0.40 -0.87 0.00 0.00 176.83 175.65 1nb4 h ILE 239 N 0.00 1.51 -0.28 0.95 2.04 -0.72 -3.21 117.51 117.79 1nb4 h ILE 239 Ca 0.06 -2.20 -0.02 0.00 1.00 0.00 0.00 64.86 63.71 1nb4 h ILE 239 Cb 0.28 2.87 -0.01 0.00 -0.74 0.00 0.00 36.82 39.21 1nb4 h ILE 239 CO -0.00 0.62 0.10 1.88 0.00 0.00 0.00 178.15 180.75 1nb4 h TYR 240 N -0.34 0.39 0.00 1.37 0.05 -0.89 -2.34 116.97 115.21 1nb4 h TYR 240 Ca -0.08 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.69 1nb4 h TYR 240 Cb 1.31 -0.12 0.00 0.00 1.01 0.00 0.00 36.73 38.93 1nb4 h TYR 240 CO 0.18 0.33 0.00 1.04 -1.05 0.00 0.00 178.16 178.65 1nb4 n GLN 241 N -4.41 0.17 0.16 4.88 1.13 -0.17 -1.77 117.38 117.37 1nb4 n GLN 241 Ca 0.01 0.44 0.13 0.00 -1.94 0.00 0.00 57.00 55.64 1nb4 n GLN 241 Cb 0.14 -1.86 0.49 0.00 0.11 0.00 0.00 30.24 29.13 1nb4 n GLN 241 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1nb4 s ASP 244 N -2.55 7.07 0.04 0.00 -1.08 0.10 -4.95 116.67 115.30 1nb4 s ASP 244 Ca 0.67 1.73 0.03 0.00 -0.52 0.00 0.00 52.55 54.47 1nb4 s ASP 244 Cb -0.21 -2.55 -0.02 0.00 -1.46 0.00 0.00 42.92 38.67 1nb4 s ASP 244 CO 0.41 -0.58 -0.10 -0.76 0.52 0.00 0.00 175.17 174.66 1nb4 s LEU 245 N 2.36 2.22 0.53 -1.34 1.43 -1.26 -1.96 118.68 120.66 1nb4 s LEU 245 Ca 0.54 -0.51 -0.21 0.00 -1.03 0.00 0.00 54.13 52.92 1nb4 s LEU 245 Cb -0.23 -0.31 -0.05 0.00 0.03 0.00 0.00 46.19 45.63 1nb4 s LEU 245 CO 0.20 -0.12 1.24 0.00 0.23 0.00 0.00 176.35 177.90 1nb4 s ALA 246 N -1.16 2.80 0.26 4.21 0.00 -1.26 -4.81 121.76 121.80 1nb4 s ALA 246 Ca -0.06 1.08 -0.02 0.00 0.00 0.00 0.00 51.96 52.97 1nb4 s ALA 246 Cb -0.09 -3.46 0.51 0.00 0.00 0.00 0.00 23.12 20.08 1nb4 s ALA 246 CO 0.01 -1.02 1.77 -1.35 0.00 0.00 0.00 175.76 175.17 1nb4 h PRO 247 N 1.52 0.64 -0.32 0.00 0.11 -2.00 -0.88 132.00 131.07 1nb4 h PRO 247 Ca -0.50 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.48 1nb4 h PRO 247 Cb 1.28 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1nb4 h PRO 247 CO 0.58 0.42 -0.19 0.93 -0.21 0.00 0.00 178.00 179.53 1nb4 h GLU 248 N 0.66 0.58 -0.41 1.05 5.08 -1.99 -1.42 114.58 118.13 1nb4 h GLU 248 Ca 0.45 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.51 1nb4 h GLU 248 Cb 0.60 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1nb4 h GLU 248 CO -0.34 0.74 -0.14 0.00 -1.00 0.00 0.00 179.01 178.27 1nb4 h ALA 249 N 1.28 0.57 -0.71 3.43 0.00 -1.59 -0.17 119.26 122.07 1nb4 h ALA 249 Ca 0.08 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1nb4 h ALA 249 Cb 0.62 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1nb4 h ALA 249 CO 0.04 0.48 0.47 -0.09 0.00 0.00 0.00 179.25 180.15 1nb4 h ARG 250 N 0.63 0.93 -0.19 0.00 2.43 -0.94 0.77 114.38 118.01 1nb4 h ARG 250 Ca 0.10 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.11 1nb4 h ARG 250 Cb 0.68 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1nb4 h ARG 250 CO 0.05 0.61 -0.27 0.37 -1.51 0.00 0.00 179.97 179.22 1nb4 h GLN 251 N 0.96 0.52 -0.95 0.20 5.75 -1.15 -2.06 115.11 118.38 1nb4 h GLN 251 Ca 0.26 -0.30 0.06 0.00 -0.15 0.00 0.00 58.65 58.52 1nb4 h GLN 251 Cb -0.10 0.03 -0.06 0.00 1.07 0.00 0.00 27.48 28.41 1nb4 h GLN 251 CO -0.06 0.90 0.62 0.00 -2.65 0.00 0.00 178.83 177.64 1nb4 h ALA 252 N 0.61 1.44 -0.66 3.38 0.00 -0.59 -0.01 119.26 123.44 1nb4 h ALA 252 Ca 0.02 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1nb4 h ALA 252 Cb 0.84 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1nb4 h ALA 252 CO 0.06 0.43 0.09 0.82 0.00 0.00 0.00 179.25 180.65 1nb4 h ILE 253 N 1.12 1.27 -0.04 0.00 2.04 -0.70 0.66 117.51 121.85 1nb4 h ILE 253 Ca 0.40 -1.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 1nb4 h ILE 253 Cb 0.14 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1nb4 h ILE 253 CO -0.15 0.40 0.02 -0.09 0.00 0.00 0.00 178.15 178.33 1nb4 h ARG 254 N 1.03 0.06 -0.38 2.37 9.65 -0.61 -0.60 114.38 125.91 1nb4 h ARG 254 Ca 0.20 -0.01 -0.06 0.00 -1.10 0.00 0.00 59.98 59.01 1nb4 h ARG 254 Cb 0.47 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.03 1nb4 h ARG 254 CO 0.02 0.17 0.00 0.77 2.80 0.00 0.00 179.97 183.73 1nb4 h SER 255 N -0.06 0.66 -0.53 -3.80 0.02 -0.95 -2.63 113.55 106.26 1nb4 h SER 255 Ca 0.01 -0.31 -0.02 0.00 -0.84 0.00 0.00 61.79 60.63 1nb4 h SER 255 Cb 0.13 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.47 1nb4 h SER 255 CO -0.00 0.81 0.26 -0.07 -1.14 0.00 0.00 176.83 176.68 1nb4 h LEU 256 N 0.50 0.72 0.04 5.07 3.38 -0.81 0.79 115.31 125.01 1nb4 h LEU 256 Ca 0.11 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1nb4 h LEU 256 Cb 0.47 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1nb4 h LEU 256 CO 0.02 0.62 -0.02 0.74 0.09 0.00 0.00 178.44 179.89 1nb4 h THR 257 N 0.80 1.04 0.00 0.22 2.02 -1.04 0.13 112.91 116.09 1nb4 h THR 257 Ca 0.20 -0.27 -0.18 0.00 0.77 0.00 0.00 66.41 66.93 1nb4 h THR 257 Cb 0.10 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1nb4 h THR 257 CO -0.02 0.07 -0.84 -0.33 0.37 0.00 0.00 175.52 174.76 1nb4 h GLU 258 N -0.17 0.01 0.00 6.66 4.39 -1.19 -1.91 114.58 122.36 1nb4 h GLU 258 Ca -0.01 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.57 1nb4 h GLU 258 Cb 0.16 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1nb4 h GLU 258 CO 0.01 0.85 -1.55 0.54 -1.16 0.00 0.00 179.01 177.70 1nb4 n ARG 259 N -3.54 0.63 0.06 2.33 1.74 0.25 -4.71 116.66 113.42 1nb4 n ARG 259 Ca -0.01 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 1nb4 n ARG 259 Cb 0.81 -1.72 0.00 0.00 -1.02 0.00 0.00 32.46 30.53 1nb4 n ARG 259 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1nb4 n LEU 260 N -2.69 0.43 -0.34 0.55 7.94 0.33 -1.44 117.00 121.79 1nb4 n LEU 260 Ca -0.09 0.19 -0.04 0.00 -1.11 0.00 0.00 56.01 54.96 1nb4 n LEU 260 Cb 0.75 -0.04 0.09 0.00 0.53 0.00 0.00 43.42 44.75 1nb4 n LEU 260 CO 0.43 -0.59 1.19 1.88 -1.11 0.00 0.00 177.39 179.20 1nb4 h TYR 261 N 0.00 1.24 0.00 1.96 0.05 -1.15 -2.76 116.97 116.31 1nb4 h TYR 261 Ca 0.00 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.75 1nb4 h TYR 261 Cb 0.20 -0.40 -0.00 0.00 1.01 0.00 0.00 36.73 37.54 1nb4 h TYR 261 CO 0.00 0.85 -0.03 0.97 -1.05 0.00 0.00 178.16 178.90 1nb4 h ILE 262 N 1.28 0.06 0.00 -2.88 2.10 -1.60 -3.42 117.51 113.05 1nb4 h ILE 262 Ca 0.32 -0.77 0.00 0.00 1.08 0.00 0.00 64.86 65.50 1nb4 h ILE 262 Cb -0.00 1.73 0.00 0.00 -1.09 0.00 0.00 36.82 37.46 1nb4 h ILE 262 CO -0.06 0.03 0.00 0.61 -1.08 0.00 0.00 178.15 177.65 1nb4 n GLY 263 N 0.46 -1.02 0.00 8.18 0.00 -1.04 -3.99 105.19 107.76 1nb4 n GLY 263 Ca 0.02 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1nb4 n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nb4 n GLY 264 N -0.64 -0.47 3.79 -0.02 0.00 -0.48 -4.11 105.19 103.26 1nb4 n GLY 264 Ca 0.00 -1.41 -0.36 0.00 0.00 0.00 0.00 46.02 44.26 1nb4 n GLY 264 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nb4 s PRO 265 N -1.86 4.26 -0.17 1.61 0.04 -1.26 -0.81 135.00 136.82 1nb4 s PRO 265 Ca 0.00 1.38 -0.01 0.00 0.04 0.00 0.00 61.00 62.41 1nb4 s PRO 265 Cb 0.00 -2.52 -0.01 0.00 0.04 0.00 0.00 34.50 32.02 1nb4 s PRO 265 CO 0.00 -0.03 -0.11 -0.51 0.04 0.00 0.00 177.00 176.39 1nb4 s LEU 266 N -2.64 2.71 0.01 -3.56 1.43 -0.14 -2.61 118.68 113.89 1nb4 s LEU 266 Ca 0.57 -0.39 0.06 0.00 -1.03 0.00 0.00 54.13 53.35 1nb4 s LEU 266 Cb -0.18 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 1nb4 s LEU 266 CO 0.23 0.08 -0.17 -0.89 0.23 0.00 0.00 176.35 175.83 1nb4 s THR 267 N 0.85 2.82 0.72 5.49 2.01 -0.13 0.08 115.64 127.48 1nb4 s THR 267 Ca -0.03 -1.05 -0.03 0.00 0.31 0.00 0.00 61.69 60.89 1nb4 s THR 267 Cb -0.15 -2.15 0.12 0.00 0.01 0.00 0.00 72.50 70.33 1nb4 s THR 267 CO 0.00 0.42 1.00 0.54 -0.69 0.00 0.00 174.62 175.90 1nb4 s ASN 268 N -1.18 4.36 0.65 3.53 2.20 -0.65 -1.29 114.94 122.55 1nb4 s ASN 268 Ca 0.13 -0.19 0.39 0.00 -0.94 0.00 0.00 52.86 52.25 1nb4 s ASN 268 Cb -0.10 -0.23 2.14 0.00 -2.00 0.00 0.00 41.25 41.05 1nb4 s ASN 268 CO 0.04 -1.85 2.25 0.77 -2.94 0.00 0.00 177.10 175.37 1nb4 h SER 269 N -0.58 0.00 1.10 3.54 4.64 -1.76 -1.10 113.55 119.39 1nb4 h SER 269 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1nb4 h SER 269 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1nb4 h SER 269 CO 0.43 0.00 -0.28 0.29 -0.87 0.00 0.00 176.83 176.40 1nb4 n LYS 270 N -3.21 0.22 0.00 4.77 5.02 -1.26 -4.92 118.16 118.77 1nb4 n LYS 270 Ca -0.02 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1nb4 n LYS 270 Cb 0.16 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 1nb4 n LYS 270 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nb4 n GLY 271 N 1.36 0.75 3.85 0.72 0.00 -0.42 -5.08 105.19 106.38 1nb4 n GLY 271 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1nb4 n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nb4 s GLN 272 N -0.95 3.97 -0.08 1.61 -0.21 -1.26 -4.84 119.66 117.90 1nb4 s GLN 272 Ca 0.00 0.51 -0.30 0.00 0.02 0.00 0.00 55.36 55.59 1nb4 s GLN 272 Cb 0.00 -2.75 -0.03 0.00 1.00 0.00 0.00 33.01 31.22 1nb4 s GLN 272 CO 0.00 0.36 1.34 1.21 -2.12 0.00 0.00 175.29 176.08 1nb4 s ASN 273 N -1.99 6.91 -0.17 5.90 3.04 -1.26 -1.64 114.94 125.72 1nb4 s ASN 273 Ca 0.44 1.90 0.17 0.00 0.04 0.00 0.00 52.86 55.41 1nb4 s ASN 273 Cb -0.13 -2.55 -0.24 0.00 -1.54 0.00 0.00 41.25 36.79 1nb4 s ASN 273 CO 0.20 -0.73 0.11 0.00 -3.04 0.00 0.00 177.10 173.63 1nb4 n GLY 275 N 1.78 -0.50 2.93 0.00 0.00 -1.11 -2.05 105.19 106.24 1nb4 n GLY 275 Ca -0.28 -1.03 -0.12 0.00 0.00 0.00 0.00 46.02 44.59 1nb4 n GLY 275 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1nb4 s TYR 276 N -3.17 -0.02 -0.09 1.61 5.04 0.60 -0.97 117.35 120.34 1nb4 s TYR 276 Ca 0.00 0.06 -0.01 0.00 -2.44 0.00 0.00 57.07 54.68 1nb4 s TYR 276 Cb 0.00 -0.00 -0.03 0.00 0.35 0.00 0.00 41.96 42.28 1nb4 s TYR 276 CO 0.00 -0.04 -0.03 0.50 -1.34 0.00 0.00 175.55 174.64 1nb4 s ARG 277 N -0.12 3.05 -0.24 4.97 3.52 0.01 -1.22 118.95 128.92 1nb4 s ARG 277 Ca -0.02 -0.48 0.19 0.00 -0.13 0.00 0.00 55.73 55.29 1nb4 s ARG 277 Cb -0.01 -2.75 0.48 0.00 -1.56 0.00 0.00 34.95 31.12 1nb4 s ARG 277 CO 0.00 0.59 1.14 0.54 -0.81 0.00 0.00 175.30 176.76 1nb4 n ARG 278 N 2.47 2.00 -2.63 5.12 1.74 -0.38 -1.38 116.66 123.60 1nb4 n ARG 278 Ca -0.18 -3.50 -0.06 0.00 -0.77 0.00 0.00 57.85 53.34 1nb4 n ARG 278 Cb 0.53 -1.60 -0.01 0.00 -1.02 0.00 0.00 32.46 30.36 1nb4 n ARG 278 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nb4 s ARG 280 N -2.32 4.13 0.24 0.00 3.52 -1.11 -4.53 118.95 118.89 1nb4 s ARG 280 Ca 0.13 2.61 -0.30 0.00 -0.13 0.00 0.00 55.73 58.04 1nb4 s ARG 280 Cb -0.01 -3.49 -0.09 0.00 -1.56 0.00 0.00 34.95 29.80 1nb4 s ARG 280 CO 0.09 -0.83 0.96 0.00 -0.81 0.00 0.00 175.30 174.71 1nb4 s ALA 281 N 2.44 3.35 -0.52 6.12 0.00 -1.26 -4.73 121.76 127.15 1nb4 s ALA 281 Ca 0.80 0.65 0.24 0.00 0.00 0.00 0.00 51.96 53.65 1nb4 s ALA 281 Cb -0.47 -3.22 0.47 0.00 0.00 0.00 0.00 23.12 19.89 1nb4 s ALA 281 CO 0.36 0.17 1.63 0.66 0.00 0.00 0.00 175.76 178.58 1nb4 h SER 282 N 4.12 0.00 -1.80 0.00 4.64 -1.89 -3.39 113.55 115.22 1nb4 h SER 282 Ca -0.45 -0.01 -0.64 0.00 -0.47 0.00 0.00 61.79 