#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xm5 s SER 4002N 0.00 4.67 0.22 6.12 1.04 -1.26 -5.04 113.70 119.45 1xm5 s SER 4002Ca 0.00 -1.08 -0.03 0.00 0.48 0.00 0.00 55.95 55.31 1xm5 s SER 4002Cb 0.00 -0.07 0.20 0.00 0.10 0.00 0.00 66.02 66.24 1xm5 s SER 4002CO 0.00 -0.83 1.61 0.06 0.98 0.00 0.00 173.24 175.06 1xm5 h GLN 4003N 1.02 0.68 -6.20 4.02 -0.00 -1.93 -3.44 115.11 109.25 1xm5 h GLN 4003Ca -0.40 -0.31 -0.67 0.00 -0.00 0.00 0.00 58.65 57.27 1xm5 h GLN 4003Cb 1.28 -0.01 -0.16 0.00 -0.00 0.00 0.00 27.48 28.58 1xm5 h GLN 4003CO 0.61 0.90 -0.68 0.08 -0.00 0.00 0.00 178.83 179.75 1xm5 s VAL 4004N -4.43 3.85 -0.22 1.86 1.01 -1.26 -3.36 120.40 117.84 1xm5 s VAL 4004Ca -0.08 -0.63 -0.06 0.00 0.00 0.00 0.00 61.98 61.20 1xm5 s VAL 4004Cb 0.13 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 1xm5 s VAL 4004CO 0.83 0.44 0.04 -0.63 0.00 0.00 0.00 175.10 175.78 1xm5 s ILE 4005N -0.98 4.19 -0.08 2.22 1.01 -0.30 -4.97 121.20 122.30 1xm5 s ILE 4005Ca 0.17 -0.22 -0.12 0.00 0.00 0.00 0.00 60.65 60.47 1xm5 s ILE 4005Cb -0.11 -2.93 -0.05 0.00 0.01 0.00 0.00 42.46 39.38 1xm5 s ILE 4005CO 0.07 0.39 0.31 -0.22 0.00 0.00 0.00 174.94 175.48 1xm5 s LEU 4006N 1.26 4.39 -0.58 2.97 2.96 -1.26 -1.71 118.68 126.71 1xm5 s LEU 4006Ca 0.04 0.71 0.04 0.00 -0.22 0.00 0.00 54.13 54.71 1xm5 s LEU 4006Cb -0.15 -2.39 0.14 0.00 0.50 0.00 0.00 46.19 44.29 1xm5 s LEU 4006CO 0.02 0.29 0.35 -0.62 -1.32 0.00 0.00 176.35 175.06 1xm5 s ASP 4007N -0.64 4.43 -0.01 3.68 2.15 -0.77 -4.98 116.67 120.53 1xm5 s ASP 4007Ca 0.20 -3.31 -0.30 0.00 0.43 0.00 0.00 52.55 49.57 1xm5 s ASP 4007Cb -0.14 -1.60 -0.04 0.00 -0.30 0.00 0.00 42.92 40.84 1xm5 s ASP 4007CO 0.08 -0.18 1.10 -0.22 -0.17 0.00 0.00 175.17 175.79 1xm5 s LEU 4008N -0.69 4.33 -0.27 -1.34 2.96 -1.26 -1.21 118.68 121.20 1xm5 s LEU 4008Ca 0.20 1.79 0.02 0.00 -0.22 0.00 0.00 54.13 55.91 1xm5 s LEU 4008Cb -0.18 -3.57 0.07 0.00 0.50 0.00 0.00 46.19 43.02 1xm5 s LEU 4008CO -0.06 -0.43 -0.02 -1.10 -1.32 0.00 0.00 176.35 173.41 1xm5 s GLN 4009N 1.48 1.57 -0.59 1.98 -0.21 0.13 -4.95 119.66 119.06 1xm5 s GLN 4009Ca 0.54 -1.24 -0.20 0.00 0.02 0.00 0.00 55.36 54.49 1xm5 s GLN 4009Cb -0.24 -2.69 0.09 0.00 1.00 0.00 0.00 33.01 31.17 1xm5 s GLN 4009CO 0.25 -0.72 0.75 -0.51 -2.12 0.00 0.00 175.29 172.94 1xm5 s LEU 4010N 1.28 5.11 -0.57 2.90 1.02 -1.26 -0.23 118.68 126.93 1xm5 s LEU 4010Ca -0.01 -1.25 0.06 0.00 0.02 0.00 0.00 54.13 52.95 1xm5 s LEU 4010Cb -0.19 -2.36 0.33 0.00 0.02 0.00 0.00 46.19 44.00 1xm5 s LEU 4010CO -0.09 -1.15 0.91 0.00 0.02 0.00 0.00 176.35 176.05 1xm5 n ALA 4011N 6.59 4.40 -2.66 4.21 0.00 0.27 -4.96 120.51 128.35 1xm5 n ALA 4011Ca -0.08 -4.60 -0.31 0.00 0.00 0.00 0.00 53.44 48.46 1xm5 n ALA 4011Cb 0.43 -0.76 -0.06 0.00 0.00 0.00 0.00 19.45 19.06 1xm5 n ALA 4011CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xm5 h GLU 4013N 1.24 -0.17 0.00 0.00 5.08 -1.97 -3.40 114.58 115.36 1xm5 h GLU 4013Ca -0.42 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1xm5 h GLU 4013Cb 1.31 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1xm5 h GLU 4013CO 0.71 0.19 0.00 -3.47 -1.00 0.00 0.00 179.01 175.43 1xm5 n ASP 4014N -4.87 0.00 0.00 1.42 2.03 -1.26 -4.93 116.55 108.94 1xm5 n ASP 4014Ca -0.06 0.36 0.00 0.00 0.52 0.00 0.00 54.79 55.61 1xm5 n ASP 4014Cb 0.22 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.62 1xm5 n ASP 4014CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1xm5 n ASN 4015N -0.40 -1.83 -4.51 1.67 3.02 -1.26 -5.06 115.26 106.90 1xm5 n ASN 4015Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.30 1xm5 n ASN 4015Cb 0.00 -0.42 -0.10 0.00 -0.61 0.00 0.00 39.78 38.65 1xm5 n ASN 4015CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1xm5 s SER 4016N -2.84 3.81 -1.57 6.41 0.01 -1.26 -4.72 113.70 113.54 1xm5 s SER 4016Ca 0.00 -0.89 -0.01 0.00 1.31 0.00 0.00 55.95 56.37 1xm5 s SER 4016Cb 0.00 -0.44 0.00 0.00 0.21 0.00 0.00 66.02 65.79 1xm5 s SER 4016CO 0.00 0.05 0.09 0.61 0.41 0.00 0.00 173.24 174.40 1xm5 n GLY 4017N -0.46 -0.41 3.62 3.44 0.00 -1.26 -5.00 105.19 105.12 1xm5 n GLY 4017Ca -0.07 -0.