60.22 1nb4 h SER 282 Cb 1.20 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.91 1nb4 h SER 282 CO 0.68 0.00 -0.21 0.61 -0.87 0.00 0.00 176.83 177.04 1nb4 n GLY 283 N 1.17 5.85 3.45 -0.77 0.00 0.27 -3.96 105.19 111.20 1nb4 n GLY 283 Ca 0.04 -2.70 -0.22 0.00 0.00 0.00 0.00 46.02 43.15 1nb4 n GLY 283 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nb4 s VAL 284 N -5.19 1.46 0.35 1.61 -7.23 -1.21 -4.52 120.40 105.67 1nb4 s VAL 284 Ca 0.48 -2.06 0.05 0.00 -1.81 0.00 0.00 61.98 58.65 1nb4 s VAL 284 Cb 0.38 -2.64 0.16 0.00 0.56 0.00 0.00 36.38 34.84 1nb4 s VAL 284 CO -0.23 -0.15 1.89 0.25 -0.31 0.00 0.00 175.10 176.55 1nb4 h LEU 285 N 2.17 0.44 -0.63 1.32 5.85 -1.95 -2.94 115.31 119.57 1nb4 h LEU 285 Ca -0.41 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.23 1nb4 h LEU 285 Cb 1.24 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1nb4 h LEU 285 CO 0.69 0.52 0.00 0.35 -0.34 0.00 0.00 178.44 179.66 1nb4 n THR 286 N -4.29 0.09 -0.14 1.05 -2.24 -1.26 -4.43 114.28 103.06 1nb4 n THR 286 Ca 0.01 -0.19 -0.10 0.00 -2.27 0.00 0.00 64.05 61.50 1nb4 n THR 286 Cb 0.24 0.10 0.04 0.00 -2.10 0.00 0.00 70.33 68.60 1nb4 n THR 286 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nb4 h THR 287 N 1.34 1.27 -0.07 4.28 1.03 -1.82 0.24 112.91 119.18 1nb4 h THR 287 Ca 0.00 -1.36 -0.02 0.00 -0.01 0.00 0.00 66.41 65.03 1nb4 h THR 287 Cb 0.29 1.14 -0.00 0.00 -1.07 0.00 0.00 68.15 68.50 1nb4 h THR 287 CO 0.00 0.46 -0.02 -1.28 -0.01 0.00 0.00 175.52 174.67 1nb4 h SER 288 N 0.80 0.15 -0.39 0.00 0.87 -1.84 -1.03 113.55 112.11 1nb4 h SER 288 Ca 0.11 -0.38 -0.03 0.00 -1.23 0.00 0.00 61.79 60.26 1nb4 h SER 288 Cb 0.76 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.67 1nb4 h SER 288 CO 0.06 0.49 0.11 0.00 -0.53 0.00 0.00 176.83 176.96 1nb4 h GLY 290 N 0.49 0.89 0.99 0.00 0.00 -0.55 -0.55 103.07 104.34 1nb4 h GLY 290 Ca 0.13 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 1nb4 h GLY 290 CO -0.00 0.53 0.33 3.43 0.00 0.00 0.00 176.54 180.82 1nb4 h ASN 291 N 0.71 0.73 -0.10 0.19 2.35 -1.13 -0.82 115.58 117.51 1nb4 h ASN 291 Ca 0.16 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1nb4 h ASN 291 Cb 0.36 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 1nb4 h ASN 291 CO 0.00 0.61 0.05 0.74 -1.65 0.00 0.00 177.43 177.18 1nb4 h THR 292 N 0.79 1.09 -0.31 2.81 2.02 -1.12 -0.00 112.91 118.20 1nb4 h THR 292 Ca 0.21 -0.25 0.01 0.00 0.77 0.00 0.00 66.41 67.14 1nb4 h THR 292 Cb 0.03 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 1nb4 h THR 292 CO -0.03 0.08 0.20 -0.07 0.37 0.00 0.00 175.52 176.06 1nb4 h LEU 293 N 0.06 0.34 -0.56 2.58 3.38 -0.99 0.02 115.31 120.15 1nb4 h LEU 293 Ca 0.04 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1nb4 h LEU 293 Cb 0.08 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1nb4 h LEU 293 CO -0.01 0.24 0.19 0.74 0.09 0.00 0.00 178.44 179.70 1nb4 h THR 294 N 0.41 1.23 -0.20 0.22 2.02 -1.01 -0.55 112.91 115.03 1nb4 h THR 294 Ca 0.12 -0.76 -0.04 0.00 0.77 0.00 0.00 66.41 66.50 1nb4 h THR 294 Cb -0.03 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1nb4 h THR 294 CO -0.03 0.29 -0.01 0.00 0.37 0.00 0.00 175.52 176.13 1nb4 h TYR 296 N 0.11 0.39 0.25 0.00 3.20 -0.90 -0.43 116.97 119.59 1nb4 h TYR 296 Ca 0.06 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 1nb4 h TYR 296 Cb 0.42 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.58 1nb4 h TYR 296 CO 0.04 0.19 -0.12 1.25 -1.64 0.00 0.00 178.16 177.88 1nb4 h LEU 297 N 0.43 -0.29 -0.50 2.82 5.85 -1.01 -1.33 115.31 121.29 1nb4 h LEU 297 Ca 0.19 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.88 1nb4 h LEU 297 Cb 0.11 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1nb4 h LEU 297 CO -0.14 -0.20 0.16 0.11 -0.34 0.00 0.00 178.44 178.03 1nb4 h LYS 298 N -0.35 0.77 -0.50 1.25 1.57 -1.21 -1.87 116.57 116.23 1nb4 h LYS 298 Ca -0.03 -0.16 -0.12 0.00 -1.87 0.00 0.00 60.65 58.47 1nb4 h LYS 298 Cb 0.27 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1nb4 h LYS 298 CO 0.06 0.72 -0.15 0.00 -0.57 0.00 0.00 179.45 179.51 1nb4 h ALA 299 N 1.02 0.69 -0.50 3.86 0.00 -1.10 0.15 119.26 123.39 1nb4 h ALA 299 Ca 0.16 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 1nb4 h ALA 299 Cb 0.26 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1nb4 h ALA 299 CO -0.01 0.63 -0.07 1.15 0.00 0.00 0.00 179.25 180.96 1nb4 h THR 300 N 0.85 1.27 -0.46 0.00 2.02 -1.16 0.41 112.91 115.83 1nb4 h THR 300 Ca 0.12 -1.19 -0.13 0.00 0.77 0.00 0.00 66.41 65.98 1nb4 h THR 300 Cb 0.72 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1nb4 h THR 300 CO 0.05 0.41 -0.23 0.00 0.37 0.00 0.00 175.52 176.12 1nb4 h ALA 301 N 0.91 0.70 -0.53 6.16 0.00 -1.24 -2.89 119.26 122.37 1nb4 h ALA 301 Ca 0.13 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 1nb4 h ALA 301 Cb 0.61 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1nb4 h ALA 301 CO 0.04 0.67 0.14 0.00 0.00 0.00 0.00 179.25 180.10 1nb4 h ALA 302 N 0.89 1.25 -0.87 0.00 0.00 -0.41 -1.77 119.26 118.36 1nb4 h ALA 302 Ca 0.10 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1nb4 h ALA 302 Cb 0.81 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1nb4 h ALA 302 CO 0.07 0.53 0.55 0.00 0.00 0.00 0.00 179.25 180.40 1nb4 h ARG 304 N 1.06 0.60 -0.36 0.00 3.08 -1.19 -2.23 114.38 115.35 1nb4 h ARG 304 Ca 0.35 -0.27 -0.03 0.00 0.07 0.00 0.00 59.98 60.10 1nb4 h ARG 304 Cb 0.04 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1nb4 h ARG 304 CO -0.13 0.85 0.11 0.00 -1.07 0.00 0.00 179.97 179.73 1nb4 h ALA 305 N 1.14 0.47 0.00 0.04 0.00 -0.80 -2.92 119.26 117.18 1nb4 h ALA 305 Ca 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1nb4 h ALA 305 Cb 0.80 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1nb4 h ALA 305 CO 0.07 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.43 1nb4 n ALA 306 N -2.32 2.41 -1.94 0.00 0.00 -0.79 -4.92 120.51 112.95 1nb4 n ALA 306 Ca -0.01 -0.15 -0.21 0.00 0.00 0.00 0.00 53.44 53.08 1nb4 n ALA 306 Cb 0.18 -1.42 -0.05 0.00 0.00 0.00 0.00 19.45 18.15 1nb4 n ALA 306 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nb4 n LYS 307 N -1.11 -1.56 -1.80 0.00 5.02 -0.95 -4.81 118.16 112.95 1nb4 n LYS 307 Ca 0.17 1.12 -0.41 0.00 -2.02 0.00 0.00 58.31 57.17 1nb4 n LYS 307 Cb 0.14 -5.62 0.00 0.00 -0.02 0.00 0.00 35.03 29.52 1nb4 n LYS 307 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1nb4 s LEU 308 N -5.28 4.30 -0.14 -0.35 1.02 -0.88 -4.97 118.68 112.38 1nb4 s LEU 308 Ca 0.00 3.05 -0.04 0.00 0.02 0.00 0.00 54.13 57.16 1nb4 s LEU 308 Cb 0.00 -3.69 -0.03 0.00 0.02 0.00 0.00 46.19 42.49 1nb4 s LEU 308 CO 0.00 -0.90 -0.01 -1.10 0.02 0.00 0.00 176.35 174.36 1nb4 s GLN 309 N -2.13 3.50 -1.08 1.70 -1.52 -1.26 -4.71 119.66 114.15 1nb4 s GLN 309 Ca 0.53 -0.45 -0.08 0.00 -1.95 0.00 0.00 55.36 53.41 1nb4 s GLN 309 Cb -0.46 -2.93 -0.05 0.00 -0.22 0.00 0.00 33.01 29.35 1nb4 s GLN 309 CO 0.63 0.40 0.89 -0.25 -0.25 0.00 0.00 175.29 176.71 1nb4 n ASP 310 N 3.07 -5.99 -4.67 5.90 9.92 -1.26 -1.26 116.55 122.26 1nb4 n ASP 310 Ca -0.18 -0.77 -0.40 0.00 -0.53 0.00 0.00 54.79 52.91 1nb4 n ASP 310 Cb 0.53 -4.82 -0.05 0.00 -0.64 0.00 0.00 41.12 36.14 1nb4 n ASP 310 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1nb4 s THR 312 N 1.85 2.83 0.21 0.00 2.01 -0.02 -4.98 115.64 117.55 1nb4 s THR 312 Ca 0.31 -0.75 0.11 0.00 0.31 0.00 0.00 61.69 61.67 1nb4 s THR 312 Cb -0.16 -2.15 -0.05 0.00 0.01 0.00 0.00 72.50 70.15 1nb4 s THR 312 CO 0.11 0.54 -0.20 -0.04 -0.69 0.00 0.00 174.62 174.35 1nb4 s MET 313 N 0.13 1.68 -0.08 4.92 -1.94 -1.26 -1.08 119.30 121.67 1nb4 s MET 313 Ca -0.08 -1.53 -0.01 0.00 -1.71 0.00 0.00 55.69 52.36 1nb4 s MET 313 Cb -0.15 -1.89 0.03 0.00 2.01 0.00 0.00 34.83 34.82 1nb4 s MET 313 CO 0.05 0.39 -0.02 -1.17 -0.01 0.00 0.00 175.02 174.26 1nb4 s LEU 314 N -2.93 0.79 -0.05 -0.03 2.96 -0.72 -4.27 118.68 114.42 1nb4 s LEU 314 Ca 0.24 -0.15 0.04 0.00 -0.22 0.00 0.00 54.13 54.04 1nb4 s LEU 314 Cb -0.07 -0.55 -0.00 0.00 0.50 0.00 0.00 46.19 46.06 1nb4 s LEU 314 CO 0.12 -0.17 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.14 1nb4 s VAL 315 N 1.84 1.34 -0.36 1.68 1.01 -0.03 -2.12 120.40 123.76 1nb4 s VAL 315 Ca 0.04 -0.65 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 1nb4 s VAL 315 Cb -0.12 -1.16 0.12 0.00 0.00 0.00 0.00 36.38 35.22 1nb4 s VAL 315 CO -0.06 0.39 0.17 0.20 0.00 0.00 0.00 175.10 175.81 1nb4 s ASN 316 N 0.15 3.56 1.81 3.32 0.01 -0.64 -0.89 114.94 122.25 1nb4 s ASN 316 Ca -0.06 -2.03 0.00 0.00 -0.71 0.00 0.00 52.86 50.06 1nb4 s ASN 316 Cb -0.12 -0.72 0.00 0.00 0.41 0.00 0.00 41.25 40.82 1nb4 s ASN 316 CO 0.02 -0.35 0.00 0.61 -1.51 0.00 0.00 177.10 175.88 1nb4 n GLY 317 N 4.30 4.05 0.12 0.66 0.00 -1.26 -0.45 105.19 112.60 1nb4 n GLY 317 Ca 0.04 0.12 0.15 0.00 0.00 0.00 0.00 46.02 46.33 1nb4 n GLY 317 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1nb4 n ASP 318 N 7.50 0.41 -4.69 1.61 5.75 -1.26 -3.90 116.55 121.97 1nb4 n ASP 318 Ca 0.00 -0.78 -0.40 0.00 -0.01 0.00 0.00 54.79 53.59 1nb4 n ASP 318 Cb 0.00 -0.07 -0.05 0.00 -1.03 0.00 0.00 41.12 39.98 1nb4 n ASP 318 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1nb4 s ASP 319 N -2.27 6.96 -0.04 -1.12 1.11 0.40 -4.66 116.67 117.05 1nb4 s ASP 319 Ca 0.36 1.16 0.02 0.00 0.18 0.00 0.00 52.55 54.27 1nb4 s ASP 319 Cb 0.21 -2.43 0.01 0.00 1.07 0.00 0.00 42.92 41.78 1nb4 s ASP 319 CO 0.42 -0.24 -0.07 -0.22 1.18 0.00 0.00 175.17 176.24 1nb4 s LEU 320 N 1.42 1.59 -0.04 1.23 2.96 -1.25 -1.62 118.68 122.97 1nb4 s LEU 320 Ca 0.37 -0.17 0.03 0.00 -0.22 0.00 0.00 54.13 54.14 1nb4 s LEU 320 Cb -0.17 -0.53 0.01 0.00 0.50 0.00 0.00 46.19 46.00 1nb4 s LEU 320 CO 0.16 0.01 -0.12 0.54 -1.32 0.00 0.00 176.35 175.62 1nb4 s VAL 321 N 0.53 1.06 -0.03 1.68 0.11 -0.90 -1.53 120.40 121.32 1nb4 s VAL 321 Ca -0.08 -0.48 0.06 0.00 -2.93 0.00 0.00 61.98 58.55 1nb4 s VAL 321 Cb -0.12 -0.94 -0.01 0.00 -1.53 0.00 0.00 36.38 33.78 1nb4 s VAL 321 CO 0.01 0.32 -0.22 -0.69 -3.33 0.00 0.00 175.10 171.19 1nb4 s VAL 322 N 0.33 1.77 -0.13 2.04 1.01 0.16 -1.76 120.40 123.82 1nb4 s VAL 322 Ca -0.07 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 60.98 1nb4 s VAL 322 Cb -0.12 -1.48 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1nb4 s VAL 322 CO 0.02 0.50 -0.16 -0.63 0.00 0.00 0.00 175.10 174.83 1nb4 s ILE 323 N -0.36 1.61 0.16 2.22 1.01 -0.24 -1.42 121.20 124.18 1nb4 s ILE 323 Ca 0.04 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 60.04 1nb4 s ILE 323 Cb -0.10 -1.48 -0.01 0.00 0.01 0.00 0.00 42.46 40.87 1nb4 s ILE 323 CO 0.01 0.46 0.11 0.00 0.00 0.00 0.00 174.94 175.51 1nb4 s GLU 325 N -2.63 4.17 0.45 0.00 0.41 -0.39 -1.73 118.70 118.98 1nb4 s GLU 325 Ca 0.15 0.43 -0.24 0.00 -0.41 0.00 0.00 54.97 54.90 1nb4 s GLU 325 Cb 0.01 -3.58 -0.08 0.00 -1.78 0.00 0.00 34.13 28.70 1nb4 s GLU 325 CO 0.11 -0.19 1.18 0.45 -0.49 0.00 0.00 175.26 176.31 1nb4 s SER 326 N 1.22 6.23 0.00 -0.19 0.15 0.15 -4.53 113.70 116.72 1nb4 s SER 326 Ca 0.24 2.35 0.05 0.00 0.70 0.00 0.00 55.95 