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 1xm5 n GLY 4017CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xm5 s LEU 4018N -5.51 3.14 0.98 0.99 1.43 -1.26 -5.10 118.68 113.35 1xm5 s LEU 4018Ca 0.05 -0.51 -0.15 0.00 -1.03 0.00 0.00 54.13 52.48 1xm5 s LEU 4018Cb -0.02 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 1xm5 s LEU 4018CO 0.06 0.08 -0.14 -2.65 0.23 0.00 0.00 176.35 173.93 1xm5 n PRO 4019N -0.15 -0.20 -3.52 1.29 -0.02 -1.26 -4.95 135.00 126.18 1xm5 n PRO 4019Ca -0.10 -0.03 -0.32 0.00 -2.02 0.00 0.00 63.50 61.03 1xm5 n PRO 4019Cb 0.56 -1.48 -0.05 0.00 -0.02 0.00 0.00 33.50 32.50 1xm5 n PRO 4019CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1xm5 s GLU 4020N -2.93 3.73 0.37 -0.52 2.02 -1.26 -4.94 118.70 115.17 1xm5 s GLU 4020Ca 0.49 0.13 0.16 0.00 0.02 0.00 0.00 54.97 55.77 1xm5 s GLU 4020Cb -0.19 -2.74 1.04 0.00 0.10 0.00 0.00 34.13 32.34 1xm5 s GLU 4020CO 0.74 0.39 1.75 1.49 0.02 0.00 0.00 175.26 179.64 1xm5 h GLU 4021N 2.70 0.43 -0.27 1.61 4.81 -1.99 1.04 114.58 122.90 1xm5 h GLU 4021Ca -0.47 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 58.75 1xm5 h GLU 4021Cb 1.17 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 1xm5 h GLU 4021CO 0.70 0.29 0.18 0.77 -0.73 0.00 0.00 179.01 180.22 1xm5 h SER 4022N 0.45 0.29 0.13 1.04 0.02 -2.00 -0.68 113.55 112.80 1xm5 h SER 4022Ca 0.62 -0.01 -0.26 0.00 -0.84 0.00 0.00 61.79 61.31 1xm5 h SER 4022Cb 1.45 -0.07 0.03 0.00 0.14 0.00 0.00 62.40 63.95 1xm5 h SER 4022CO -0.37 0.21 -1.09 1.56 -1.14 0.00 0.00 176.83 176.01 1xm5 h GLN 4023N 0.35 0.51 -0.81 3.45 4.20 0.72 -2.87 115.11 120.66 1xm5 h GLN 4023Ca 0.10 -0.72 0.00 0.00 0.06 0.00 0.00 58.65 58.09 1xm5 h GLN 4023Cb -0.01 0.24 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 1xm5 h GLN 4023CO -0.02 1.32 0.52 0.74 -0.67 0.00 0.00 178.83 180.72 1xm5 h PHE 4024N 0.06 1.03 -0.50 2.96 -1.00 -0.88 -0.87 116.94 117.74 1xm5 h PHE 4024Ca -0.17 0.02 0.02 0.00 2.81 0.00 0.00 57.97 60.65 1xm5 h PHE 4024Cb 1.80 -0.35 -0.03 0.00 3.61 0.00 0.00 35.95 40.98 1xm5 h PHE 4024CO 0.14 0.66 0.30 1.96 -1.61 0.00 0.00 178.31 179.76 1xm5 h GLN 4025N 1.10 0.58 -0.43 1.51 1.08 -1.18 0.08 115.11 117.85 1xm5 h GLN 4025Ca 0.29 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.44 1xm5 h GLN 4025Cb -0.10 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.18 1xm5 h GLN 4025CO -0.06 0.38 0.17 1.15 -0.95 0.00 0.00 178.83 179.53 1xm5 h THR 4026N 0.60 1.20 -0.47 -0.54 2.02 -1.20 0.33 112.91 114.85 1xm5 h THR 4026Ca 0.20 -0.61 -0.06 0.00 0.77 0.00 0.00 66.41 66.72 1xm5 h THR 4026Cb 0.02 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 1xm5 h THR 4026CO -0.09 0.22 0.07 -0.50 0.37 0.00 0.00 175.52 175.59 1xm5 h TRP 4027N 0.55 0.83 -0.03 3.16 6.55 -0.86 -2.65 115.95 123.50 1xm5 h TRP 4027Ca 0.14 -0.12 -0.00 0.00 0.95 0.00 0.00 58.89 59.87 1xm5 h TRP 4027Cb 0.18 -0.23 -0.00 0.00 -0.86 0.00 0.00 29.16 28.26 1xm5 h TRP 4027CO -0.00 0.77 0.02 1.25 -1.05 0.00 0.00 178.44 179.43 1xm5 h LEU 4028N 0.64 0.04 -2.00 -4.49 5.85 -0.80 -2.84 115.31 111.72 1xm5 h LEU 4028Ca 0.14 -0.08 0.19 0.00 0.84 0.00 0.00 57.88 58.97 1xm5 h LEU 4028Cb 0.39 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 1xm5 h LEU 4028CO 0.01 0.11 0.49 0.78 -0.34 0.00 0.00 178.44 179.48 1xm5 h ASN 4029N -0.03 0.00 0.95 1.25 2.35 -0.16 -0.77 115.58 119.18 1xm5 h ASN 4029Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1xm5 h ASN 4029Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1xm5 h ASN 4029CO -0.00 0.00 -0.33 0.00 -1.65 0.00 0.00 177.43 175.45 1xm5 n ALA 4030N -2.63 2.80 -0.06 -0.83 0.00 -1.02 -4.54 120.51 114.24 1xm5 n ALA 4030Ca 0.13 -0.19 -0.10 0.00 0.00 0.00 0.00 53.44 53.27 1xm5 n ALA 4030Cb 0.74 -1.29 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 1xm5 n ALA 4030CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xm5 n VAL 4031N -1.88 1.24 -2.13 0.00 0.31 -0.35 -4.94 118.33 110.59 1xm5 n VAL 4031Ca 0.05 0.07 -0.42 0.00 -0.01 0.00 0.00 64.34 64.02 1xm5 n VAL 4031Cb 0.39 -1.95 -0.03 0.00 -0.91 0.00 0.00 33.84 31.35 1xm5 n VAL 4031CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1xm5 s ILE 4032N -2.48 3.66 0.66 2.52 -1.09 -0.87 -4.98 121.20 118.62 1xm5 s ILE 4032Ca -0.20 0.93 -0.14 0.00 -2.23 0.00 0.00 60.65 59.01 1xm5 s ILE 4032Cb 0.05 -3.60 -0.00 0.00 -1.58 0.00 0.00 42.46 37.33 1xm5 s ILE 4032CO 0.28 -0.05 1.08 -2.16 -1.23 0.00 0.00 174.94 172.86 1xm5 s PRO 4033N 3.24 2.95 -0.68 2.79 0.04 -1.26 -4.82 135.00 137.25 1xm5 s PRO 4033Ca 0.68 1.22 -0.27 0.00 0.04 0.00 0.00 61.00 62.66 1xm5 s PRO 4033Cb -0.32 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1xm5 s PRO 4033CO 0.27 -1.11 1.58 -1.14 0.04 0.00 0.00 177.00 176.64 1xm5 s GLN 4034N -4.36 2.90 0.85 4.56 2.00 -1.26 -4.92 119.66 119.44 1xm5 s GLN 4034Ca 0.63 0.18 -0.13 0.00 -2.00 0.00 0.00 55.36 54.04 1xm5 s GLN 4034Cb -0.17 -4.31 0.19 0.00 0.80 0.00 0.00 33.01 29.53 1xm5 s GLN 4034CO 0.44 -2.46 1.16 1.19 -0.50 0.00 0.00 175.29 175.12 1xm5 n PHE 4035N 11.14 -3.88 0.82 1.67 3.01 -1.26 -4.96 117.46 123.99 1xm5 n PHE 4035Ca 0.12 -1.11 0.13 0.00 1.01 0.00 0.00 57.45 57.60 1xm5 n PHE 4035Cb 0.51 -0.89 0.49 0.00 -0.01 0.00 0.00 39.48 39.57 1xm5 n PHE 4035CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1xm5 n GLN 4036N -3.43 0.13 -4.55 -1.08 1.13 -1.26 -4.78 117.38 103.54 1xm5 n GLN 4036Ca 0.15 0.10 -0.26 0.00 -1.94 0.00 0.00 57.00 55.04 1xm5 n GLN 4036Cb 0.52 -1.64 -0.11 0.00 0.11 0.00 0.00 30.24 29.12 1xm5 n GLN 4036CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1xm5 s GLU 4037N -3.05 1.83 0.18 -1.09 2.56 -1.26 -5.10 118.70 112.78 1xm5 s GLU 4037Ca 0.12 -1.96 -0.30 0.00 0.00 0.00 0.00 54.97 52.83 1xm5 s GLU 4037Cb 0.16 -1.67 -0.08 0.00 2.00 0.00 0.00 34.13 34.53 1xm5 s GLU 4037CO 0.58 0.10 1.30 -1.21 -0.56 0.00 0.00 175.26 175.47 1xm5 s GLU 4038N -3.63 4.39 -0.11 4.30 2.02 -1.26 -5.02 118.70 119.40 1xm5 s GLU 4038Ca 0.33 2.03 -0.01 0.00 0.02 0.00 0.00 54.97 57.33 1xm5 s GLU 4038Cb 0.04 -3.21 -0.03 0.00 0.10 0.00 0.00 34.13 31.03 1xm5 s GLU 4038CO 0.17 -0.26 -0.05 -1.54 0.02 0.00 0.00 175.26 173.60 1xm5 s SER 4039N 0.42 4.77 0.03 -0.19 1.04 -1.22 -4.29 113.70 114.26 1xm5 s SER 4039Ca 0.57 -0.05 0.09 0.00 0.48 0.00 0.00 55.95 57.04 1xm5 s SER 4039Cb -0.36 -1.47 -0.03 0.00 0.10 0.00 0.00 66.02 64.27 1xm5 s SER 4039CO 0.37 0.28 -0.25 -1.61 0.98 0.00 0.00 173.24 173.01 1xm5 s GLU 4040N -0.33 1.81 -0.02 4.02 2.02 -0.38 -1.15 118.70 124.67 1xm5 s GLU 4040Ca 0.05 -1.04 0.02 0.00 0.02 0.00 0.00 54.97 54.02 1xm5 s GLU 4040Cb -0.12 -1.92 0.01 0.00 0.10 0.00 0.00 34.13 32.20 1xm5 s GLU 4040CO 0.02 0.50 -0.06 0.54 0.02 0.00 0.00 175.26 176.29 1xm5 s VAL 4041N -0.75 0.54 -0.23 2.63 0.11 -0.69 -0.86 120.40 121.15 1xm5 s VAL 4041Ca 0.11 -0.21 -0.13 0.00 -2.93 0.00 0.00 61.98 58.82 1xm5 s VAL 4041Cb -0.10 -0.51 -0.05 0.00 -1.53 0.00 0.00 36.38 34.19 1xm5 s VAL 4041CO 0.01 0.19 0.26 -0.89 -3.33 0.00 0.00 175.10 171.34 1xm5 s THR 4042N 0.37 5.29 -0.23 5.04 2.01 -0.74 -1.85 115.64 125.54 1xm5 s THR 4042Ca -0.05 0.39 0.01 0.00 0.31 0.00 0.00 61.69 62.35 1xm5 s THR 4042Cb -0.09 -3.59 0.04 0.00 0.01 0.00 0.00 72.50 68.86 1xm5 s THR 4042CO 0.00 0.29 -0.13 -0.51 -0.69 0.00 0.00 174.62 173.58 1xm5 s ILE 4043N 1.29 2.35 -0.20 1.82 -1.16 -0.35 -0.83 121.20 124.12 1xm5 s ILE 4043Ca 0.12 -1.21 -0.06 0.00 -0.51 0.00 0.00 60.65 58.99 1xm5 s ILE 4043Cb -0.14 -2.19 -0.03 0.00 0.61 0.00 0.00 42.46 40.71 1xm5 s ILE 4043CO 0.07 0.24 0.04 -0.60 -2.81 0.00 0.00 174.94 171.87 1xm5 s ARG 4044N 1.24 3.76 -0.23 3.50 3.52 0.79 0.21 118.95 131.74 1xm5 s ARG 4044Ca -0.01 -0.45 -0.11 0.00 -0.13 0.00 0.00 55.73 55.03 1xm5 s ARG 4044Cb -0.17 -3.17 -0.05 0.00 -1.56 0.00 0.00 34.95 30.01 1xm5 s ARG 4044CO -0.08 0.08 0.16 0.08 -0.81 0.00 0.00 175.30 174.74 1xm5 s VAL 4045N 0.86 5.37 0.40 7.11 1.01 0.69 -0.12 120.40 135.72 1xm5 s VAL 4045Ca 0.02 0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.25 1xm5 s VAL 4045Cb -0.14 -3.50 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 1xm5 s VAL 4045CO 0.02 0.37 0.15 0.68 0.00 0.00 0.00 175.10 176.32 1xm5 s VAL 4046N 0.89 0.49 0.26 2.92 -7.23 0.77 -0.57 120.40 117.93 1xm5 s VAL 4046Ca 0.08 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.31 1xm5 s VAL 4046Cb -0.13 -2.36 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 1xm5 s VAL 4046CO 0.03 0.00 0.33 -1.81 -0.31 0.00 0.00 175.10 173.34 1xm5 s ASP 4047N -3.57 6.04 0.31 4.85 -0.00 -1.26 -2.19 116.67 120.83 1xm5 s ASP 4047Ca 0.26 -0.07 0.02 0.00 -0.00 0.00 0.00 52.55 52.76 1xm5 s ASP 4047Cb 0.02 -1.63 0.76 0.00 -0.00 0.00 0.00 42.92 42.07 1xm5 s ASP 4047CO 0.16 -0.12 1.58 0.71 -0.00 0.00 0.00 175.17 177.50 1xm5 h THR 4048N 1.21 0.06 -0.11 -1.27 1.35 -1.97 -2.71 112.91 109.47 1xm5 h THR 4048Ca -0.50 -0.01 0.02 0.00 -0.55 0.00 0.00 66.41 65.37 1xm5 h THR 4048Cb 1.24 0.03 -0.04 0.00 -1.73 0.00 0.00 68.15 67.65 1xm5 h THR 4048CO 0.60 0.01 -0.30 0.00 -0.25 0.00 0.00 175.52 175.57 1xm5 h ALA 4049N 1.95 -0.66 -0.53 6.62 0.00 -1.98 0.53 119.26 125.19 1xm5 h ALA 4049Ca 0.59 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.53 1xm5 h ALA 4049Cb 1.23 0.85 -0.05 0.00 0.00 0.00 0.00 17.79 19.82 1xm5 h ALA 4049CO -0.88 -0.78 0.26 1.49 0.00 0.00 0.00 179.25 179.34 1xm5 h GLU 4050N -0.30 0.49 0.32 0.00 4.81 -1.90 -0.20 114.58 117.80 1xm5 h GLU 4050Ca 0.02 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1xm5 h GLU 4050Cb 0.37 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1xm5 h GLU 4050CO -0.26 0.32 -0.27 1.03 -0.73 0.00 0.00 179.01 179.10 1xm5 h SER 4051N 0.50 -0.71 -0.40 1.04 0.87 -1.24 -0.47 113.55 113.14 1xm5 h SER 4051Ca 0.24 0.06 0.08 0.00 -1.23 0.00 0.00 61.79 60.94 1xm5 h SER 4051Cb 0.17 0.23 -0.08 0.00 -0.44 0.00 0.00 62.40 62.28 1xm5 h SER 4051CO -0.18 -0.40 -0.12 -0.74 -0.53 0.00 0.00 176.83 174.86 1xm5 h HIS 4052N -0.60 -0.27 -0.36 2.24 -0.00 0.45 0.77 115.15 117.38 1xm5 h HIS 4052Ca -0.02 0.04 0.02 0.00 -0.00 0.00 0.00 60.37 60.41 1xm5 h HIS 4052Cb 0.53 0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 28.10 1xm5 h HIS 4052CO -0.15 -0.20 0.19 1.03 -0.00 0.00 0.00 177.93 178.80 1xm5 h SER 4053N -0.03 0.30 -0.77 3.26 0.87 -0.83 -2.52 113.55 113.83 1xm5 h SER 4053Ca 0.20 0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.71 1xm5 h SER 4053Cb 0.33 