59.30 1nb4 s SER 326 Cb -0.15 -2.61 0.12 0.00 -1.71 0.00 0.00 66.02 61.67 1nb4 s SER 326 CO 0.10 -0.88 1.00 0.00 1.20 0.00 0.00 173.24 174.66 1nb4 n ALA 327 N -0.34 2.20 0.00 5.45 0.00 -1.26 -4.91 120.51 121.65 1nb4 n ALA 327 Ca 0.06 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.58 1nb4 n ALA 327 Cb 0.47 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.71 1nb4 n ALA 327 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nb4 n GLY 328 N 0.10 3.31 0.38 0.00 0.00 -1.26 -4.68 105.19 103.04 1nb4 n GLY 328 Ca 0.05 -1.86 -0.15 0.00 0.00 0.00 0.00 46.02 44.06 1nb4 n GLY 328 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1nb4 h THR 329 N 0.00 0.25 -0.33 2.61 2.02 -1.99 -0.70 112.91 114.76 1nb4 h THR 329 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1nb4 h THR 329 Cb 0.00 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 66.64 1nb4 h THR 329 CO 0.00 0.00 0.09 -0.61 0.37 0.00 0.00 175.52 175.37 1nb4 h GLN 330 N -0.69 0.53 -0.48 6.66 5.75 -2.00 -2.03 115.11 122.85 1nb4 h GLN 330 Ca -0.00 -0.12 -0.05 0.00 -0.15 0.00 0.00 58.65 58.32 1nb4 h GLN 330 Cb 0.66 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.12 1nb4 h GLN 330 CO -0.13 0.58 0.08 1.05 -2.65 0.00 0.00 178.83 177.76 1nb4 h GLU 331 N 0.38 0.75 -0.54 1.69 9.09 -1.82 -2.04 114.58 122.09 1nb4 h GLU 331 Ca 0.11 -0.16 -0.11 0.00 0.05 0.00 0.00 59.36 59.25 1nb4 h GLU 331 Cb 0.29 -0.11 -0.02 0.00 -1.65 0.00 0.00 28.75 27.26 1nb4 h GLU 331 CO 0.00 0.71 -0.08 -0.44 0.05 0.00 0.00 179.01 179.25 1nb4 h ASP 332 N 0.72 0.98 -0.15 3.06 3.45 -0.94 -1.46 116.42 122.08 1nb4 h ASP 332 Ca 0.15 -0.31 -0.02 0.00 0.43 0.00 0.00 57.03 57.28 1nb4 h ASP 332 Cb 0.33 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.83 1nb4 h ASP 332 CO 0.00 1.08 0.00 0.00 -1.57 0.00 0.00 179.24 178.76 1nb4 h ALA 333 N 1.01 0.21 -0.76 3.45 0.00 -1.05 -0.96 119.26 121.15 1nb4 h ALA 333 Ca 0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1nb4 h ALA 333 Cb 0.63 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1nb4 h ALA 333 CO 0.04 -0.10 0.42 0.00 0.00 0.00 0.00 179.25 179.62 1nb4 h ALA 334 N 0.77 0.97 -0.05 0.00 0.00 -1.33 -1.61 119.26 118.01 1nb4 h ALA 334 Ca 0.04 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 1nb4 h ALA 334 Cb 0.36 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1nb4 h ALA 334 CO 0.01 0.48 -0.42 0.00 0.00 0.00 0.00 179.25 179.32 1nb4 h ALA 335 N 1.22 1.21 -0.22 0.00 0.00 -1.16 -1.63 119.26 118.68 1nb4 h ALA 335 Ca 0.27 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1nb4 h ALA 335 Cb 0.03 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1nb4 h ALA 335 CO -0.04 0.56 -0.30 1.25 0.00 0.00 0.00 179.25 180.72 1nb4 h LEU 336 N 0.10 0.64 -1.03 0.00 5.85 -0.76 -0.98 115.31 119.13 1nb4 h LEU 336 Ca 0.01 -0.51 0.09 0.00 0.84 0.00 0.00 57.88 58.31 1nb4 h LEU 336 Cb 0.78 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.56 1nb4 h LEU 336 CO 0.06 1.02 0.64 0.03 -0.34 0.00 0.00 178.44 179.85 1nb4 h ARG 337 N 0.28 1.04 -0.42 1.25 2.47 -1.09 -1.35 114.38 116.55 1nb4 h ARG 337 Ca 0.02 -0.06 -0.12 0.00 -1.26 0.00 0.00 59.98 58.57 1nb4 h ARG 337 Cb 0.88 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.95 1nb4 h ARG 337 CO 0.07 0.69 -0.21 0.00 0.56 0.00 0.00 179.97 181.08 1nb4 h ALA 338 N 1.50 0.85 -0.43 0.04 0.00 -1.12 -2.19 119.26 117.91 1nb4 h ALA 338 Ca 0.46 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1nb4 h ALA 338 Cb 0.32 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1nb4 h ALA 338 CO -0.21 0.64 0.27 0.35 0.00 0.00 0.00 179.25 180.29 1nb4 h PHE 339 N 0.72 0.56 -0.93 0.00 3.57 -0.44 -1.92 116.94 118.50 1nb4 h PHE 339 Ca 0.10 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1nb4 h PHE 339 Cb 0.73 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 39.24 1nb4 h PHE 339 CO 0.04 0.39 0.60 1.15 -2.23 0.00 0.00 178.31 178.25 1nb4 h THR 340 N 0.57 1.25 -0.64 4.41 2.02 -1.05 -1.12 112.91 118.34 1nb4 h THR 340 Ca 0.16 -0.49 -0.07 0.00 0.77 0.00 0.00 66.41 66.78 1nb4 h THR 340 Cb -0.02 -0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.26 1nb4 h THR 340 CO -0.03 0.25 0.12 -0.33 0.37 0.00 0.00 175.52 175.90 1nb4 h GLU 341 N 1.28 1.04 -0.13 6.66 4.39 -1.03 0.16 114.58 126.94 1nb4 h GLU 341 Ca 0.34 -0.26 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1nb4 h GLU 341 Cb -0.11 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.40 1nb4 h GLU 341 CO -0.07 0.95 0.05 0.00 -1.16 0.00 0.00 179.01 178.77 1nb4 h ALA 342 N 1.14 0.17 -1.00 3.43 0.00 -0.68 -1.31 119.26 121.00 1nb4 h ALA 342 Ca 0.20 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1nb4 h ALA 342 Cb 0.40 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 1nb4 h ALA 342 CO 0.01 -0.24 0.66 0.52 0.00 0.00 0.00 179.25 180.20 1nb4 h MET 343 N 0.04 1.24 -0.85 0.00 2.86 -1.07 -1.84 114.93 115.31 1nb4 h MET 343 Ca 0.04 -0.07 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1nb4 h MET 343 Cb 0.19 -0.28 -0.05 0.00 0.06 0.00 0.00 31.60 31.52 1nb4 h MET 343 CO -0.00 0.82 0.56 1.15 1.06 0.00 0.00 176.91 180.49 1nb4 h THR 344 N 1.28 1.17 -0.02 2.22 2.02 -0.65 0.72 112.91 119.64 1nb4 h THR 344 Ca 0.39 -0.38 -0.07 0.00 0.77 0.00 0.00 66.41 67.13 1nb4 h THR 344 Cb -0.02 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.35 1nb4 h THR 344 CO -0.12 0.20 -0.32 0.03 0.37 0.00 0.00 175.52 175.68 1nb4 h ARG 345 N 1.10 0.03 -0.02 6.66 3.08 -0.46 -1.94 114.38 122.83 1nb4 h ARG 345 Ca 0.33 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1nb4 h ARG 345 Cb -0.04 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1nb4 h ARG 345 CO -0.10 0.35 0.00 0.66 -1.07 0.00 0.00 179.97 179.81 1nb4 n TYR 346 N -4.15 0.02 -2.32 3.04 0.53 -0.41 -1.00 117.16 112.87 1nb4 n TYR 346 Ca -0.02 -0.01 -0.04 0.00 -1.02 0.00 0.00 57.90 56.81 1nb4 n TYR 346 Cb 0.37 0.00 0.02 0.00 -1.03 0.00 0.00 39.34 38.70 1nb4 n TYR 346 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 1nb4 n SER 347 N -0.64 -2.07 -3.02 7.72 2.88 -0.73 -4.89 113.62 112.87 1nb4 n SER 347 Ca 0.19 -0.15 -0.15 0.00 -1.33 0.00 0.00 58.87 57.43 1nb4 n SER 347 Cb 0.14 -1.62 0.01 0.00 -0.75 0.00 0.00 64.21 62.00 1nb4 n SER 347 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nb4 n ALA 348 N -1.76 1.00 -1.71 -1.46 0.00 0.11 -4.69 120.51 112.00 1nb4 n ALA 348 Ca -0.07 -2.69 -0.35 0.00 0.00 0.00 0.00 53.44 50.33 1nb4 n ALA 348 Cb 0.54 -1.01 0.03 0.00 0.00 0.00 0.00 19.45 19.00 1nb4 n ALA 348 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1nb4 s PRO 349 N -1.46 3.06 0.49 0.00 0.04 -1.26 -4.02 135.00 131.86 1nb4 s PRO 349 Ca 0.33 1.69 -0.19 0.00 0.04 0.00 0.00 61.00 62.88 1nb4 s PRO 349 Cb 0.33 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.83 1nb4 s PRO 349 CO -0.07 -1.10 1.01 -1.25 0.04 0.00 0.00 177.00 175.63 1nb4 s PRO 350 N -3.42 3.86 -0.04 0.56 0.04 -1.26 -2.90 135.00 131.83 1nb4 s PRO 350 Ca 0.74 1.20 -0.11 0.00 0.04 0.00 0.00 61.00 62.87 1nb4 s PRO 350 Cb -0.27 -2.11 -0.06 0.00 0.04 0.00 0.00 34.50 32.10 1nb4 s PRO 350 CO 0.32 -0.36 0.49 0.78 0.04 0.00 0.00 177.00 178.27 1nb4 h GLY 351 N 1.35 -0.41 -4.83 0.56 0.00 -1.16 -3.40 103.07 95.18 1nb4 h GLY 351 Ca -0.48 0.15 -0.54 0.00 0.00 0.00 0.00 47.33 46.46 1nb4 h GLY 351 CO 0.60 -0.15 -0.83 0.99 0.00 0.00 0.00 176.54 177.15 1nb4 s ASP 352 N -4.75 2.08 0.32 0.19 1.01 -1.26 -4.93 116.67 109.33 1nb4 s ASP 352 Ca -0.06 -0.36 -0.28 0.00 0.71 0.00 0.00 52.55 52.56 1nb4 s ASP 352 Cb 0.01 -0.21 -0.13 0.00 1.01 0.00 0.00 42.92 43.60 1nb4 s ASP 352 CO 0.17 0.19 1.25 -2.65 0.21 0.00 0.00 175.17 174.34 1nb4 n PRO 353 N 2.44 1.97 -0.83 8.23 -0.02 -1.26 -4.78 135.00 140.75 1nb4 n PRO 353 Ca -0.15 0.69 -0.31 0.00 -2.02 0.00 0.00 63.50 61.71 1nb4 n PRO 353 Cb 0.54 -2.24 0.15 0.00 -0.02 0.00 0.00 33.50 31.93 1nb4 n PRO 353 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1nb4 s PRO 354 N -1.68 1.25 -0.04 0.52 0.04 -1.26 -5.04 135.00 128.78 1nb4 s PRO 354 Ca 0.57 1.42 0.01 0.00 0.04 0.00 0.00 61.00 63.04 1nb4 s PRO 354 Cb -0.60 -1.76 0.02 0.00 0.04 0.00 0.00 34.50 32.20 1nb4 s PRO 354 CO 0.61 -2.43 -0.03 -1.14 0.04 0.00 0.00 177.00 174.05 1nb4 s GLN 355 N -4.71 0.65 0.34 4.56 2.00 -1.26 -5.00 119.66 116.23 1nb4 s GLN 355 Ca 0.65 -0.04 -0.28 0.00 -2.00 0.00 0.00 55.36 53.69 1nb4 s GLN 355 Cb -0.21 -0.72 -0.10 0.00 0.80 0.00 0.00 33.01 32.78 1nb4 s GLN 355 CO 0.58 -0.10 1.32 -1.25 -0.50 0.00 0.00 175.29 175.33 1nb4 s PRO 356 N 0.95 4.31 -0.01 1.67 0.04 -1.26 -4.59 135.00 136.11 1nb4 s PRO 356 Ca -0.11 2.23 0.03 0.00 0.04 0.00 0.00 61.00 63.19 1nb4 s PRO 356 Cb -0.14 -3.04 -0.01 0.00 0.04 0.00 0.00 34.50 31.35 1nb4 s PRO 356 CO -0.00 -0.23 -0.10 -2.00 0.04 0.00 0.00 177.00 174.70 1nb4 s GLU 357 N -1.85 0.85 0.00 4.56 2.56 0.66 -4.97 118.70 120.51 1nb4 s GLU 357 Ca 0.50 -0.35 0.12 0.00 0.00 0.00 0.00 54.97 55.24 1nb4 s GLU 357 Cb -0.40 -0.81 0.13 0.00 2.00 0.00 0.00 34.13 35.05 1nb4 s GLU 357 CO 0.53 0.20 0.95 0.66 -0.56 0.00 0.00 175.26 177.04 1nb4 n TYR 358 N 2.90 0.07 -4.21 5.30 4.02 -1.26 -0.71 117.16 123.27 1nb4 n TYR 358 Ca -0.14 -0.07 -0.31 0.00 -0.01 0.00 0.00 57.90 57.37 1nb4 n TYR 358 Cb 0.56 -0.00 -0.16 0.00 -0.02 0.00 0.00 39.34 39.71 1nb4 n TYR 358 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1nb4 s ASP 359 N -1.03 2.88 0.31 7.72 2.15 -1.26 -4.96 116.67 122.48 1nb4 s ASP 359 Ca 0.16 -0.56 0.06 0.00 0.43 0.00 0.00 52.55 52.65 1nb4 s ASP 359 Cb 0.11 -1.32 0.74 0.00 -0.30 0.00 0.00 42.92 42.16 1nb4 s ASP 359 CO 0.16 -0.01 1.80 0.25 -0.17 0.00 0.00 175.17 177.21 1nb4 h LEU 360 N 7.82 0.77 -2.44 -1.34 5.85 -1.97 0.88 115.31 124.88 1nb4 h LEU 360 Ca -0.39 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 1nb4 h LEU 360 Cb 1.15 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 1nb4 h LEU 360 CO 0.57 0.32 -0.00 -0.08 -0.34 0.00 0.00 178.44 178.90 1nb4 h GLU 361 N 0.77 0.00 -0.06 1.25 4.81 -1.96 -2.57 114.58 116.83 1nb4 h GLU 361 Ca 0.54 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.77 1nb4 h GLU 361 Cb 0.83 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.21 1nb4 h GLU 361 CO -0.32 0.00 0.00 1.28 -0.73 0.00 0.00 179.01 179.24 1nb4 n LEU 362 N -3.11 0.83 -4.63 1.64 4.32 0.30 -4.55 117.00 111.81 1nb4 n LEU 362 Ca -0.02 -0.32 -0.38 0.00 -0.02 0.00 0.00 56.01 55.27 1nb4 n LEU 362 Cb 0.16 -0.03 -0.10 0.00 -1.62 0.00 0.00 43.42 41.82 1nb4 n LEU 362 CO 0.23 0.16 -0.11 -0.63 -1.22 0.00 0.00 177.39 175.82 1nb4 s ILE 363 N -1.93 5.29 -0.07 -0.08 1.01 -0.97 -5.05 121.20 119.40 1nb4 s ILE 363 Ca 0.35 0.29 0.02 0.00 0.00 0.00 0.00 60.65 61.31 1nb4 s ILE 363 Cb 0.17 -3.