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.20 1xm5 h SER 4053CO -0.43 0.22 0.27 -0.07 -0.53 0.00 0.00 176.83 176.29 1xm5 h LEU 4054N 0.40 1.09 -1.55 2.23 4.07 -0.22 -1.79 115.31 119.55 1xm5 h LEU 4054Ca 0.15 -0.19 0.00 0.00 0.08 0.00 0.00 57.88 57.92 1xm5 h LEU 4054Cb 0.04 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 41.49 1xm5 h LEU 4054CO -0.09 0.99 0.00 -1.13 -1.08 0.00 0.00 178.44 177.13 1xm5 h ASN 4055N 1.13 0.00 0.05 -0.43 -1.24 -0.61 -2.28 115.58 112.20 1xm5 h ASN 4055Ca 0.25 0.00 -0.34 0.00 0.71 0.00 0.00 56.30 56.92 1xm5 h ASN 4055Cb 0.27 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.28 1xm5 h ASN 4055CO -0.01 0.00 -1.92 -0.11 -1.29 0.00 0.00 177.43 174.10 1xm5 n LEU 4056N -2.70 2.36 -0.44 0.34 7.94 -0.91 -0.74 117.00 122.84 1xm5 n LEU 4056Ca -0.00 0.24 0.02 0.00 -1.11 0.00 0.00 56.01 55.16 1xm5 n LEU 4056Cb 0.19 -1.00 0.07 0.00 0.53 0.00 0.00 43.42 43.21 1xm5 n LEU 4056CO 0.21 0.65 0.50 1.07 -1.11 0.00 0.00 177.39 178.71 1xm5 n THR 4057N -3.85 0.32 0.00 1.96 5.66 -0.72 -1.76 114.28 115.89 1xm5 n THR 4057Ca -0.37 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.40 1xm5 n THR 4057Cb 0.90 -0.07 0.00 0.00 -1.55 0.00 0.00 70.33 69.61 1xm5 n THR 4057CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 1xm5 n TYR 4058N 0.01 0.00 -0.29 1.09 4.02 -0.87 -4.88 117.16 116.23 1xm5 n TYR 4058Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1xm5 n TYR 4058Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.55 1xm5 n TYR 4058CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1xm5 n ARG 4059N -0.09 0.80 -1.72 -0.72 5.12 -0.92 -5.01 116.66 114.11 1xm5 n ARG 4059Ca 0.00 -0.20 -0.17 0.00 -1.93 0.00 0.00 57.85 55.55 1xm5 n ARG 4059Cb 0.00 -0.64 -0.05 0.00 -1.16 0.00 0.00 32.46 30.60 1xm5 n ARG 4059CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1xm5 n GLY 4060N 0.17 1.12 3.84 -0.13 0.00 -0.72 -4.91 105.19 104.56 1xm5 n GLY 4060Ca 0.00 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 1xm5 n GLY 4060CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xm5 s LYS 4061N -3.83 3.20 -0.89 1.61 -0.14 0.08 -4.90 119.74 114.87 1xm5 s LYS 4061Ca 0.00 -0.47 0.00 0.00 -1.36 0.00 0.00 55.97 54.14 1xm5 s LYS 4061Cb 0.00 -2.93 0.34 0.00 -1.68 0.00 0.00 37.83 33.56 1xm5 s LYS 4061CO 0.00 0.63 1.69 -3.47 -0.76 0.00 0.00 175.35 173.45 1xm5 n ASP 4062N 0.82 6.81 -3.61 2.83 4.64 -1.26 -2.59 116.55 124.20 1xm5 n ASP 4062Ca -0.10 -3.72 -0.04 0.00 -1.38 0.00 0.00 54.79 49.54 1xm5 n ASP 4062Cb 0.52 -1.01 -0.02 0.00 -1.04 0.00 0.00 41.12 39.57 1xm5 n ASP 4062CO 0.00 0.00 0.00 -1.59 -0.82 0.00 0.00 177.20 174.79 1xm5 s LYS 4063N -4.10 0.26 0.78 -0.67 0.00 -1.26 -5.11 119.74 109.63 1xm5 s LYS 4063Ca 0.44 -0.07 -0.12 0.00 0.00 0.00 0.00 55.97 56.22 1xm5 s LYS 4063Cb 0.27 0.12 0.06 0.00 0.00 0.00 0.00 37.83 38.28 1xm5 s LYS 4063CO -0.20 -0.11 1.11 -1.25 0.00 0.00 0.00 175.35 174.90 1xm5 s PRO 4064N -2.15 2.27 0.32 1.78 0.04 -1.26 -4.53 135.00 131.46 1xm5 s PRO 4064Ca 0.09 0.49 0.04 0.00 0.04 0.00 0.00 61.00 61.66 1xm5 s PRO 4064Cb -0.01 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 1xm5 s PRO 4064CO -0.04 -1.46 0.18 0.95 0.04 0.00 0.00 177.00 176.67 1xm5 s THR 4065N -3.28 0.27 -0.03 1.26 -4.23 -1.26 -4.92 115.64 103.45 1xm5 s THR 4065Ca 0.60 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.96 1xm5 s THR 4065Cb -0.13 -2.48 -0.08 0.00 1.34 0.00 0.00 72.50 71.15 1xm5 s THR 4065CO 0.53 0.00 0.63 -0.55 -0.54 0.00 0.00 174.62 174.69 1xm5 h ASN 4066N 2.15 -0.45 -4.40 3.99 7.08 -1.89 -3.34 115.58 118.71 1xm5 h ASN 4066Ca -0.32 0.02 -0.66 0.00 -3.08 0.00 0.00 56.30 52.26 1xm5 h ASN 4066Cb 1.25 0.12 -0.28 0.00 -2.08 0.00 0.00 38.32 37.33 1xm5 h ASN 4066CO 0.49 -0.04 -0.87 -0.69 -2.08 0.00 0.00 177.43 174.23 1xm5 s VAL 4067N -3.29 1.94 -0.07 6.14 1.01 -1.26 -0.99 120.40 123.87 1xm5 s VAL 4067Ca -0.08 -1.19 0.03 0.00 0.00 0.00 0.00 61.98 60.74 1xm5 s VAL 4067Cb 0.01 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.76 1xm5 s VAL 4067CO 0.23 0.41 -0.15 -0.22 0.00 0.00 0.00 175.10 175.37 1xm5 s LEU 4068N -0.92 1.77 -0.13 3.92 2.96 0.76 -4.97 118.68 122.07 1xm5 s LEU 4068Ca 0.10 -0.37 -0.03 0.00 -0.22 0.00 0.00 54.13 53.61 1xm5 s LEU 4068Cb -0.09 -0.98 -0.03 0.00 0.50 0.00 0.00 46.19 45.59 1xm5 s LEU 4068CO 0.01 0.07 -0.03 -0.44 -1.32 0.00 0.00 176.35 174.64 1xm5 s SER 4069N 0.57 4.94 -0.61 3.68 0.01 -1.26 -1.25 113.70 119.78 1xm5 s SER 4069Ca -0.16 -0.04 0.05 0.00 1.31 0.00 0.00 55.95 57.12 1xm5 s SER 4069Cb -0.16 -1.65 0.19 0.00 0.21 0.00 0.00 66.02 64.61 1xm5 s SER 4069CO 0.05 0.24 0.52 0.49 0.41 0.00 0.00 173.24 174.95 1xm5 n PHE 4070N 3.06 2.19 -2.11 2.43 3.01 0.13 -4.99 117.46 121.18 1xm5 n PHE 4070Ca -0.18 -4.02 -0.41 0.00 1.01 0.00 0.00 57.45 53.86 1xm5 n PHE 4070Cb 0.53 -0.41 -0.02 0.00 -0.01 0.00 0.00 39.48 39.57 1xm5 n PHE 4070CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1xm5 s PRO 4071N -1.33 4.34 0.12 -1.08 0.04 -1.26 -1.15 135.00 134.67 1xm5 s PRO 4071Ca 0.30 2.19 -0.04 0.00 0.04 0.00 0.00 61.00 63.49 1xm5 s PRO 4071Cb 0.03 -3.13 -0.05 0.00 0.04 0.00 0.00 34.50 31.39 1xm5 s PRO 4071CO -0.14 -0.29 0.34 -0.06 0.04 0.00 0.00 177.00 176.89 1xm5 s PHE 4072N -0.29 3.49 -0.09 0.56 0.08 -0.23 -4.91 117.98 116.59 1xm5 s PHE 4072Ca 0.55 0.51 -0.23 0.00 0.12 0.00 0.00 56.93 57.88 1xm5 s PHE 4072Cb -0.39 -1.97 -0.03 0.00 -0.57 0.00 0.00 43.02 40.06 1xm5 s PHE 4072CO 0.44 0.47 0.71 -1.21 -0.10 0.00 0.00 175.22 175.53 1xm5 s GLU 4073N -2.56 4.41 -0.19 0.44 2.02 -1.26 -4.83 118.70 116.72 1xm5 s GLU 4073Ca 0.39 0.87 -0.27 0.00 0.02 0.00 0.00 54.97 55.98 1xm5 s GLU 4073Cb -0.12 -3.47 -0.00 0.00 0.10 0.00 0.00 34.13 30.63 1xm5 s GLU 4073CO 0.25 -0.00 0.93 0.54 0.02 0.00 0.00 175.26 176.99 1xm5 s VAL 4074N 1.03 4.79 0.22 2.63 0.11 -1.26 -4.98 120.40 122.94 1xm5 s VAL 4074Ca 0.37 1.82 -0.32 0.00 -2.93 0.00 0.00 61.98 60.92 1xm5 s VAL 4074Cb -0.17 -4.22 -0.12 0.00 -1.53 0.00 0.00 36.38 30.34 1xm5 s VAL 4074CO 0.17 -0.06 1.67 -2.65 -3.33 0.00 0.00 175.10 170.90 1xm5 n PRO 4075N 5.65 2.65 -1.72 1.54 -0.02 -1.26 -4.85 135.00 136.99 1xm5 n PRO 4075Ca 0.08 0.95 -0.60 0.00 -2.02 0.00 0.00 63.50 61.91 1xm5 n PRO 4075Cb 0.48 -2.77 -0.08 0.00 -0.02 0.00 0.00 33.50 31.11 1xm5 n PRO 4075CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1xm5 n PRO 4076N 3.45 0.90 0.00 0.52 -0.04 -1.26 0.71 135.00 139.27 1xm5 n PRO 4076Ca 0.14 0.33 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 1xm5 n PRO 4076Cb 0.34 -1.97 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 1xm5 n PRO 4076CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xm5 n GLY 4077N 4.13 2.85 3.83 0.55 0.00 -1.26 -5.06 105.19 110.24 1xm5 n GLY 4077Ca 0.27 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 1xm5 n GLY 4077CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xm5 s MET 4078N 0.00 3.00 0.68 1.61 -1.94 0.22 -5.06 119.30 117.82 1xm5 s MET 4078Ca 0.00 0.83 -0.11 0.00 -1.71 0.00 0.00 55.69 54.71 1xm5 s MET 4078Cb 0.00 -2.01 0.01 0.00 2.01 0.00 0.00 34.83 34.84 1xm5 s MET 4078CO 0.00 -1.02 1.07 -1.21 -0.01 0.00 0.00 175.02 173.85 1xm5 s GLU 4079N -5.11 2.97 -0.30 2.03 2.02 -1.26 -4.75 118.70 114.30 1xm5 s GLU 4079Ca 0.58 0.45 -0.08 0.00 0.02 0.00 0.00 54.97 55.94 1xm5 s GLU 4079Cb -0.13 -2.06 0.00 0.00 0.10 0.00 0.00 34.13 32.04 1xm5 s GLU 4079CO 0.54 -0.93 0.10 1.41 0.02 0.00 0.00 175.26 176.41 1xm5 s MET 4080N -5.29 3.19 0.00 1.61 -2.45 -1.26 -4.81 119.30 110.28 1xm5 s MET 4080Ca 0.57 -0.80 0.00 0.00 -1.25 0.00 0.00 55.69 54.21 1xm5 s MET 4080Cb -0.11 -3.44 0.00 0.00 1.25 0.00 0.00 34.83 32.53 1xm5 s MET 4080CO 0.51 -0.43 0.00 -1.13 1.05 0.00 0.00 175.02 175.03 1xm5 n SER 4081N 4.91 0.00 -4.55 1.11 3.41 -1.26 -4.69 113.62 112.54 1xm5 n SER 4081Ca -0.14 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.08 1xm5 n SER 4081Cb 0.48 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.40 1xm5 n SER 4081CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1xm5 s LEU 4082N -1.99 3.33 0.51 1.04 0.20 -1.26 -1.25 118.68 119.26 1xm5 s LEU 4082Ca 0.00 0.56 0.30 0.00 0.69 0.00 0.00 54.13 55.68 1xm5 s LEU 4082Cb 0.00 -2.60 1.09 0.00 -0.43 0.00 0.00 46.19 44.26 1xm5 s LEU 4082CO 0.00 -2.43 1.89 -0.07 -0.29 0.00 0.00 176.35 175.44 1xm5 h LEU 4083N 16.86 0.00 0.00 -0.68 3.38 -1.35 -3.43 115.31 130.10 1xm5 h LEU 4083Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1xm5 h LEU 4083Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1xm5 h LEU 4083CO 1.19 0.05 0.00 0.61 0.09 0.00 0.00 178.44 180.38 1xm5 n GLY 4084N 0.26 0.97 3.37 0.83 0.00 -1.26 -1.07 105.19 108.29 1xm5 n GLY 4084Ca 0.01 -1.88 -0.23 0.00 0.00 0.00 0.00 46.02 43.92 1xm5 n GLY 4084CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xm5 s ASP 4085N -4.00 2.97 -0.21 1.61 1.01 -0.30 -1.78 116.67 115.98 1xm5 s ASP 4085Ca 0.00 -0.89 0.01 0.00 0.71 0.00 0.00 52.55 52.37 1xm5 s ASP 4085Cb 0.00 -0.20 0.05 0.00 1.01 0.00 0.00 42.92 43.78 1xm5 s ASP 4085CO 0.00 0.00 -0.07 -0.76 0.21 0.00 0.00 175.17 174.55 1xm5 s LEU 4086N -2.81 2.24 -0.35 1.23 1.43 -0.01 -0.69 118.68 119.72 1xm5 s LEU 4086Ca 0.19 -0.95 -0.11 0.00 -1.03 0.00 0.00 54.13 52.23 1xm5 s LEU 4086Cb -0.06 -1.15 0.01 0.00 0.03 0.00 0.00 46.19 45.02 1xm5 s LEU 4086CO 0.08 -0.19 0.20 -0.69 0.23 0.00 0.00 176.35 175.99 1xm5 s VAL 4087N 1.45 4.75 -0.10 -1.59 1.01 -0.38 -0.15 120.40 125.39 1xm5 s VAL 4087Ca -0.03 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.37 1xm5 s VAL 4087Cb -0.17 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 1xm5 s VAL 4087CO -0.07 -0.11 -0.13 -0.63 0.00 0.00 0.00 175.10 174.16 1xm5 s ILE 4088N 1.61 3.14 -0.34 2.22 1.01 0.83 -0.17 