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.05 1nb4 s ILE 363 CO 0.28 0.27 -0.11 0.28 0.00 0.00 0.00 174.94 175.66 1nb4 s THR 364 N 1.52 3.31 -0.19 2.92 -1.32 -1.26 -4.41 115.64 116.21 1nb4 s THR 364 Ca 0.10 -0.62 -0.24 0.00 -1.21 0.00 0.00 61.69 59.72 1nb4 s THR 364 Cb -0.15 -2.34 0.06 0.00 -1.51 0.00 0.00 72.50 68.57 1nb4 s THR 364 CO 0.08 0.58 0.63 -0.55 -2.21 0.00 0.00 174.62 173.16 1nb4 s SER 365 N -0.55 -0.64 -1.30 8.08 0.15 -0.08 -4.74 113.70 114.62 1nb4 s SER 365 Ca 0.08 1.10 -0.03 0.00 0.70 0.00 0.00 55.95 57.80 1nb4 s SER 365 Cb -0.12 1.09 0.00 0.00 -1.71 0.00 0.00 66.02 65.29 1nb4 s SER 365 CO 0.02 -0.32 0.43 0.00 1.20 0.00 0.00 173.24 174.56 1nb4 n SER 367 N -1.65 -4.72 -4.38 0.00 7.64 -1.26 -4.95 113.62 104.30 1nb4 n SER 367 Ca -0.11 0.34 -0.19 0.00 1.01 0.00 0.00 58.87 59.92 1nb4 n SER 367 Cb 0.61 -3.91 -0.10 0.00 -1.01 0.00 0.00 64.21 59.80 1nb4 n SER 367 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1nb4 s SER 368 N -2.31 2.19 0.04 6.43 1.04 -0.70 -4.57 113.70 115.82 1nb4 s SER 368 Ca 0.00 -1.23 -0.06 0.00 0.48 0.00 0.00 55.95 55.14 1nb4 s SER 368 Cb 0.00 -0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.05 1nb4 s SER 368 CO 0.00 -0.48 0.10 0.54 0.98 0.00 0.00 173.24 174.39 1nb4 s ASN 369 N -3.37 0.17 0.22 7.02 4.22 -0.29 -0.90 114.94 122.00 1nb4 s ASN 369 Ca 0.30 -0.52 -0.29 0.00 -2.14 0.00 0.00 52.86 50.21 1nb4 s ASN 369 Cb 0.06 0.23 -0.09 0.00 1.28 0.00 0.00 41.25 42.73 1nb4 s ASN 369 CO 0.11 -0.51 0.91 -0.69 -2.04 0.00 0.00 177.10 174.88 1nb4 s VAL 370 N -2.58 4.15 0.30 3.54 1.01 -1.26 -1.79 120.40 123.77 1nb4 s VAL 370 Ca -0.05 2.03 0.05 0.00 0.00 0.00 0.00 61.98 64.00 1nb4 s VAL 370 Cb -0.01 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 1nb4 s VAL 370 CO -0.04 0.49 0.22 -0.55 0.00 0.00 0.00 175.10 175.21 1nb4 s SER 371 N -1.08 1.42 0.01 3.32 0.15 0.21 -4.42 113.70 113.31 1nb4 s SER 371 Ca 0.41 -1.64 0.07 0.00 0.70 0.00 0.00 55.95 55.48 1nb4 s SER 371 Cb -0.25 0.49 -0.02 0.00 -1.71 0.00 0.00 66.02 64.52 1nb4 s SER 371 CO 0.31 -0.98 -0.20 -0.69 1.20 0.00 0.00 173.24 172.88 1nb4 s VAL 372 N -3.61 1.63 0.17 4.45 1.01 -1.26 -1.24 120.40 121.55 1nb4 s VAL 372 Ca 0.38 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 61.39 1nb4 s VAL 372 Cb 0.04 -1.38 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 1nb4 s VAL 372 CO 0.22 0.34 0.16 0.00 0.00 0.00 0.00 175.10 175.82 1nb4 n ALA 373 N 2.26 0.29 -2.50 5.51 0.00 -0.71 -3.28 120.51 122.08 1nb4 n ALA 373 Ca -0.16 -0.98 -0.25 0.00 0.00 0.00 0.00 53.44 52.05 1nb4 n ALA 373 Cb 0.53 0.79 -0.15 0.00 0.00 0.00 0.00 19.45 20.62 1nb4 n ALA 373 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1nb4 s HIS 374 N -2.87 1.64 0.48 0.00 3.76 -1.26 -0.86 115.29 116.17 1nb4 s HIS 374 Ca 0.20 -0.32 -0.07 0.00 -0.15 0.00 0.00 55.06 54.72 1nb4 s HIS 374 Cb 0.01 -1.06 0.11 0.00 1.11 0.00 0.00 32.58 32.75 1nb4 s HIS 374 CO 0.14 -0.04 0.66 -0.40 -0.85 0.00 0.00 174.74 174.25 1nb4 n ASP 375 N 2.66 0.18 -0.11 1.40 5.75 -0.50 -1.55 116.55 124.37 1nb4 n ASP 375 Ca -0.15 -1.32 -0.07 0.00 -0.01 0.00 0.00 54.79 53.25 1nb4 n ASP 375 Cb 0.54 -0.49 -0.01 0.00 -1.03 0.00 0.00 41.12 40.13 1nb4 n ASP 375 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nb4 h ALA 376 N -1.63 -0.08 -0.17 2.12 0.00 -1.91 -1.25 119.26 116.35 1nb4 h ALA 376 Ca -0.21 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1nb4 h ALA 376 Cb 0.62 0.62 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1nb4 h ALA 376 CO 0.16 -0.67 0.07 0.66 0.00 0.00 0.00 179.25 179.47 1nb4 h SER 377 N -0.21 0.20 0.00 0.00 4.64 -1.96 -3.46 113.55 112.76 1nb4 h SER 377 Ca 0.18 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1nb4 h SER 377 Cb 0.51 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1nb4 h SER 377 CO -0.51 0.19 0.00 0.61 -0.87 0.00 0.00 176.83 176.24 1nb4 n GLY 378 N -1.39 0.91 3.81 -0.77 0.00 -0.47 -5.11 105.19 102.17 1nb4 n GLY 378 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1nb4 n GLY 378 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nb4 s LYS 379 N -0.21 4.31 0.16 1.61 2.20 -1.26 -4.67 119.74 121.88 1nb4 s LYS 379 Ca 0.00 1.13 -0.31 0.00 -0.36 0.00 0.00 55.97 56.42 1nb4 s LYS 379 Cb 0.00 -2.42 -0.11 0.00 -1.51 0.00 0.00 37.83 33.80 1nb4 s LYS 379 CO 0.00 0.10 1.73 1.03 -0.36 0.00 0.00 175.35 177.85 1nb4 s ARG 380 N -2.77 4.15 -0.06 4.03 0.52 -1.26 -1.41 118.95 122.14 1nb4 s ARG 380 Ca 0.57 2.54 0.02 0.00 -0.52 0.00 0.00 55.73 58.34 1nb4 s ARG 380 Cb -0.12 -3.34 0.01 0.00 0.52 0.00 0.00 34.95 32.02 1nb4 s ARG 380 CO 0.17 -0.76 -0.12 0.08 0.02 0.00 0.00 175.30 174.68 1nb4 s VAL 381 N 1.91 1.12 0.20 3.52 1.01 -0.04 -4.92 120.40 123.21 1nb4 s VAL 381 Ca 0.76 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 62.22 1nb4 s VAL 381 Cb -0.46 -1.02 -0.06 0.00 0.00 0.00 0.00 36.38 34.84 1nb4 s VAL 381 CO 0.34 0.35 0.45 -0.31 0.00 0.00 0.00 175.10 175.93 1nb4 s TYR 382 N 0.61 3.47 0.22 5.22 1.51 -1.26 -1.74 117.35 125.37 1nb4 s TYR 382 Ca -0.14 0.59 -0.22 0.00 -1.01 0.00 0.00 57.07 56.29 1nb4 s TYR 382 Cb -0.15 -2.04 0.05 0.00 -0.11 0.00 0.00 41.96 39.70 1nb4 s TYR 382 CO 0.03 0.33 0.69 1.52 -1.11 0.00 0.00 175.55 177.02 1nb4 s TYR 383 N -1.82 -0.33 -0.04 2.71 1.13 -0.38 -4.98 117.35 113.63 1nb4 s TYR 383 Ca 0.42 -0.01 -0.15 0.00 -1.41 0.00 0.00 57.07 55.93 1nb4 s TYR 383 Cb -0.11 0.64 -0.05 0.00 -1.10 0.00 0.00 41.96 41.33 1nb4 s TYR 383 CO 0.26 -1.04 0.39 -0.51 -2.51 0.00 0.00 175.55 172.14 1nb4 s LEU 384 N -2.84 4.42 0.00 -3.49 1.43 -1.26 -0.62 118.68 116.32 1nb4 s LEU 384 Ca 0.07 0.86 0.02 0.00 -1.03 0.00 0.00 54.13 54.05 1nb4 s LEU 384 Cb -0.04 -2.55 -0.01 0.00 0.03 0.00 0.00 46.19 43.63 1nb4 s LEU 384 CO -0.02 0.26 0.37 1.07 0.23 0.00 0.00 176.35 178.26 1nb4 n THR 385 N 2.29 0.00 -3.75 5.49 5.66 -0.74 -4.74 114.28 118.49 1nb4 n THR 385 Ca -0.13 -1.92 -0.07 0.00 -3.05 0.00 0.00 64.05 58.88 1nb4 n THR 385 Cb 0.52 1.07 -0.02 0.00 -1.55 0.00 0.00 70.33 70.35 1nb4 n THR 385 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nb4 s ARG 386 N -2.97 1.51 0.25 1.09 1.70 -1.26 -1.13 118.95 118.14 1nb4 s ARG 386 Ca 0.31 -0.79 -0.31 0.00 -0.47 0.00 0.00 55.73 54.48 1nb4 s ARG 386 Cb 0.00 0.54 -0.11 0.00 -0.57 0.00 0.00 34.95 34.81 1nb4 s ARG 386 CO 0.22 -0.69 1.60 0.34 -1.08 0.00 0.00 175.30 175.70 1nb4 s ASP 387 N -2.87 6.44 -0.03 -2.89 2.15 -1.26 -4.89 116.67 113.31 1nb4 s ASP 387 Ca 0.09 2.85 0.12 0.00 0.43 0.00 0.00 52.55 56.04 1nb4 s ASP 387 Cb -0.04 -2.62 0.40 0.00 -0.30 0.00 0.00 42.92 40.36 1nb4 s ASP 387 CO 0.02 -0.88 1.29 -0.81 -0.17 0.00 0.00 175.17 174.61 1nb4 n PRO 388 N 2.83 2.29 0.01 4.34 -0.04 -1.26 -4.48 135.00 138.69 1nb4 n PRO 388 Ca 0.10 -1.59 -0.11 0.00 -0.04 0.00 0.00 63.50 61.87 1nb4 n PRO 388 Cb 0.37 -1.48 -0.04 0.00 -0.04 0.00 0.00 33.50 32.31 1nb4 n PRO 388 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1nb4 h THR 389 N 2.43 0.30 -0.18 0.52 2.02 -1.95 0.02 112.91 116.06 1nb4 h THR 389 Ca 0.00 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.13 1nb4 h THR 389 Cb 0.76 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1nb4 h THR 389 CO 0.07 0.00 -0.07 0.74 0.37 0.00 0.00 175.52 176.63 1nb4 h THR 390 N -0.40 1.30 -0.61 3.16 2.02 -1.95 -2.08 112.91 114.35 1nb4 h THR 390 Ca 0.09 -1.09 0.07 0.00 0.77 0.00 0.00 66.41 66.25 1nb4 h THR 390 Cb 0.54 1.64 -0.06 0.00 -1.74 0.00 0.00 68.15 68.53 1nb4 h THR 390 CO -0.34 0.33 0.30 -0.65 0.37 0.00 0.00 175.52 175.53 1nb4 h PRO 391 N 0.07 0.54 -0.68 6.66 0.11 -1.80 -0.41 132.00 136.48 1nb4 h PRO 391 Ca 0.04 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.08 1nb4 h PRO 391 Cb 0.53 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 31.49 1nb4 h PRO 391 CO 0.02 0.35 0.25 -0.07 -0.21 0.00 0.00 178.00 178.35 1nb4 h LEU 392 N 0.55 0.95 -0.25 2.35 3.38 -0.87 -0.80 115.31 120.62 1nb4 h LEU 392 Ca 0.28 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1nb4 h LEU 392 Cb 0.24 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1nb4 h LEU 392 CO -0.21 0.88 0.17 0.00 0.09 0.00 0.00 178.44 179.36 1nb4 h ALA 393 N 1.11 0.32 -0.29 1.53 0.00 -0.96 -0.78 119.26 120.18 1nb4 h ALA 393 Ca 0.22 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 1nb4 h ALA 393 Cb 0.24 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1nb4 h ALA 393 CO -0.01 -0.21 -0.26 0.00 0.00 0.00 0.00 179.25 178.77 1nb4 h ARG 394 N 0.34 0.58 -0.38 0.00 3.08 -0.96 -1.85 114.38 115.19 1nb4 h ARG 394 Ca 0.09 -0.23 -0.07 0.00 0.07 0.00 0.00 59.98 59.83 1nb4 h ARG 394 Cb -0.04 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1nb4 h ARG 394 CO -0.02 0.79 -0.08 0.00 -1.07 0.00 0.00 179.97 179.59 1nb4 h ALA 395 N 1.21 1.16 -0.23 0.04 0.00 -0.87 -1.08 119.26 119.50 1nb4 h ALA 395 Ca 0.07 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.54 1nb4 h ALA 395 Cb 0.72 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1nb4 h ALA 395 CO 0.06 0.54 -0.54 0.00 0.00 0.00 0.00 179.25 179.30 1nb4 h ALA 396 N 1.33 0.62 -0.57 0.00 0.00 -0.69 -2.20 119.26 117.75 1nb4 h ALA 396 Ca 0.11 -0.51 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 1nb4 h ALA 396 Cb 0.49 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1nb4 h ALA 396 CO 0.03 0.69 0.20 2.35 0.00 0.00 0.00 179.25 182.52 1nb4 h TRP 397 N 0.52 0.89 0.00 0.00 2.91 -0.98 -2.62 115.95 116.67 1nb4 h TRP 397 Ca 0.01 -0.08 0.00 0.00 1.13 0.00 0.00 58.89 59.95 1nb4 h TRP 397 Cb 1.11 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 29.50 1nb4 h TRP 397 CO 0.06 0.73 0.00 0.39 -1.03 0.00 0.00 178.44 178.59 1nb4 n GLU 398 N -4.46 0.14 0.06 2.65 1.02 -0.44 -1.19 120.64 118.42 1nb4 n GLU 398 Ca 0.03 0.07 -0.21 0.00 -0.02 0.00 0.00 57.16 57.03 1nb4 n GLU 398 Cb 0.18 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 29.96 1nb4 n GLU 398 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1nb4 h THR 399 N 0.00 0.95 0.00 2.62 2.02 -1.02 -3.39 112.91 114.09 1nb4 h THR 399 Ca 0.00 -2.57 -0.24 0.00 0.77 0.00 0.00 66.41 64.37 1nb4 h THR 399 Cb 0.34 2.73 -0.04 0.00 -1.74 0.00 0.00 68.15 69.44 1nb4 h THR 399 CO 0.00 0.84 -1.44 0.00 0.37 0.00 0.00 175.52 175.30 1nb4 h ALA 400 N 0.23 0.66 -3.22 6.16 0.00 -1.31 -3.45 119.26 118.34 1nb4 h ALA 400 Ca -0.33 -1.17 -0.60 0.00 0.00 0.00 0.00 54.91 52.82 1nb4 h ALA 400 Cb 2.07 0.29 -0.36 0.00 0.00 0.00 0.00 17.79 19.79 1nb4 h ALA 400 CO 0.16 1.32 -0.82 1.03 0.00 0.00 0.00 179.25 180.94 1nb4 s ARG 401 N -2.71 2.14 -0.43 0.00 0.52 -0.34 -5.00 118.95 113.13 1nb4 s ARG 401 Ca -0.03 -0.62 -0.27 0.00 -0.52 0.00 0.00 55.73 54.29 1nb4 s ARG 401 Cb 0.08 -2.16 -0.04 0.00 0.52 0.00 0.00 34.95 33.35 1nb4 s ARG 401 CO 0.82 -0.30 2.05 -1.58 0.02 0.00 0.00 175.30 176.30 1nb4 s HIS 402 N 1.48 1.46 0.24 -0.53 5.65 -1.26 -4.37 115.29 117.96 1nb4 s HIS 402 Ca 0.03 0.90 0.05 0.00 0.25 0.00 0.00 55.06 56.29 1nb4 s HIS 402 Cb -0.14 -3.94 -0.03 0.00 -1.18 0.00 0.00 32.58 27.29 1nb4 s HIS 402 CO -0.10 -2.88 0.33 0.95 -0.65 0.00 0.00 174.74 172.40 1nb4 s THR 403 N 9.10 5.08 0.05 0.89 -4.23 -1.26 -5.07 115.64 120.20 1nb4 s THR 403 Ca 0.85 -1.07 -0.28 0.00 -1.18 0.00 0.00 61.69 60.00 1nb4 s THR 403 Cb -0.20 -3.76 -0.17 0.00 1.34 0.00 0.00 72.50 69.70 1nb4 s THR 403 CO 0.28 -0.33 1.51 1.55 -0.54 0.00 0.00 174.62 177.09 1nb4 h PRO 404 N 1.23 -0.56 -5.52 3.99 0.13 -1.96 -3.43 132.00 125.88 1nb4 h PRO 404 Ca -0.51 0.04 -0.64 0.00 -0.87 0.00 0.00 66.00 64.01 1nb4 h PRO 404 Cb 1.23 0.13 -0.12 0.00 0.13 0.00 0.00 31.00 32.37 1nb4 h PRO 404 CO 0.61 -0.32 -0.53 -1.50 -0.23 0.00 0.00 178.00 176.03 1nb4 s ILE 405 N -5.60 5.08 -1.04 -3.56 2.07 -1.26 -4.60 121.20 112.30 1nb4 s ILE 405 Ca -0.16 0.06 -0.11 0.00 -1.41 0.00 0.00 60.65 59.04 1nb4 s ILE 405 Cb 0.03 -3.25 0.26 0.00 0.13 0.00 0.00 42.46 39.63 1nb4 s ILE 405 CO 0.60 0.54 1.04 0.20 -1.91 0.00 0.00 174.94 175.40 1nb4 s ASN 406 N -0.33 7.15 0.60 4.50 0.01 0.02 -4.93 114.94 121.97 1nb4 s ASN 406 Ca 0.10 -3.30 0.31 0.00 -0.71 0.00 0.00 52.86 49.25 1nb4 s ASN 406 Cb -0.12 -2.22 1.77 0.00 0.41 0.00 0.00 41.25 41.09 1nb4 s ASN 406 CO 0.01 -0.40 2.15 0.77 -1.51 0.00 0.00 177.10 178.13 1nb4 h SER 407 N 7.02 0.00 -0.47 -1.22 4.64 -1.93 -1.46 113.55 120.14 1nb4 h SER 407 Ca 0.17 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.43 1nb4 h SER 407 Cb 0.92 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.99 1nb4 h SER 407 CO 0.96 0.00 0.09 4.11 -0.87 0.00 0.00 176.83 181.12 1nb4 h TRP 408 N 0.00 0.86 -0.23 4.77 5.08 -1.91 0.17 115.95 124.70 1nb4 h TRP 408 Ca 0.05 -0.09 -0.16 0.00 1.08 0.00 0.00 58.89 59.77 1nb4 h TRP 408 Cb 0.33 -0.25 -0.01 0.00 -3.00 0.00 0.00 29.16 26.24 1nb4 h TRP 408 CO 0.00 0.75 -0.52 1.25 -1.28 0.00 0.00 178.44 178.64 1nb4 h LEU 409 N 0.79 0.71 -0.76 0.11 5.85 -1.66 -0.90 115.31 119.45 1nb4 h LEU 409 Ca 0.17 -0.37 -0.10 0.00 0.84 0.00 0.00 57.88 58.42 1nb4 h LEU 409 Cb 0.35 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1nb4 h LEU 409 CO 0.01 1.10 -0.14 1.23 -0.34 0.00 0.00 178.44 180.29 1nb4 h GLY 410 N 0.97 0.86 1.27 3.75 0.00 -1.36 -1.81 103.07 106.75 1nb4 h GLY 410 Ca 0.02 -0.67 -0.15 0.00 0.00 0.00 0.00 47.33 46.52 1nb4 h GLY 410 CO 0.10 0.62 -0.39 3.43 0.00 0.00 0.00 176.54 180.30 1nb4 h ASN 411 N 0.71 0.85 -0.56 0.19 2.35 -0.44 0.12 115.58 118.80 1nb4 h ASN 411 Ca 0.11 -0.38 -0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1nb4 h ASN 411 Cb 0.63 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.74 1nb4 h ASN 411 CO 0.04 1.13 0.34 0.40 -1.65 0.00 0.00 177.43 177.69 1nb4 h ILE 412 N 0.65 1.17 -0.24 2.81 2.04 -1.00 0.18 117.51 123.12 1nb4 h ILE 412 Ca 0.05 -0.38 -0.08 0.00 1.00 0.00 0.00 64.86 65.45 1nb4 h ILE 412 Cb 0.95 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1nb4 h ILE 412 CO 0.09 0.17 -0.16 0.40 0.00 0.00 0.00 178.15 178.65 1nb4 h ILE 413 N 0.75 1.31 0.00 -0.67 2.04 -1.05 -1.54 117.51 118.35 1nb4 h ILE 413 Ca 0.20 -1.28 -0.18 0.00 1.00 0.00 0.00 64.86 64.59 1nb4 h ILE 413 Cb -0.01 1.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 1nb4 h ILE 413 CO -0.04 0.40 -0.88 0.24 0.00 0.00 0.00 178.15 177.87 1nb4 h MET 414 N 0.24 0.00 -0.15 2.37 2.86 -0.68 -3.34 114.93 116.23 1nb4 h MET 414 Ca 0.05 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.62 1nb4 h MET 414 Cb 0.69 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.31 1nb4 h MET 414 CO 0.04 0.88 -0.27 0.66 1.06 0.00 0.00 176.91 179.29 1nb4 n TYR 415 N -3.44 0.47 -0.09 -0.22 4.02 0.62 -4.84 117.16 113.68 1nb4 n TYR 415 Ca -0.00 -1.47 0.25 0.00 -0.01 0.00 0.00 57.90 56.67 1nb4 n TYR 415 Cb 0.85 -0.34 0.72 0.00 -0.02 0.00 0.00 39.34 40.55 1nb4 n TYR 415 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1nb4 h ALA 416 N 0.95 2.64 0.00 -0.72 0.00 -1.41 -1.43 119.26 119.30 1nb4 h ALA 416 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1nb4 h ALA 416 Cb 1.28 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1nb4 h ALA 416 CO 0.16 -0.91 -0.01 -2.30 0.00 0.00 0.00 179.25 176.20 1nb4 n PRO 417 N -4.22 0.05 -2.00 0.00 -0.02 -1.26 -4.58 135.00 122.97 1nb4 n PRO 417 Ca 0.14 0.04 -0.32 0.00 -2.02 0.00 0.00 63.50 61.34 1nb4 n PRO 417 Cb 0.81 -1.56 0.01 0.00 -0.02 0.00 0.00 33.50 32.74 1nb4 n PRO 417 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1nb4 s THR 418 N -3.02 4.08 0.23 3.45 -4.23 -0.54 -4.93 115.64 110.67 1nb4 s THR 418 Ca 0.13 0.89 -0.07 0.00 -1.18 0.00 0.00 61.69 61.46 1nb4 s THR 418 Cb 0.18 -3.49 0.19 0.00 1.34 0.00 0.00 72.50 70.71 1nb4 s THR 418 CO 0.55 -0.67 1.83 0.25 -0.54 0.00 0.00 174.62 176.03 1nb4 h LEU 419 N 0.23 1.12 0.02 4.79 5.85 -1.91 -2.40 115.31 123.01 1nb4 h LEU 419 Ca -0.46 -0.12 -0.24 0.00 0.84 0.00 0.00 57.88 57.90 1nb4 h LEU 419 Cb 1.21 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 1nb4 h LEU 419 CO 0.58 0.93 -1.10 4.11 -0.34 0.00 0.00 178.44 182.62 1nb4 h TRP 420 N 1.23 0.27 -0.12 1.25 5.08 -1.93 -2.25 115.95 119.48 1nb4 h TRP 420 Ca 0.30 -0.19 -0.18 0.00 1.08 0.00 0.00 58.89 59.90 1nb4 h TRP 420 Cb 0.09 -0.01 -0.00 0.00 -3.00 0.00 0.00 29.16 26.23 1nb4 h TRP 420 CO 0.01 1.13 -0.66 0.00 -1.28 0.00 0.00 178.44 177.64 1nb4 h ALA 421 N 0.80 0.62 -0.01 0.11 0.00 -1.78 -1.86 119.26 117.15 1nb4 h ALA 421 Ca -0.07 -0.57 -0.02 0.00 0.00 0.00 0.00 54.91 54.25 1nb4 h ALA 421 Cb 1.83 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.55 1nb4 h ALA 421 CO 0.17 0.73 -0.06 0.00 0.00 0.00 0.00 179.25 180.08 1nb4 h ARG 422 N 0.35 0.06 0.07 0.00 3.08 -1.50 -1.29 114.38 115.14 1nb4 h ARG 422 Ca -0.02 -0.05 -0.25 0.00 0.07 0.00 0.00 59.98 59.73 1nb4 h ARG 422 Cb 1.23 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.29 1nb4 h ARG 422 CO 0.12 0.74 -1.09 0.52 -1.07 0.00 0.00 179.97 179.19 1nb4 h MET 423 N -0.61 0.34 0.00 0.04 2.86 -1.51 -3.35 114.93 112.70 1nb4 h MET 423 Ca -0.00 -0.45 -0.12 0.00 -2.06 0.00 0.00 59.70 57.07 1nb4 h MET 423 Cb 0.75 0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.55 1nb4 h MET 423 CO 0.01 1.16 -1.37 -0.89 1.06 0.00 0.00 176.91 176.88 1nb4 n ILE 424 N -3.64 1.50 -0.00 -1.22 5.41 -0.72 -4.23 119.36 116.46 1nb4 n ILE 424 Ca -0.08 0.01 -0.12 0.00 1.00 0.00 0.00 62.75 63.57 1nb4 n ILE 424 Cb 0.93 -2.22 -0.07 0.00 -0.71 0.00 0.00 39.64 37.56 1nb4 n ILE 424 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1nb4 h LEU 425 N -0.99 0.07 -0.20 1.39 4.07 -1.30 -0.76 115.31 117.59 1nb4 h LEU 425 Ca -0.17 -0.21 -0.00 0.00 0.08 0.00 0.00 57.88 57.57 1nb4 h LEU 425 Cb 1.14 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.85 1nb4 h LEU 425 CO -0.11 0.27 0.12 0.24 -1.08 0.00 0.00 178.44 177.89 1nb4 h MET 426 N -0.13 0.27 0.15 1.13 2.86 -1.39 -0.88 114.93 116.95 1nb4 h MET 426 Ca 0.02 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1nb4 h MET 426 Cb 0.22 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.83 1nb4 h MET 426 CO -0.00 0.21 -0.07 1.15 1.06 0.00 0.00 176.91 179.26 1nb4 h THR 427 N 0.25 0.85 0.01 2.22 2.02 -1.68 -0.37 112.91 116.21 1nb4 h THR 427 Ca 0.07 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.24 1nb4 h THR 427 Cb 0.01 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1nb4 h THR 427 CO -0.01 0.00 -0.00 -0.74 0.37 0.00 0.00 175.52 175.13 1nb4 h HIS 428 N -0.21 -0.01 -0.08 3.16 6.17 -1.05 -2.15 115.15 120.98 1nb4 h HIS 428 Ca -0.02 -0.00 -0.21 0.00 0.71 0.00 0.00 60.37 60.85 1nb4 h HIS 428 Cb 0.16 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.10 1nb4 h HIS 428 CO -0.07 0.10 -0.81 0.74 0.71 0.00 0.00 177.93 178.60 1nb4 h PHE 429 N -0.12 0.77 -0.15 5.26 -1.00 -1.12 -2.39 116.94 118.19 1nb4 h PHE 429 Ca -0.00 -0.36 -0.08 0.00 2.81 0.00 0.00 57.97 60.34 1nb4 h PHE 429 Cb 0.12 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.56 1nb4 h PHE 429 CO -0.04 1.16 -0.25 0.74 -1.61 0.00 0.00 178.31 178.31 1nb4 h PHE 430 N 0.36 0.29 -0.21 -0.55 -1.00 -1.12 0.35 116.94 115.06 1nb4 h PHE 430 Ca -0.06 -0.05 0.02 0.00 2.81 0.00 0.00 57.97 60.69 1nb4 h PHE 430 Cb 1.42 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 40.89 1nb4 h PHE 430 CO 0.07 0.50 0.08 1.03 -1.61 0.00 0.00 178.31 178.38 1nb4 h SER 431 N 0.24 0.11 0.41 2.17 0.87 -1.25 0.74 113.55 116.85 1nb4 h SER 431 Ca 0.04 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 1nb4 h SER 431 Cb 0.58 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 1nb4 h SER 431 CO 0.04 0.09 -0.20 0.40 -0.53 0.00 0.00 176.83 176.63 1nb4 h ILE 432 N 0.19 0.55 -0.49 2.23 1.08 -1.13 -2.39 117.51 117.55 1nb4 h ILE 432 Ca 0.09 -0.41 0.04 0.00 -0.39 0.00 0.00 64.86 64.20 1nb4 h ILE 432 Cb 0.05 0.74 -0.04 0.00 -3.07 0.00 0.00 36.82 34.50 1nb4 h ILE 432 CO -0.08 0.07 0.25 -0.07 -0.69 0.00 0.00 178.15 177.63 1nb4 h LEU 433 N -0.80 0.36 -0.85 1.44 4.07 -0.88 0.12 115.31 118.77 1nb4 h LEU 433 Ca -0.06 0.03 0.06 0.00 0.08 0.00 0.00 57.88 57.99 1nb4 h LEU 433 Cb 0.54 -0.04 -0.06 0.00 1.08 0.00 0.00 40.66 42.18 1nb4 h LEU 433 CO 0.09 0.25 0.53 0.25 -1.08 0.00 0.00 178.44 178.48 1nb4 h LEU 434 N 0.49 0.83 -1.18 1.67 5.85 -0.88 0.28 115.31 122.38 1nb4 h LEU 434 Ca 0.22 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.87 1nb4 h LEU 434 Cb 0.12 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1nb4 h LEU 434 CO -0.15 0.53 -0.39 0.00 -0.34 0.00 0.00 178.44 178.08 1nb4 h ALA 435 N 1.40 1.24 -0.27 1.25 0.00 -0.65 -2.84 119.26 119.39 1nb4 h ALA 435 Ca 0.37 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1nb4 h ALA 435 Cb 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1nb4 h ALA 435 CO -0.17 0.49 0.00 1.04 0.00 0.00 0.00 179.25 180.61 1nb4 n GLN 436 N -3.91 2.33 -1.17 0.00 6.02 0.30 -4.95 117.38 116.00 1nb4 n GLN 436 Ca -0.01 -2.11 -0.06 0.00 -0.01 0.00 0.00 57.00 54.81 1nb4 n GLN 436 Cb 0.45 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 30.21 1nb4 n GLN 436 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1nb4 n GLU 437 N 1.35 -1.41 -0.04 -1.09 -0.58 0.86 -4.88 120.64 114.86 1nb4 n GLU 437 Ca 0.17 0.63 0.01 0.00 -0.42 0.00 0.00 57.16 57.54 1nb4 n GLU 437 Cb 0.57 -4.80 0.02 0.00 -0.57 0.00 0.00 31.44 26.66 1nb4 n GLU 437 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1nb4 n GLN 438 N -0.81 1.16 0.14 3.49 1.13 -0.94 -4.36 117.38 117.20 1nb4 n GLN 438 Ca -0.06 -0.18 0.15 0.00 -1.94 0.00 0.00 57.00 54.98 1nb4 n GLN 438 Cb 0.44 -1.26 0.72 0.00 0.11 0.00 0.00 30.24 30.25 1nb4 n GLN 438 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1nb4 h LEU 439 N 0.26 0.00 0.00 1.08 5.85 -1.90 -2.09 115.31 118.50 1nb4 h LEU 439 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1nb4 h LEU 439 Cb 0.