121.20 129.50 1xm5 s ILE 4088Ca 0.04 -0.65 -0.16 0.00 0.00 0.00 0.00 60.65 59.88 1xm5 s ILE 4088Cb -0.18 -2.29 -0.01 0.00 0.01 0.00 0.00 42.46 39.98 1xm5 s ILE 4088CO 0.07 0.55 0.40 0.00 0.00 0.00 0.00 174.94 175.96 1xm5 h ARG 4090N 8.46 0.58 0.33 0.00 0.11 -1.76 -1.42 114.38 120.67 1xm5 h ARG 4090Ca -0.29 -0.11 0.00 0.00 0.10 0.00 0.00 59.98 59.68 1xm5 h ARG 4090Cb 1.14 -0.09 -0.03 0.00 1.11 0.00 0.00 29.97 32.10 1xm5 h ARG 4090CO 0.72 0.57 -0.40 1.96 0.10 0.00 0.00 179.97 182.91 1xm5 h GLN 4091N 0.47 -0.75 -0.63 0.08 7.50 -1.93 0.49 115.11 120.33 1xm5 h GLN 4091Ca 0.13 0.05 0.11 0.00 0.50 0.00 0.00 58.65 59.43 1xm5 h GLN 4091Cb 0.21 0.17 -0.04 0.00 0.05 0.00 0.00 27.48 27.87 1xm5 h GLN 4091CO -0.01 -0.50 0.42 0.28 -1.50 0.00 0.00 178.83 177.53 1xm5 h VAL 4092N -0.78 0.88 0.13 -0.54 2.07 -1.86 -1.36 116.25 114.80 1xm5 h VAL 4092Ca -0.02 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1xm5 h VAL 4092Cb 0.72 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1xm5 h VAL 4092CO -0.11 0.08 -0.06 0.58 0.02 0.00 0.00 177.57 178.07 1xm5 h VAL 4093N 0.42 1.04 -0.96 2.57 2.07 -0.19 -2.91 116.25 118.29 1xm5 h VAL 4093Ca 0.30 -1.01 0.13 0.00 0.82 0.00 0.00 66.70 66.94 1xm5 h VAL 4093Cb 0.59 1.64 -0.09 0.00 -1.52 0.00 0.00 31.29 31.91 1xm5 h VAL 4093CO -0.08 0.23 0.59 -0.33 0.02 0.00 0.00 177.57 177.99 1xm5 h GLU 4094N -0.68 0.87 0.00 1.57 5.08 0.45 -2.39 114.58 119.48 1xm5 h GLU 4094Ca -0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1xm5 h GLU 4094Cb 0.51 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1xm5 h GLU 4094CO 0.03 0.57 0.00 1.63 -1.00 0.00 0.00 179.01 180.24 1xm5 n LYS 4095N -4.69 0.00 -0.06 2.33 5.02 -0.56 -2.64 118.16 117.56 1xm5 n LYS 4095Ca 0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 1xm5 n LYS 4095Cb 0.39 -0.76 0.01 0.00 -0.02 0.00 0.00 35.03 34.65 1xm5 n LYS 4095CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1xm5 n GLU 4096N -0.26 -0.03 -0.04 1.97 1.02 -1.10 0.18 120.64 122.38 1xm5 n GLU 4096Ca 0.00 0.26 -0.08 0.00 -0.02 0.00 0.00 57.16 57.32 1xm5 n GLU 4096Cb 0.00 -0.38 -0.02 0.00 -0.02 0.00 0.00 31.44 31.02 1xm5 n GLU 4096CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xm5 h ALA 4097N 0.26 -0.01 0.18 0.62 0.00 -1.48 0.18 119.26 119.00 1xm5 h ALA 4097Ca 0.06 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1xm5 h ALA 4097Cb 0.11 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1xm5 h ALA 4097CO -0.17 -0.59 -0.09 0.37 0.00 0.00 0.00 179.25 178.78 1xm5 h GLN 4098N -0.16 -0.24 0.00 0.00 4.15 0.22 0.15 115.11 119.23 1xm5 h GLN 4098Ca 0.12 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.56 1xm5 h GLN 4098Cb 0.35 0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.09 1xm5 h GLN 4098CO -0.31 -0.07 0.00 0.39 -1.93 0.00 0.00 178.83 176.92 1xm5 n GLU 4099N -5.15 0.06 0.00 1.69 1.02 -0.34 -1.93 120.64 116.00 1xm5 n GLU 4099Ca -0.09 0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1xm5 n GLU 4099Cb 0.16 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1xm5 n GLU 4099CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1xm5 n GLN 4100N -1.30 2.73 0.00 3.49 6.02 0.58 -5.00 117.38 123.90 1xm5 n GLN 4100Ca 0.02 -0.18 0.00 0.00 -0.01 0.00 0.00 57.00 56.83 1xm5 n GLN 4100Cb 0.04 -0.62 0.00 0.00 1.02 0.00 0.00 30.24 30.68 1xm5 n GLN 4100CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xm5 n GLY 4101N 0.44 2.49 3.57 1.08 0.00 0.48 -4.96 105.19 108.28 1xm5 n GLY 4101Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1xm5 n GLY 4101CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xm5 n LYS 4102N -0.83 1.13 -1.13 1.61 5.02 -1.09 -4.88 118.16 117.99 1xm5 n LYS 4102Ca 0.00 0.40 -0.34 0.00 -2.02 0.00 0.00 58.31 56.36 1xm5 n LYS 4102Cb 0.00 -1.86 0.13 0.00 -0.02 0.00 0.00 35.03 33.28 1xm5 n LYS 4102CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 1xm5 s PRO 4103N -1.82 1.65 0.03 1.97 0.02 -1.26 -4.46 135.00 131.12 1xm5 s PRO 4103Ca 0.63 1.78 -0.19 0.00 0.02 0.00 0.00 61.00 63.23 1xm5 s PRO 4103Cb -0.60 -1.77 -0.11 0.00 0.02 0.00 0.00 34.50 32.04 1xm5 s PRO 4103CO 0.57 -2.21 1.22 1.25 -0.33 0.00 0.00 177.00 177.50 1xm5 h LEU 4104N -0.86 -0.58 -0.72 -5.54 5.85 -1.90 -2.75 115.31 108.80 1xm5 h LEU 4104Ca -0.46 0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.38 1xm5 h LEU 4104Cb 1.30 0.15 -0.12 0.00 0.37 0.00 0.00 40.66 42.36 1xm5 h LEU 4104CO 0.46 -0.40 -0.44 -0.08 -0.34 0.00 0.00 178.44 177.64 1xm5 h GLU 4105N -0.73 -0.14 -0.55 1.25 4.81 -2.00 0.39 114.58 117.62 1xm5 h GLU 4105Ca -0.07 0.01 0.16 0.00 -0.13 0.00 0.00 59.36 59.33 1xm5 h GLU 4105Cb 0.53 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 1xm5 h GLU 4105CO 0.12 -0.09 0.49 0.00 -0.73 0.00 0.00 179.01 178.79 1xm5 h ALA 4106N 0.79 2.36 0.07 2.92 0.00 -1.94 0.41 119.26 123.88 1xm5 h ALA 4106Ca 0.22 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.83 1xm5 h ALA 4106Cb 0.55 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1xm5 h ALA 4106CO -0.79 -0.77 -1.42 1.25 0.00 0.00 0.00 179.25 177.52 1xm5 h HIS 4107N 0.00 0.28 0.22 0.00 -0.00 0.04 -2.97 115.15 112.72 1xm5 h HIS 4107Ca 0.26 -0.20 -0.01 0.00 -0.00 0.00 0.00 60.37 60.42 1xm5 h HIS 4107Cb 1.24 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.64 1xm5 h HIS 4107CO 0.00 1.23 -0.11 -1.49 -0.00 0.00 0.00 177.93 177.56 1xm5 h TRP 4108N 0.04 -0.27 -0.99 5.26 4.06 0.14 -2.02 115.95 122.18 1xm5 h TRP 4108Ca -0.19 -0.01 0.19 0.00 2.06 0.00 0.00 58.89 60.95 1xm5 h TRP 4108Cb 1.96 0.09 -0.10 0.00 -1.00 0.00 0.00 29.16 30.11 1xm5 h TRP 4108CO 0.04 -0.08 0.61 0.00 -3.56 0.00 0.00 178.44 175.45 1xm5 h ALA 4109N 0.34 1.81 -0.30 1.49 0.00 -1.33 0.44 119.26 121.71 1xm5 h ALA 4109Ca -0.03 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xm5 h ALA 4109Cb 0.32 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1xm5 h ALA 4109CO 0.05 -0.16 0.18 1.25 0.00 0.00 0.00 179.25 180.57 1xm5 h HIS 4110N 0.68 0.39 -0.57 0.00 6.17 -1.26 -0.96 115.15 119.61 1xm5 h HIS 4110Ca 0.55 0.00 0.06 0.00 0.71 0.00 0.00 60.37 61.69 1xm5 h HIS 4110Cb 0.97 -0.13 -0.05 0.00 2.52 0.00 0.00 27.41 30.71 1xm5 h HIS 4110CO -0.00 0.28 0.28 0.52 0.71 0.00 0.00 177.93 179.72 1xm5 h MET 4111N 0.39 0.51 -0.24 5.26 2.07 -0.22 0.47 114.93 123.17 1xm5 h MET 4111Ca 0.11 -0.03 -0.13 0.00 -2.07 0.00 0.00 59.70 57.58 1xm5 h MET 4111Cb 0.00 -0.12 -0.01 0.00 -1.87 0.00 0.00 31.60 29.61 1xm5 h MET 4111CO -0.02 0.34 -0.39 -0.39 1.07 0.00 0.00 176.91 177.52 1xm5 h VAL 4112N 0.53 1.30 -0.36 -2.22 -1.51 -1.27 0.80 116.25 113.52 1xm5 h VAL 4112Ca 0.26 -1.55 -0.12 0.00 -1.23 0.00 0.00 66.70 64.06 1xm5 h VAL 4112Cb 0.20 1.54 -0.01 0.00 -2.13 0.00 0.00 31.29 30.89 1xm5 h VAL 4112CO -0.20 0.49 -0.26 0.58 -1.23 0.00 0.00 177.57 176.95 1xm5 h VAL 4113N 0.47 1.28 -0.10 7.19 2.07 -0.36 -0.44 116.25 126.36 1xm5 h VAL 4113Ca 0.04 -1.42 -0.03 0.00 0.82 0.00 0.00 66.70 66.11 1xm5 h VAL 4113Cb 0.89 1.40 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1xm5 h VAL 4113CO 0.08 0.47 -0.07 -0.74 0.02 0.00 0.00 177.57 177.32 1xm5 h HIS 4114N 0.60 0.26 -0.24 1.57 6.17 0.01 -2.36 115.15 121.17 1xm5 h HIS 4114Ca 0.07 -0.07 0.01 0.00 0.71 0.00 0.00 60.37 61.09 1xm5 h HIS 4114Cb 0.83 -0.06 -0.02 0.00 2.52 0.00 0.00 27.41 30.69 1xm5 h HIS 4114CO 0.06 0.61 0.13 0.78 0.71 0.00 0.00 177.93 180.23 1xm5 h GLY 4115N -0.16 0.32 0.74 5.26 0.00 -0.86 -2.38 103.07 105.98 1xm5 h GLY 4115Ca 0.02 -0.10 0.08 0.00 0.00 0.00 0.00 47.33 47.33 1xm5 h GLY 4115CO 0.02 0.09 0.60 1.76 0.00 0.00 0.00 176.54 179.01 1xm5 h SER 4116N 0.28 0.90 -0.61 0.19 0.02 -1.06 0.14 113.55 113.40 1xm5 h SER 4116Ca 0.09 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.01 1xm5 h SER 4116Cb 0.00 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 1xm5 h SER 4116CO -0.05 0.55 0.21 -0.07 -1.14 0.00 0.00 176.83 176.33 1xm5 h LEU 4117N 1.00 0.90 -0.04 5.07 -0.00 -0.97 -0.30 115.31 120.97 1xm5 h LEU 4117Ca 0.42 -0.15 -0.00 0.00 -0.00 0.00 0.00 57.88 58.15 1xm5 h LEU 4117Cb 0.30 -0.23 -0.00 0.00 -0.00 0.00 0.00 40.66 40.73 1xm5 h LEU 4117CO -0.18 0.83 0.03 0.45 -0.00 0.00 0.00 178.44 179.57 1xm5 h HIS 4118N 0.94 0.06 -0.97 1.13 3.86 -0.34 -0.54 115.15 119.29 1xm5 h HIS 4118Ca 0.21 -0.00 0.24 0.00 -1.16 0.00 0.00 60.37 59.66 1xm5 h HIS 4118Cb 0.25 -0.02 -0.07 0.00 1.06 0.00 0.00 27.41 28.64 1xm5 h HIS 4118CO 0.02 0.07 0.65 -0.07 0.86 0.00 0.00 177.93 179.46 1xm5 h LEU 4119N 0.02 0.33 -1.12 2.43 4.07 -0.34 0.30 115.31 121.00 1xm5 h LEU 4119Ca 0.02 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.02 1xm5 h LEU 4119Cb 0.03 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 41.76 1xm5 h LEU 4119CO -0.00 0.10 0.00 0.18 -1.08 0.00 0.00 178.44 177.64 1xm5 n LEU 4120N -4.49 1.63 0.00 1.67 4.77 -0.19 -4.87 117.00 115.53 1xm5 n LEU 4120Ca 0.21 -0.82 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 1xm5 n LEU 4120Cb 0.83 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 1xm5 n LEU 4120CO 0.31 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1xm5 n GLY 4121N 0.90 1.58 3.72 -0.72 0.00 0.11 -5.04 105.19 105.73 1xm5 n GLY 4121Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1xm5 n GLY 4121CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xm5 s TYR 4122N -2.43 1.87 0.13 1.61 1.51 -0.29 -4.96 117.35 114.80 1xm5 s TYR 4122Ca 0.00 0.78 -0.25 0.00 -1.01 0.00 0.00 57.07 56.58 1xm5 s TYR 4122Cb 0.00 -3.42 0.07 0.00 -0.11 0.00 0.00 41.96 38.51 1xm5 s TYR 4122CO 0.00 -2.91 1.01 0.34 -1.11 0.00 0.00 175.55 172.88 1xm5 s ASP 4123N -3.86 -0.14 -0.22 2.29 2.15 -1.26 -4.36 116.67 111.27 1xm5 s ASP 4123Ca 0.67 -0.40 0.21 0.00 0.43 0.00 0.00 52.55 53.46 1xm5 s ASP 