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1nb4 h LEU 439 CO 0.01 0.00 -1.23 -0.62 -0.34 0.00 0.00 178.44 176.27 1nb4 n GLU 440 N -4.26 0.25 -1.82 1.25 1.02 -1.26 -3.32 120.64 112.50 1nb4 n GLU 440 Ca 0.03 -0.05 -0.42 0.00 -0.02 0.00 0.00 57.16 56.70 1nb4 n GLU 440 Cb 0.36 -1.54 -0.03 0.00 -0.02 0.00 0.00 31.44 30.21 1nb4 n GLU 440 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1nb4 s LYS 441 N -3.19 4.17 0.28 3.49 2.47 -0.79 -4.85 119.74 121.32 1nb4 s LYS 441 Ca 0.03 2.45 -0.28 0.00 -1.56 0.00 0.00 55.97 56.61 1nb4 s LYS 441 Cb 0.15 -3.76 -0.09 0.00 -1.46 0.00 0.00 37.83 32.66 1nb4 s LYS 441 CO 0.85 -0.83 0.96 0.00 0.16 0.00 0.00 175.35 176.49 1nb4 s ALA 442 N 3.22 3.28 0.20 3.13 0.00 -1.26 -4.23 121.76 126.10 1nb4 s ALA 442 Ca 0.79 0.60 0.07 0.00 0.00 0.00 0.00 51.96 53.42 1nb4 s ALA 442 Cb -0.41 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.45 1nb4 s ALA 442 CO 0.35 0.16 -0.13 -0.51 0.00 0.00 0.00 175.76 175.63 1nb4 s LEU 443 N -1.60 2.54 -0.13 0.00 1.43 0.73 -4.85 118.68 116.80 1nb4 s LEU 443 Ca 0.45 -1.03 -0.06 0.00 -1.03 0.00 0.00 54.13 52.46 1nb4 s LEU 443 Cb -0.23 -0.60 -0.04 0.00 0.03 0.00 0.00 46.19 45.35 1nb4 s LEU 443 CO 0.29 -0.22 0.08 -1.81 0.23 0.00 0.00 176.35 174.93 1nb4 s ASP 444 N -3.29 5.89 0.24 2.29 1.01 -1.26 0.12 116.67 121.67 1nb4 s ASP 444 Ca 0.22 0.28 -0.01 0.00 0.71 0.00 0.00 52.55 53.75 1nb4 s ASP 444 Cb 0.00 -1.88 -0.03 0.00 1.01 0.00 0.00 42.92 42.02 1nb4 s ASP 444 CO 0.06 0.34 0.21 0.00 0.21 0.00 0.00 175.17 175.98 1nb4 s GLN 446 N -3.95 1.81 -0.16 0.00 -2.07 -1.26 0.35 119.66 114.38 1nb4 s GLN 446 Ca 0.37 -0.80 0.01 0.00 -1.82 0.00 0.00 55.36 53.12 1nb4 s GLN 446 Cb 0.05 -1.75 0.02 0.00 -1.09 0.00 0.00 33.01 30.24 1nb4 s GLN 446 CO 0.15 0.48 -0.17 0.42 -1.32 0.00 0.00 175.29 174.85 1nb4 s ILE 447 N -0.52 1.81 -1.36 3.63 1.09 0.70 -4.66 121.20 121.89 1nb4 s ILE 447 Ca 0.08 -0.79 -0.09 0.00 -1.10 0.00 0.00 60.65 58.75 1nb4 s ILE 447 Cb -0.09 -1.65 0.07 0.00 -1.06 0.00 0.00 42.46 39.73 1nb4 s ILE 447 CO -0.01 0.50 0.56 -1.22 -0.10 0.00 0.00 174.94 174.67 1nb4 n TYR 448 N 4.59 -1.86 0.00 3.97 0.53 -1.26 -1.43 117.16 121.70 1nb4 n TYR 448 Ca -0.19 0.53 0.00 0.00 -1.02 0.00 0.00 57.90 57.22 1nb4 n TYR 448 Cb 0.50 -3.27 0.00 0.00 -1.03 0.00 0.00 39.34 35.55 1nb4 n TYR 448 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1nb4 n GLY 449 N -1.28 1.92 3.80 2.72 0.00 -1.26 -1.85 105.19 109.24 1nb4 n GLY 449 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1nb4 n GLY 449 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nb4 s ALA 450 N -2.57 3.67 -0.08 4.61 0.00 -0.51 -4.46 121.76 122.41 1nb4 s ALA 450 Ca 0.00 -0.33 -0.27 0.00 0.00 0.00 0.00 51.96 51.36 1nb4 s ALA 450 Cb 0.00 -2.36 -0.02 0.00 0.00 0.00 0.00 23.12 20.73 1nb4 s ALA 450 CO 0.00 0.34 0.86 0.00 0.00 0.00 0.00 175.76 176.96 1nb4 s TYR 452 N 1.44 2.18 -0.22 0.00 1.51 0.15 -1.07 117.35 121.35 1nb4 s TYR 452 Ca 0.43 -0.39 -0.08 0.00 -1.01 0.00 0.00 57.07 56.03 1nb4 s TYR 452 Cb -0.18 -1.17 -0.04 0.00 -0.11 0.00 0.00 41.96 40.46 1nb4 s TYR 452 CO 0.19 0.33 0.08 0.45 -1.11 0.00 0.00 175.55 175.49 1nb4 s SER 453 N -2.14 5.42 0.04 2.29 0.15 -1.26 -1.37 113.70 116.83 1nb4 s SER 453 Ca 0.13 -0.06 0.02 0.00 0.70 0.00 0.00 55.95 56.75 1nb4 s SER 453 Cb -0.10 -1.96 -0.02 0.00 -1.71 0.00 0.00 66.02 62.24 1nb4 s SER 453 CO 0.06 0.06 -0.08 -0.63 1.20 0.00 0.00 173.24 173.85 1nb4 s ILE 454 N 1.06 0.58 -0.24 6.45 -1.09 0.33 -3.36 121.20 124.92 1nb4 s ILE 454 Ca 0.04 -1.07 -0.09 0.00 -2.23 0.00 0.00 60.65 57.31 1nb4 s ILE 454 Cb -0.14 -0.64 -0.04 0.00 -1.58 0.00 0.00 42.46 40.06 1nb4 s ILE 454 CO 0.03 -0.35 0.12 -1.61 -1.23 0.00 0.00 174.94 171.90 1nb4 s GLU 455 N -1.54 3.87 0.54 2.79 2.02 -1.26 0.26 118.70 125.37 1nb4 s GLU 455 Ca -0.09 -0.37 0.24 0.00 0.02 0.00 0.00 54.97 54.76 1nb4 s GLU 455 Cb -0.10 -3.43 1.42 0.00 0.10 0.00 0.00 34.13 32.12 1nb4 s GLU 455 CO 0.01 -0.05 2.05 -1.00 0.02 0.00 0.00 175.26 176.28 1nb4 h PRO 456 N 7.85 0.00 0.00 0.39 0.13 -1.74 -0.23 132.00 138.40 1nb4 h PRO 456 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1nb4 h PRO 456 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1nb4 h PRO 456 CO 0.61 0.00 0.00 -0.07 -0.23 0.00 0.00 178.00 178.31 1nb4 h LEU 457 N 0.00 0.00 -0.19 1.56 3.38 -1.92 -1.54 115.31 116.60 1nb4 h LEU 457 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1nb4 h LEU 457 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1nb4 h LEU 457 CO -0.00 0.00 -0.28 0.47 0.09 0.00 0.00 178.44 178.72 1nb4 n ASP 458 N -2.68 0.57 -0.27 -0.43 8.00 -0.10 -4.40 116.55 117.24 1nb4 n ASP 458 Ca -0.00 -0.40 0.05 0.00 0.71 0.00 0.00 54.79 55.14 1nb4 n ASP 458 Cb 0.17 0.05 0.14 0.00 -0.02 0.00 0.00 41.12 41.46 1nb4 n ASP 458 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1nb4 h LEU 459 N 0.46 -0.50 -0.89 0.64 4.07 -1.37 -2.08 115.31 115.63 1nb4 h LEU 459 Ca 0.00 0.22 0.14 0.00 0.08 0.00 0.00 57.88 58.32 1nb4 h LEU 459 Cb 0.47 0.41 -0.09 0.00 1.08 0.00 0.00 40.66 42.53 1nb4 h LEU 459 CO 0.00 -0.22 0.50 -0.65 -1.08 0.00 0.00 178.44 176.98 1nb4 h PRO 460 N 0.05 0.71 -0.00 1.13 0.11 -1.82 0.13 132.00 132.32 1nb4 h PRO 460 Ca 0.41 -0.04 -0.24 0.00 0.11 0.00 0.00 66.00 66.24 1nb4 h PRO 460 Cb 0.71 -0.16 0.02 0.00 0.11 0.00 0.00 31.00 31.68 1nb4 h PRO 460 CO -0.74 0.47 -0.92 1.96 -0.21 0.00 0.00 178.00 178.56 1nb4 h GLN 461 N 0.73 0.63 -0.41 1.05 7.50 -1.73 -1.44 115.11 121.43 1nb4 h GLN 461 Ca 0.47 -0.67 0.07 0.00 0.50 0.00 0.00 58.65 59.02 1nb4 h GLN 461 Cb 0.61 0.19 -0.06 0.00 0.05 0.00 0.00 27.48 28.27 1nb4 h GLN 461 CO -0.33 1.27 0.07 0.82 -1.50 0.00 0.00 178.83 179.16 1nb4 h ILE 462 N 0.26 0.77 -0.56 2.54 2.04 -0.87 0.21 117.51 121.90 1nb4 h ILE 462 Ca -0.11 -0.07 -0.10 0.00 1.00 0.00 0.00 64.86 65.58 1nb4 h ILE 462 Cb 1.59 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.21 1nb4 h ILE 462 CO 0.18 0.04 -0.02 0.40 0.00 0.00 0.00 178.15 178.74 1nb4 h ILE 463 N 0.20 1.27 -0.20 -0.67 2.04 -0.77 0.18 117.51 119.55 1nb4 h ILE 463 Ca 0.20 -1.16 -0.01 0.00 1.00 0.00 0.00 64.86 64.90 1nb4 h ILE 463 Cb 0.25 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1nb4 h ILE 463 CO -0.27 0.41 0.10 -0.08 0.00 0.00 0.00 178.15 178.31 1nb4 h GLU 464 N 0.89 0.29 -0.19 2.37 4.81 -0.44 0.58 114.58 122.88 1nb4 h GLU 464 Ca 0.16 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 1nb4 h GLU 464 Cb 0.58 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1nb4 h GLU 464 CO 0.03 0.30 0.08 0.00 -0.73 0.00 0.00 179.01 178.69 1nb4 h ARG 465 N 0.20 0.17 -0.16 1.92 2.47 -0.52 0.55 114.38 119.01 1nb4 h ARG 465 Ca 0.07 -0.01 -0.22 0.00 -1.26 0.00 0.00 59.98 58.56 1nb4 h ARG 465 Cb 0.11 -0.04 0.01 0.00 -1.65 0.00 0.00 29.97 28.40 1nb4 h ARG 465 CO -0.01 0.11 -0.76 -0.07 0.56 0.00 0.00 179.97 179.80 1nb4 h LEU 466 N 0.17 0.92 0.00 3.04 3.38 -0.76 -3.38 115.31 118.68 1nb4 h LEU 466 Ca 0.08 -0.59 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1nb4 h LEU 466 Cb 0.04 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.51 1nb4 h LEU 466 CO -0.07 1.39 -0.51 1.41 0.09 0.00 0.00 178.44 180.75 1nb4 n HIS 467 N -3.93 0.00 0.00 1.13 8.25 0.20 -4.51 115.22 116.35 1nb4 n HIS 467 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1nb4 n HIS 467 Cb 0.74 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.82 1nb4 n HIS 467 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1nb4 n GLY 468 N 1.33 -1.68 0.36 -1.41 0.00 0.19 -4.51 105.19 99.47 1nb4 n GLY 468 Ca 0.01 -1.53 0.19 0.00 0.00 0.00 0.00 46.02 44.69 1nb4 n GLY 468 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1nb4 h LEU 469 N 0.00 0.00 -2.10 0.99 4.07 -1.89 -2.59 115.31 113.79 1nb4 h LEU 469 Ca 0.00 0.00 0.06 0.00 0.08 0.00 0.00 57.88 58.02 1nb4 h LEU 469 Cb 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 1nb4 h LEU 469 CO 0.00 0.00 0.18 0.77 -1.08 0.00 0.00 178.44 178.31 1nb4 h SER 470 N 0.00 0.00 -0.04 -0.43 4.64 -1.97 -1.37 113.55 114.38 1nb4 h SER 470 Ca 0.15 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.48 1nb4 h SER 470 Cb 0.79 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1nb4 h SER 470 CO -0.00 0.00 0.09 0.00 -0.87 0.00 0.00 176.83 176.05 1nb4 h ALA 471 N 1.85 1.32 -0.22 5.18 0.00 -1.69 0.14 119.26 125.83 1nb4 h ALA 471 Ca 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1nb4 h ALA 471 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1nb4 h ALA 471 CO -0.00 -0.11 0.00 1.19 0.00 0.00 0.00 179.25 180.33 1nb4 n PHE 472 N -3.35 0.27 -0.15 0.00 0.99 -0.52 -4.47 117.46 110.25 1nb4 n PHE 472 Ca -0.02 -0.14 0.00 0.00 -0.00 0.00 0.00 57.45 57.29 1nb4 n PHE 472 Cb 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.65 1nb4 n PHE 472 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1nb4 n THR 473 N 1.13 0.00 -1.72 4.37 -2.24 0.41 -4.49 114.28 111.74 1nb4 n THR 473 Ca 0.17 -0.33 -0.41 0.00 -2.27 0.00 0.00 64.05 61.21 1nb4 n THR 473 Cb 0.53 1.15 0.01 0.00 -2.10 0.00 0.00 70.33 69.91 1nb4 n THR 473 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1nb4 n LEU 474 N -0.38 4.15 0.00 3.22 4.77 -0.82 -4.15 117.00 123.80 1nb4 n LEU 474 Ca 0.00 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 57.14 1nb4 n LEU 474 Cb 0.04 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 39.60 1nb4 n LEU 474 CO 0.00 -0.40 0.00 0.00 -1.33 0.00 0.00 177.39 175.66 1nb4 n HIS 475 N 0.06 0.00 -3.65 -1.77 1.44 -0.60 -4.95 115.22 105.75 1nb4 n HIS 475 Ca 0.05 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.41 1nb4 n HIS 475 Cb 0.39 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.43 1nb4 n HIS 475 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 1nb4 n SER 476 N -0.24 4.09 -4.76 4.39 7.64 -1.26 -4.96 113.62 118.52 1nb4 n SER 476 Ca 0.00 -3.17 -0.33 0.00 1.01 0.00 0.00 58.87 56.39 1nb4 n SER 476 Cb 0.00 -1.00 0.06 0.00 -1.01 0.00 0.00 64.21 62.26 1nb4 n SER 476 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1nb4 s TYR 477 N -1.49 2.56 0.68 1.43 1.51 -1.26 -4.21 117.35 116.57 1nb4 s TYR 477 Ca 0.28 1.56 -0.16 0.00 -1.01 0.00 0.00 57.07 57.74 1nb4 s TYR 477 Cb -0.05 -3.17 0.01 0.00 -0.11 0.00 0.00 41.96 38.64 1nb4 s TYR 477 CO -0.12 -1.79 1.19 -1.54 -1.11 0.00 0.00 175.55 172.17 1nb4 s SER 478 N -2.68 4.63 0.34 2.29 1.04 -1.21 -4.85 113.70 113.26 1nb4 s SER 478 Ca 0.66 2.29 0.06 0.00 0.48 0.00 0.00 55.95 59.44 1nb4 s SER 478 Cb -0.21 -2.58 0.61 0.00 0.10 0.00 0.00 66.02 63.94 1nb4 s SER 478 CO 0.44 -1.97 1.84 -0.65 0.98 0.00 0.00 173.24 173.89 1nb4 h PRO 479 N 0.06 0.42 -0.39 4.02 0.11 -1.95 -1.28 132.00 132.99 1nb4 h PRO 479 Ca -0.48 -0.11 -0.08 0.00 0.11 0.00 0.00 66.00 65.44 1nb4 h PRO 479 Cb 1.29 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1nb4 h PRO 479 CO 0.52 0.54 -0.06 0.78 -0.21 0.00 0.00 178.00 179.56 1nb4 h GLY 480 N 0.87 0.79 0.81 -0.55 0.00 -1.99 -0.96 103.07 102.04 1nb4 h GLY 480 Ca 0.08 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.75 1nb4 h GLY 480 CO 0.02 0.58 0.01 -2.09 0.00 0.00 0.00 176.54 175.07 1nb4 h GLU 481 N 0.55 0.29 -0.18 4.80 4.57 -1.86 -1.59 114.58 121.15 1nb4 h GLU 481 Ca 0.10 -0.08 0.03 0.00 -1.18 0.00 0.00 59.36 58.23 1nb4 h GLU 481 Cb 0.57 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.10 1nb4 h GLU 481 CO 0.03 0.48 0.00 0.82 -1.18 0.00 0.00 179.01 179.17 1nb4 h ILE 482 N 0.05 0.87 -0.74 2.32 2.04 -1.23 -1.04 117.51 119.78 1nb4 h ILE 482 Ca 0.05 -0.02 0.02 0.00 1.00 0.00 0.00 64.86 65.91 1nb4 h ILE 482 Cb 0.34 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1nb4 h ILE 482 CO 0.01 0.01 0.48 0.78 0.00 0.00 0.00 178.15 179.42 1nb4 h ASN 483 N 0.06 0.80 -0.08 1.72 -0.26 -1.07 -0.75 115.58 116.00 1nb4 h ASN 483 Ca 0.09 -0.01 0.02 0.00 -0.56 0.00 0.00 56.30 55.83 1nb4 h ASN 483 Cb 0.10 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 37.16 1nb4 h ASN 483 CO -0.14 0.56 -0.03 -0.09 -1.06 0.00 0.00 177.43 176.67 1nb4 h ARG 484 N 0.95 -0.01 0.63 0.81 2.43 -0.85 0.60 114.38 118.93 1nb4 h ARG 484 Ca 0.29 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.44 1nb4 h ARG 484 Cb -0.03 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1nb4 h ARG 484 CO -0.09 -0.01 -0.46 0.28 -1.51 0.00 0.00 179.97 178.19 1nb4 h VAL 485 N -0.01 0.09 -0.41 0.20 2.07 -0.93 0.43 116.25 117.69 1nb4 h VAL 485 Ca 0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.64 1nb4 h VAL 485 Cb 0.07 0.09 -0.07 0.00 -1.52 0.00 0.00 31.29 29.86 1nb4 h VAL 485 CO -0.09 0.00 -0.02 0.00 0.02 0.00 0.00 177.57 177.48 1nb4 h ALA 486 N -0.86 0.36 -0.60 1.67 0.00 -1.04 0.21 119.26 119.00 1nb4 h ALA 486 Ca -0.08 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1nb4 h ALA 486 Cb 0.87 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1nb4 h ALA 486 CO 0.03 -0.41 0.35 1.03 0.00 0.00 0.00 179.25 180.26 1nb4 h SER 487 N 0.08 0.73 -0.58 0.00 0.87 -0.84 -2.21 113.55 111.61 1nb4 h SER 487 Ca 0.20 -0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.65 1nb4 h SER 487 Cb 0.30 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 1nb4 h SER 487 CO -0.36 0.57 0.10 0.00 -0.53 0.00 0.00 176.83 176.62 1nb4 h LEU 489 N 0.85 0.89 -0.31 0.00 3.38 -0.88 -2.24 115.31 117.00 1nb4 h LEU 489 Ca 0.18 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1nb4 h LEU 489 Cb 0.40 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1nb4 h LEU 489 CO 0.01 0.84 0.16 0.03 0.09 0.00 0.00 178.44 179.58 1nb4 h ARG 490 N 0.92 0.43 -0.52 1.13 2.47 -1.28 0.72 114.38 118.25 1nb4 h ARG 490 Ca 0.20 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.88 1nb4 h ARG 490 Cb 0.29 -0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.50 1nb4 h ARG 490 CO -0.01 0.38 0.33 -0.22 0.56 0.00 0.00 179.97 181.02 1nb4 h LYS 491 N 0.37 0.65 -0.00 0.04 3.64 -1.20 -2.99 116.57 117.08 1nb4 h LYS 491 Ca 0.11 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1nb4 h LYS 491 Cb 0.08 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1nb4 h LYS 491 CO -0.02 0.43 -0.17 1.28 -2.27 0.00 0.00 179.45 178.71 1nb4 n LEU 492 N -4.75 0.21 -0.26 5.20 4.77 -0.87 -4.92 117.00 116.39 1nb4 n LEU 492 Ca 0.03 0.28 -0.02 0.00 -0.03 0.00 0.00 56.01 56.26 1nb4 n LEU 492 Cb 0.04 -0.38 -0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1nb4 n LEU 492 CO 0.34 0.05 -0.03 0.61 -1.33 0.00 0.00 177.39 177.03 1nb4 n GLY 493 N 1.47 0.33 3.78 -0.72 0.00 -0.36 -2.27 105.19 107.42 1nb4 n GLY 493 Ca 0.08 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 44.88 1nb4 n GLY 493 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nb4 s VAL 494 N -2.11 4.79 0.59 1.61 1.01 0.10 -1.79 120.40 124.59 1nb4 s VAL 494 Ca 0.00 1.28 -0.20 0.00 0.00 0.00 0.00 61.98 63.06 1nb4 s VAL 494 Cb 0.00 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1nb4 s VAL 494 CO 0.00 0.48 1.25 -0.81 0.00 0.00 0.00 175.10 176.02 1nb4 n PRO 495 N 2.22 1.33 -1.32 2.72 -0.04 -1.26 -4.54 135.00 134.11 1nb4 n PRO 495 Ca -0.08 0.50 -0.35 0.00 -0.04 0.00 0.00 63.50 63.53 1nb4 n PRO 495 Cb 0.51 -2.47 0.11 0.00 -0.04 0.00 0.00 33.50 31.60 1nb4 n PRO 495 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1nb4 n PRO 496 N -1.30 0.50 -0.19 0.54 -0.04 -1.26 -4.80 135.00 128.44 1nb4 n PRO 496 Ca 0.13 0.24 0.25 0.00 -0.04 0.00 0.00 63.50 64.08 1nb4 n PRO 496 Cb 0.46 -2.43 0.65 0.00 -0.04 0.00 0.00 33.50 32.14 1nb4 n PRO 496 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1nb4 h LEU 497 N -0.40 0.13 -1.65 1.53 3.38 -1.98 -0.03 115.31 116.30 1nb4 h LEU 497 Ca -0.48 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 1nb4 h LEU 497 Cb 1.32 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 1nb4 h LEU 497 CO 0.48 0.05 -0.20 0.08 0.09 0.00 0.00 178.44 178.94 1nb4 h ARG 498 N 0.13 0.00 -0.19 1.13 -0.00 -2.00 -0.71 114.38 112.75 1nb4 h ARG 498 Ca 0.43 0.00 -0.07 0.00 -0.00 0.00 0.00 59.98 60.34 1nb4 h ARG 498 Cb 1.50 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.46 1nb4 h ARG 498 CO -0.07 0.20 -0.17 1.15 -0.00 0.00 0.00 179.97 181.09 1nb4 h THR 499 N 0.00 1.33 -0.89 0.08 2.02 -1.33 -2.23 112.91 111.89 1nb4 h THR 499 Ca -0.00 -1.31 0.05 0.00 0.77 0.00 0.00 66.41 65.92 1nb4 h THR 499 Cb 0.43 1.77 -0.05 0.00 -1.74 0.00 0.00 68.15 68.56 1nb4 h THR 499 CO 0.03 0.39 0.58 -0.50 0.37 0.00 0.00 175.52 176.39 1nb4 h TRP 500 N 0.11 1.05 -0.62 3.16 4.06 -1.24 -0.08 115.95 122.38 1nb4 h TRP 500 Ca 0.03 0.03 -0.04 0.00 2.06 0.00 0.00 58.89 60.97 1nb4 h TRP 500 Cb 0.70 -0.35 -0.03 0.00 -1.00 0.00 0.00 29.16 28.48 1nb4 h TRP 500 CO 0.08 0.58 0.22 -0.09 -3.56 0.00 0.00 178.44 175.68 1nb4 h ARG 501 N 1.06 0.94 -0.04 0.49 2.43 -0.97 -0.21 114.38 118.08 1nb4 h ARG 501 Ca 0.36 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 1nb4 h ARG 501 Cb 0.10 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1nb4 h ARG 501 CO -0.12 0.81 0.02 0.45 -1.51 0.00 0.00 179.97 179.62 1nb4 h HIS 502 N 0.87 0.07 -0.58 2.20 3.86 -0.73 -1.90 115.15 118.94 1nb4 h HIS 502 Ca 0.20 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.40 1nb4 h HIS 502 Cb 0.24 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 28.66 1nb4 h HIS 502 CO 0.02 0.19 0.33 0.00 0.86 0.00 0.00 177.93 179.32 1nb4 h ARG 503 N -0.07 0.78 -0.35 2.45 3.08 -0.92 -2.07 114.38 117.27 1nb4 h ARG 503 Ca 0.01 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 1nb4 h ARG 503 Cb 0.15 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1nb4 h ARG 503 CO -0.00 0.57 -0.10 0.00 -1.07 0.00 0.00 179.97 179.36 1nb4 h ALA 504 N 1.57 1.16 -0.92 0.04 0.00 -0.68 -1.82 119.26 118.61 1nb4 h ALA 504 Ca 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1nb4 h ALA 504 Cb -0.00 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1nb4 h ALA 504 CO -0.04 0.53 0.53 0.00 0.00 0.00 0.00 179.25 180.27 1nb4 h ARG 505 N 0.56 1.27 -0.37 0.00 3.08 -0.62 0.21 114.38 118.51 1nb4 h ARG 505 Ca 0.10 -0.13 -0.15 0.00 0.07 0.00 0.00 59.98 59.87 1nb4 h ARG 505 Cb 0.51 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1nb4 h ARG 505 CO 0.03 0.91 -0.37 1.03 -1.07 0.00 0.00 179.97 180.49 1nb4 h SER 506 N 1.28 0.94 -0.34 7.04 0.87 -1.37 -2.34 113.55 119.63 1nb4 h SER 506 Ca 0.33 -0.42 -0.15 0.00 -1.23 0.00 0.00 61.79 60.31 1nb4 h SER 506 Cb -0.01 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 1nb4 h SER 506 CO -0.06 1.20 -0.36 0.58 -0.53 0.00 0.00 176.83 177.66 1nb4 h VAL 507 N 0.72 1.27 0.25 2.23 2.07 -1.07 -2.90 116.25 118.83 1nb4 h VAL 507 Ca 0.06 -1.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.05 1nb4 h VAL 507 Cb 0.95 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1nb4 h VAL 507 CO 0.09 0.51 -0.20 -0.09 0.02 0.00 0.00 177.57 177.90 1nb4 h ARG 508 N 0.73 -0.45 -0.70 1.57 2.43 -0.42 -2.03 114.38 115.51 1nb4 h ARG 508 Ca 0.07 0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.35 1nb4 h ARG 508 Cb 0.94 0.10 -0.11 0.00 -0.42 0.00 0.00 29.97 30.48 1nb4 h ARG 508 CO 0.09 -0.30 -0.50 0.00 -1.51 0.00 0.00 179.97 177.75 1nb4 h ALA 509 N 0.24 -0.45 -0.45 2.80 0.00 -1.35 0.13 119.26 120.18 1nb4 h ALA 509 Ca -0.01 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1nb4 h ALA 509 Cb 0.41 1.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 1nb4 h ALA 509 CO -0.01 -0.90 0.30 0.87 0.00 0.00 0.00 179.25 179.50 1nb4 h LYS 510 N -0.18 0.49 -0.61 0.00 1.57 -1.35 -0.94 116.57 115.54 1nb4 h LYS 510 Ca 0.17 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.82 1nb4 h LYS 510 Cb 0.53 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1nb4 h LYS 510 CO -0.77 0.32 0.01 -0.07 -0.57 0.00 0.00 179.45 178.38 1nb4 h LEU 511 N 0.50 1.05 -0.12 2.94 3.38 -0.03 -2.64 115.31 120.38 1nb4 h LEU 511 Ca 0.18 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1nb4 h LEU 511 Cb 0.11 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 1nb4 h LEU 511 CO -0.04 1.09 0.02 -0.07 0.09 0.00 0.00 178.44 179.53 1nb4 h LEU 512 N 0.97 0.19 -0.45 1.67 3.38 -0.18 -2.67 115.31 118.22 1nb4 h LEU 512 Ca 0.18 -0.25 0.04 0.00 0.09 0.00 0.00 57.88 57.94 1nb4 h LEU 512 Cb 0.54 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 1nb4 h LEU 512 CO 0.03 0.39 -0.27 -1.20 0.09 0.00 0.00 178.44 177.48 1nb4 n SER 513 N -4.84 -0.48 0.03 -0.43 7.64 -0.47 0.17 113.62 115.25 1nb4 n SER 513 Ca -0.05 1.30 0.02 0.00 1.01 0.00 0.00 58.87 61.14 1nb4 n SER 513 Cb 0.17 -0.35 0.08 0.00 -1.01 0.00 0.00 64.21 63.09 1nb4 n SER 513 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nb4 n GLN 514 N -4.01 0.02 -0.95 1.43 6.02 -1.01 -4.94 117.38 113.92 1nb4 n GLN 514 Ca 0.01 0.40 0.10 0.00 -0.01 0.00 0.00 57.00 57.50 1nb4 n GLN 514 Cb 0.12 -1.72 -0.03 0.00 1.02 0.00 0.00 30.24 29.62 1nb4 n GLN 514 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nb4 n GLY 515 N -1.34 -1.29 7.00 1.08 0.00 0.13 -4.80 105.19 105.96 1nb4 n GLY 515 Ca -0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1nb4 n GLY 515 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nb4 n GLY 516 N -3.07 -0.08 0.29 -0.02 0.00 -1.26 -3.47 105.19 97.58 1nb4 n GLY 516 Ca -0.02 -0.99 -0.06 0.00 0.00 0.00 0.00 46.02 44.95 1nb4 n GLY 516 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nb4 n ARG 517 N 0.00 -0.28 -0.23 1.61 5.12 -1.26 0.13 116.66 121.74 1nb4 n ARG 517 Ca 0.00 1.07 0.03 0.00 -1.93 0.00 0.00 57.85 57.02 1nb4 n ARG 517 Cb 0.00 -1.58 0.13 0.00 -1.16 0.00 0.00 32.46 29.85 1nb4 n ARG 517 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1nb4 h ALA 518 N 0.47 0.70 -0.71 7.54 0.00 -1.85 0.30 119.26 125.71 1nb4 h ALA 518 Ca 0.14 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 1nb4 h ALA 518 Cb 0.32 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1nb4 h ALA 518 CO -0.67 -0.40 0.41 0.00 0.00 0.00 0.00 179.25 178.58 1nb4 h ALA 519 N 1.63 0.91 -0.34 0.00 0.00 0.14 0.27 119.26 121.88 1nb4 h ALA 519 Ca 0.37 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.23 1nb4 h ALA 519 Cb 0.62 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1nb4 h ALA 519 CO -0.59 0.41 0.04 1.15 0.00 0.00 0.00 179.25 180.25 1nb4 h THR 520 N 0.97 0.80 -0.66 0.00 2.02 0.12 0.32 112.91 116.48 1nb4 h THR 520 Ca 0.25 -0.05 0.07 0.00 0.77 0.00 0.00 66.41 67.45 1nb4 h THR 520 Cb 0.01 0.64 -0.06 0.00 -1.74 0.00 0.00 68.15 67.00 1nb4 h THR 520 CO -0.04 0.03 0.34 0.00 0.37 0.00 0.00 175.52 176.22 1nb4 h GLY 522 N 0.62 -0.09 1.18 0.00 0.00 0.96 0.31 103.07 106.05 1nb4 h GLY 522 Ca 0.31 0.09 -0.18 0.00 0.00 0.00 0.00 47.33 47.56 1nb4 h GLY 522 CO -0.22 -0.09 -0.50 3.21 0.00 0.00 0.00 176.54 178.94 1nb4 h ARG 523 N -0.14 0.87 0.00 4.80 3.08 -0.12 -3.16 114.38 119.72 1nb4 h ARG 523 Ca 0.03 -0.52 -0.12 0.00 0.07 0.00 0.00 59.98 59.44 1nb4 h ARG 523 Cb 0.18 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1nb4 h ARG 523 CO -0.08 1.16 -0.65 1.88 -1.07 0.00 0.00 179.97 181.21 1nb4 h TYR 524 N 0.68 0.00 -0.06 3.04 -1.99 -0.96 -3.25 116.97 114.43 1nb4 h TYR 524 Ca 0.03 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.69 1nb4 h TYR 524 Cb 1.10 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.82 1nb4 h TYR 524 CO 0.07 1.20 -0.27 -0.07 -0.00 0.00 0.00 178.16 179.08 1nb4 h LEU 525 N -1.00 0.10 -3.19 3.88 3.38 -0.54 -3.24 115.31 114.69 1nb4 h LEU 525 Ca -0.18 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 1nb4 h LEU 525 Cb 1.12 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 1nb4 h LEU 525 CO -0.11 0.38 -0.00 0.49 0.09 0.00 0.00 178.44 179.29 1nb4 n PHE 526 N -4.18 0.71 0.26 1.13 3.01 -1.19 -4.62 117.46 112.57 1nb4 n PHE 526 Ca -0.02 -0.91 0.10 0.00 1.01 0.00 0.00 57.45 57.62 1nb4 n PHE 526 Cb 0.35 -0.28 0.68 0.00 -0.01 0.00 0.00 39.48 40.22 1nb4 n PHE 526 CO 0.00 0.00 0.00 -0.97 1.01 0.00 0.00 176.76 176.80 1nb4 h ASN 527 N 1.34 0.00 0.42 4.37 -1.24 -1.59 -0.69 115.58 118.19 1nb4 h ASN 527 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1nb4 h ASN 527 Cb 1.34 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.39 1nb4 h ASN 527 CO 0.17 0.07 0.00 4.11 -1.29 0.00 0.00 177.43 180.49 1nb4 h TRP 528 N 0.00 0.00 0.00 0.67 5.08 -1.82 -3.08 115.95 116.80 1nb4 h TRP 528 Ca -0.00 0.00 -0.20 0.00 1.08 0.00 0.00 58.89 59.76 1nb4 h TRP 528 Cb 0.14 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.26 1nb4 h TRP 528 CO 0.00 0.00 -1.20 0.00 -1.28 0.00 0.00 178.44 175.96 1nb4 h ALA 529 N 2.04 0.60 -2.32 0.11 0.00 -1.48 -3.48 119.26 114.73 1nb4 h ALA 529 Ca 0.00 -0.97 -0.49 0.00 0.00 0.00 0.00 54.91 53.45 1nb4 h ALA 529 Cb 0.21 0.14 0.05 0.00 0.00 0.00 0.00 17.79 18.18 1nb4 h ALA 529 CO 0.00 1.16 0.21 0.14 0.00 0.00 0.00 179.25 180.76 1nb4 s VAL 530 N -2.77 4.52 -0.01 0.00 -7.23 -1.17 -4.90 120.40 108.84 1nb4 s VAL 530 Ca -0.01 0.32 -0.12 0.00 -1.81 0.00 0.00 61.98 60.36 1nb4 s VAL 530 Cb 0.09 -3.76 -0.07 0.00 0.56 0.00 0.00 36.38 33.20 1nb4 s VAL 530 CO 0.81 -0.82 0.67 0.03 -0.31 0.00 0.00 175.10 175.47 1nb4 h ARG 531 N -0.03 -0.42 -5.56 4.82 2.47 -1.92 -3.39 114.38 110.35 1nb4 h ARG 531 Ca -0.46 0.03 -0.63 0.00 -1.26 0.00 0.00 59.98 57.66 1nb4 h ARG 531 Cb 1.21 0.10 -0.14 0.00 -1.65 0.00 0.00 29.97 29.49 1nb4 h ARG 531 CO 0.62 -0.28 0.84 0.99 0.56 0.00 0.00 179.97 182.70 1nb4 s THR 532 N -3.12 4.29 0.30 2.04 2.01 -1.26 -4.99 115.64 114.91 1nb4 s THR 532 Ca -0.06 -0.64 -0.29 0.00 0.31 0.00 0.00 61.69 61.00 1nb4 s THR 532 Cb 0.01 -4.80 -0.13 0.00 0.01 0.00 0.00 72.50 67.59 1nb4 s THR 532 CO 0.19 -1.60 1.36 0.29 -0.69 0.00 0.00 174.62 174.17 1nb4 n LYS 533 N 7.81 2.14 -3.68 4.92 4.76 -1.26 -4.96 118.16 127.89 1nb4 n LYS 533 Ca 0.10 0.76 -0.36 0.00 -2.87 0.00 0.00 58.31 55.94 1nb4 n LYS 533 Cb 0.48 -2.39 -0.10 0.00 -1.84 0.00 0.00 35.03 31.19 1nb4 n LYS 533 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1nb4 s LEU 534 N -0.51 4.08 -0.05 -0.35 2.96 -1.26 -5.05 118.68 118.50 1nb4 s LEU 534 Ca 0.61 0.10 -0.35 0.00 -0.22 0.00 0.00 54.13 54.28 1nb4 s LEU 534 Cb -0.59 -2.09 -0.13 0.00 0.50 0.00 0.00 46.19 43.87 1nb4 s LEU 534 CO 0.56 0.07 1.79 0.29 -1.32 0.00 0.00 176.35 177.74 1nb4 n LYS 535 N 4.27 2.04 -4.17 1.98 4.76 -1.26 -4.96 118.16 120.82 1nb4 n LYS 535 Ca -0.15 0.74 -0.35 0.00 -2.87 0.00 0.00 58.31 55.69 1nb4 n LYS 535 Cb 0.52 -2.55 -0.13 0.00 -1.84 0.00 0.00 35.03 31.03 1nb4 n LYS 535 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1nb4 s LEU 536 N 3.27 3.17 0.36 -0.35 1.43 -1.26 -5.10 118.68 120.20 1nb4 s LEU 536 Ca 0.90 -0.22 0.09 0.00 -1.03 0.00 0.00 54.13 53.87 1nb4 s LEU 536 Cb -0.74 -1.79 -0.06 0.00 0.03 0.00 0.00 46.19 43.64 1nb4 s LEU 536 CO 0.50 0.08 0.04 0.42 0.23 0.00 0.00 176.35 177.63 1nb4 s THR 537 N 0.89 2.55 0.10 5.49 -4.23 -1.26 -5.08 115.64 114.10 1nb4 s THR 537 Ca 0.00 -1.92 -0.36 0.00 -1.18 0.00 0.00 61.69 58.24 1nb4 s THR 537 Cb -0.14 -2.85 -0.17 0.00 1.34 0.00 0.00 72.50 70.67 1nb4 s THR 537 CO 0.02 -0.15 1.16 -2.65 -0.54 0.00 0.00 174.62 172.45 1nb4 n PRO 538 N -1.01 0.80 -3.04 3.99 -0.02 -1.26 -4.95 135.00 129.51 1nb4 n PRO 538 Ca -0.04 0.29 -0.39 0.00 -2.02 0.00 0.00 63.50 61.34 1nb4 n PRO 538 Cb 0.63 -1.80 -0.06 0.00 -0.02 0.00 0.00 33.50 32.25 1nb4 n PRO 538 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1nb4 s ILE 539 N 0.04 4.55 0.00 4.25 1.01 -1.26 -5.04 121.20 124.75 1nb4 s ILE 539 Ca 0.81 1.59 0.00 0.00 0.00 0.00 0.00 60.65 63.04 1nb4 s ILE 539 Cb -0.99 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 37.39 1nb4 s ILE 539 CO 0.52 0.48 0.00 -2.65 0.00 0.00 0.00 174.94 173.29 1nb4 n PRO 540 N 2.01 0.00 -0.29 2.79 -0.02 -1.26 -3.18 135.00 135.05 1nb4 n PRO 540 Ca -0.06 0.00 0.27 0.00 -2.02 0.00 0.00 63.50 61.69 1nb4 n PRO 540 Cb 0.50 -0.09 0.48 0.00 -0.02 0.00 0.00 33.50 34.36 1nb4 n PRO 540 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nb4 n ALA 541 N -3.00 0.89 -0.87 3.55 0.00 -1.26 -2.93 120.51 116.89 1nb4 n ALA 541 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 53.44 54.16 1nb4 n ALA 541 Cb 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1nb4 n ALA 541 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nb4 n ALA 542 N -2.48 0.00 0.00 0.00 0.00 -1.19 -2.13 120.51 114.70 1nb4 n ALA 542 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1nb4 n ALA 542 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.52 1nb4 n ALA 542 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1nb4 n SER 543 N 0.00 0.00 0.00 0.00 7.64 -1.23 -4.08 113.62 115.95 1nb4 n SER 543 Ca 0.00 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.26 1nb4 n SER 543 Cb 0.00 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 1nb4 n SER 543 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nb4 n GLN 544 N -1.37 0.00 -1.65 1.43 6.02 -0.91 -4.87 117.38 116.04 1nb4 n GLN 544 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 57.00 56.54 1nb4 n GLN 544 Cb 0.08 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.32 1nb4 n GLN 544 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.06 177.52 1nb4 n LEU 545 N 0.00 2.77 0.00 1.08 -0.00 -0.95 -4.88 117.00 115.03 1nb4 n LEU 545 Ca 0.00 1.17 0.00 0.00 -0.00 0.00 0.00 56.01 57.18 1nb4 n LEU 545 Cb 0.00 -1.39 0.00 0.00 -0.00 0.00 0.00 43.42 42.03 1nb4 n LEU 545 CO 0.00 -0.77 0.00 0.47 -0.00 0.00 0.00 177.39 177.09 1nb4 n ASP 546 N 1.58 0.00 -3.38 1.45 10.43 -1.26 -4.42 116.55 120.94 1nb4 n ASP 546 Ca 0.10 -0.16 0.00 0.00 2.57 0.00 0.00 54.79 57.29 1nb4 n ASP 546 Cb 0.32 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.28 1nb4 n ASP 546 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1nb4 n LEU 547 N 0.00 0.00 0.00 0.64 4.32 -1.26 -5.00 117.00 115.70 1nb4 n LEU 547 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1nb4 n LEU 547 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1nb4 n LEU 547 CO 0.00 -0.49 0.00 -1.54 -1.22 0.00 0.00 177.39 174.14 1nb4 n SER 548 N -0.68 0.00 0.00 -1.43 3.41 -1.26 -5.02 113.62 108.64 1nb4 n SER 548 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1nb4 n SER 548 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1nb4 n SER 548 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nb4 n GLY 549 N 0.00 0.00 0.01 5.00 0.00 -1.26 -4.36 105.19 104.58 1nb4 n GLY 549 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1nb4 n GLY 549 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1nb4 n TRP 550 N 0.00 0.00 -3.17 1.61 7.02 -1.26 -4.87 117.44 116.77 1nb4 n TRP 550 Ca 0.00 0.00 -0.24 0.00 -1.02 0.00 0.00 57.50 56.24 1nb4 n TRP 550 Cb 0.00 0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 28.84 1nb4 n TRP 550 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1nb4 n PHE 551 N -2.48 2.31 -0.08 -5.99 3.01 -1.26 -4.80 117.46 108.18 1nb4 n PHE 551 Ca 0.00 -3.92 -0.15 0.00 1.01 0.00 0.00 57.45 54.39 1nb4 n PHE 551 Cb 0.49 -0.47 -0.06 0.00 -0.01 0.00 0.00 39.48 39.42 1nb4 n PHE 551 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1nb4 n VAL 552 N 0.45 0.89 -3.91 -4.37 0.31 -1.20 -4.13 118.33 106.38 1nb4 n VAL 552 Ca 0.28 -0.27 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 1nb4 n VAL 552 Cb 0.48 -1.43 -0.02 0.00 -0.91 0.00 0.00 33.84 31.96 1nb4 n VAL 552 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1nb4 s ALA 553 N -2.30 -0.61 -0.06 3.52 0.00 -1.24 -4.16 121.76 116.90 1nb4 s ALA 553 Ca -0.22 -0.71 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 1nb4 s ALA 553 Cb 0.07 0.91 -0.04 0.00 0.00 0.00 0.00 23.12 24.06 1nb4 s ALA 553 CO 0.32 -0.95 0.13 0.20 0.00 0.00 0.00 175.76 175.46 1nb4 s GLY 554 N -3.02 2.12 -0.02 0.00 0.00 -1.26 -4.93 107.32 100.21 1nb4 s GLY 554 Ca 0.18 -0.73 0.16 0.00 0.00 0.00 0.00 44.72 44.33 1nb4 s GLY 554 CO 0.10 -0.54 1.12 -1.72 0.00 0.00 0.00 173.10 172.06 1nb4 n TYR 555 N 1.55 0.00 0.00 1.90 4.02 -0.77 -4.56 117.16 119.30 1nb4 n TYR 555 Ca -0.16 -0.43 0.00 0.00 -0.01 0.00 0.00 57.90 57.30 1nb4 n TYR 555 Cb 0.54 -0.12 0.00 0.00 -0.02 0.00 0.00 39.34 39.73 1nb4 n TYR 555 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1nb4 n SER 556 N 0.14 0.00 -0.03 7.72 3.41 -1.25 0.32 113.62 123.93 1nb4 n SER 556 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1nb4 n SER 556 Cb 0.95 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.90 1nb4 n SER 556 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nb4 n GLY 557 N 0.00 -0.39 3.70 5.00 0.00 -1.25 -4.59 105.19 107.66 1nb4 n GLY 557 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1nb4 n GLY 557 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nb4 s GLY 558 N -1.50 1.57 -0.60 -0.02 0.00 0.15 -3.35 107.32 103.57 1nb4 s GLY 558 Ca 0.00 -0.39 0.06 0.00 0.00 0.00 0.00 44.72 44.38 1nb4 s GLY 558 CO 0.00 0.20 0.85 1.34 0.00 0.00 0.00 173.10 175.49 1nb4 n ASP 559 N -4.07 4.03 -4.57 1.64 2.03 -1.26 -4.98 116.55 109.38 1nb4 n ASP 559 Ca 0.06 -3.55 -0.34 0.00 0.52 0.00 0.00 54.79 51.47 1nb4 n ASP 559 Cb 0.58 -0.61 -0.11 0.00 -0.72 0.00 0.00 41.12 40.25 1nb4 n ASP 559 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1nb4 s ILE 560 N -3.51 4.03 -0.00 5.18 -1.09 -1.26 -4.40 121.20 120.15 1nb4 s ILE 560 Ca 0.45 -0.33 0.07 0.00 -2.23 0.00 0.00 60.65 58.61 1nb4 s ILE 560 Cb 0.22 -2.74 -0.02 0.00 -1.58 0.00 0.00 42.46 38.35 1nb4 s ILE 560 CO -0.08 0.53 -0.22 -0.47 -1.23 0.00 0.00 174.94 173.47 1nb4 s TYR 561 N -0.12 1.96 0.00 3.97 5.04 -0.09 -2.12 117.35 126.00 1nb4 s TYR 561 Ca 0.03 -0.37 0.00 0.00 -2.44 0.00 0.00 57.07 54.29 1nb4 s TYR 561 Cb -0.13 -1.24 0.00 0.00 0.35 0.00 0.00 41.96 40.94 1nb4 s TYR 561 CO 0.02 0.00 0.77 0.72 -1.34 0.00 0.00 175.55 175.73 1nb4 n HIS 562 N 2.36 0.00 0.00 4.97 8.25 -0.23 -4.66 115.22 125.91 1nb4 n HIS 562 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.30 1nb4 n HIS 562 Cb 0.53 0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.66 1nb4 n HIS 562 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1nb4 n SER 563 N 0.00 0.00 -3.71 0.41 7.64 -1.24 -4.72 113.62 112.00 1nb4 n SER 563 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.82 1nb4 n SER 563 Cb 0.62 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.80 1nb4 n SER 563 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1nb4 s LEU 564 N 0.00 -0.25 0.00 -3.43 -0.00 -1.21 -4.71 118.68 109.07 1nb4 s LEU 564 Ca 0.00 -0.34 0.00 0.00 -0.00 0.00 0.00 54.13 53.79 1nb4 s LEU 564 Cb 0.00 2.26 0.00 0.00 -0.00 0.00 0.00 46.19 48.45 1nb4 s LEU 564 CO 0.00 -0.94 0.00 -1.54 -0.00 0.00 0.00 176.35 173.87