4123Cb -0.14 0.45 0.49 0.00 -0.30 0.00 0.00 42.92 43.41 1xm5 s ASP 4123CO 0.55 -0.83 1.13 0.00 -0.17 0.00 0.00 175.17 175.85 1xm5 n HIS 4124N -0.50 1.20 0.07 -5.34 1.44 -1.26 -3.41 115.22 107.43 1xm5 n HIS 4124Ca -0.06 -1.86 -0.21 0.00 -2.01 0.00 0.00 57.72 53.57 1xm5 n HIS 4124Cb 0.61 -0.23 -0.15 0.00 0.12 0.00 0.00 29.99 30.34 1xm5 n HIS 4124CO 0.00 0.00 0.00 -0.84 -2.81 0.00 0.00 176.34 172.69 1xm5 h ILE 4125N 5.28 1.02 -2.49 0.61 3.07 -1.98 -3.44 117.51 119.58 1xm5 h ILE 4125Ca -0.09 -2.61 -0.46 0.00 1.55 0.00 0.00 64.86 63.25 1xm5 h ILE 4125Cb 1.40 2.78 0.09 0.00 -0.27 0.00 0.00 36.82 40.81 1xm5 h ILE 4125CO 0.23 0.84 0.13 -1.61 -1.05 0.00 0.00 178.15 176.69 1xm5 s GLU 4126N -2.59 1.70 -0.08 0.16 0.41 -1.26 -5.00 118.70 112.04 1xm5 s GLU 4126Ca -0.13 -0.94 0.04 0.00 -0.41 0.00 0.00 54.97 53.52 1xm5 s GLU 4126Cb 0.06 -2.29 -0.25 0.00 -1.78 0.00 0.00 34.13 29.87 1xm5 s GLU 4126CO 0.86 -1.45 0.53 -0.25 -0.49 0.00 0.00 175.26 174.46 1xm5 n ASP 4127N -2.88 1.46 -0.00 -0.19 8.00 -1.26 -3.04 116.55 118.63 1xm5 n ASP 4127Ca 0.14 0.32 -0.18 0.00 0.71 0.00 0.00 54.79 55.78 1xm5 n ASP 4127Cb 0.60 -0.44 -0.09 0.00 -0.02 0.00 0.00 41.12 41.18 1xm5 n ASP 4127CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 1xm5 h ASP 4128N 0.03 0.82 -0.15 -2.24 2.03 -1.99 -2.96 116.42 111.96 1xm5 h ASP 4128Ca -0.35 -0.68 -0.04 0.00 -0.73 0.00 0.00 57.03 55.23 1xm5 h ASP 4128Cb 2.03 -0.25 -0.00 0.00 -0.83 0.00 0.00 39.33 40.27 1xm5 h ASP 4128CO 0.08 1.38 -0.07 -0.08 -1.03 0.00 0.00 179.24 179.52 1xm5 h GLU 4129N 0.34 0.32 -0.68 4.15 4.81 -1.87 -3.07 114.58 118.58 1xm5 h GLU 4129Ca -0.07 -0.14 0.03 0.00 -0.13 0.00 0.00 59.36 59.05 1xm5 h GLU 4129Cb 1.42 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.75 1xm5 h GLU 4129CO 0.16 0.63 0.45 0.00 -0.73 0.00 0.00 179.01 179.52 1xm5 h ALA 4130N 0.68 1.60 0.58 2.92 0.00 -1.55 -2.26 119.26 121.23 1xm5 h ALA 4130Ca 0.04 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1xm5 h ALA 4130Cb 0.53 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1xm5 h ALA 4130CO 0.02 0.34 -0.45 1.49 0.00 0.00 0.00 179.25 180.65 1xm5 h GLU 4131N 0.84 -0.96 -0.59 0.00 4.22 -1.43 0.17 114.58 116.83 1xm5 h GLU 4131Ca 0.27 0.07 0.08 0.00 0.08 0.00 0.00 59.36 59.85 1xm5 h GLU 4131Cb 0.03 0.22 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 1xm5 h GLU 4131CO -0.07 -0.64 0.25 1.49 -2.18 0.00 0.00 179.01 177.86 1xm5 h GLU 4132N -0.99 0.45 -0.36 1.92 4.81 -1.44 0.53 114.58 119.51 1xm5 h GLU 4132Ca -0.08 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1xm5 h GLU 4132Cb 0.83 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.09 1xm5 h GLU 4132CO 0.02 0.30 0.23 1.98 -0.73 0.00 0.00 179.01 180.81 1xm5 h MET 4133N 0.47 0.48 0.19 1.92 4.05 -1.26 -0.28 114.93 120.51 1xm5 h MET 4133Ca 0.28 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.66 1xm5 h MET 4133Cb 0.29 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 30.98 1xm5 h MET 4133CO -0.25 0.34 -0.09 0.93 0.23 0.00 0.00 176.91 178.07 1xm5 h GLU 4134N 0.48 -0.25 -0.90 0.39 5.08 -0.47 0.36 114.58 119.28 1xm5 h GLU 4134Ca 0.13 0.02 0.21 0.00 -1.00 0.00 0.00 59.36 58.72 1xm5 h GLU 4134Cb -0.03 0.06 -0.12 0.00 0.50 0.00 0.00 28.75 29.15 1xm5 h GLU 4134CO -0.03 -0.11 0.41 0.00 -1.00 0.00 0.00 179.01 178.28 1xm5 h ALA 4135N 0.46 1.44 -0.20 3.43 0.00 -0.64 0.30 119.26 124.05 1xm5 h ALA 4135Ca -0.03 0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1xm5 h ALA 4135Cb 0.26 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1xm5 h ALA 4135CO 0.04 -0.31 -0.24 1.25 0.00 0.00 0.00 179.25 179.99 1xm5 h LEU 4136N 0.43 0.56 -0.27 0.00 6.46 -0.42 -1.07 115.31 120.99 1xm5 h LEU 4136Ca 0.56 -0.50 0.04 0.00 -0.12 0.00 0.00 57.88 57.86 1xm5 h LEU 4136Cb 1.03 -0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.77 1xm5 h LEU 4136CO -0.51 0.94 0.03 -0.33 -0.62 0.00 0.00 178.44 177.95 1xm5 h GLU 4137N 0.18 0.12 0.22 1.25 5.08 0.16 -1.15 114.58 120.44 1xm5 h GLU 4137Ca 0.03 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1xm5 h GLU 4137Cb 0.81 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.99 1xm5 h GLU 4137CO 0.06 0.08 -0.40 1.15 -1.00 0.00 0.00 179.01 178.89 1xm5 h THR 4138N 0.12 0.19 -0.85 1.13 2.02 -0.44 0.19 112.91 115.28 1xm5 h THR 4138Ca 0.13 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.43 1xm5 h THR 4138Cb 0.15 0.19 -0.09 0.00 -1.74 0.00 0.00 68.15 66.66 1xm5 h THR 4138CO -0.19 0.00 0.46 -0.08 0.37 0.00 0.00 175.52 176.08 1xm5 h GLU 4139N -0.70 0.67 -0.04 6.66 4.81 -0.86 0.28 114.58 125.40 1xm5 h GLU 4139Ca 0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1xm5 h GLU 4139Cb 0.69 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1xm5 h GLU 4139CO -0.17 0.45 -0.08 0.82 -0.73 0.00 0.00 179.01 179.29 1xm5 h ILE 4140N 0.69 1.44 0.12 2.32 2.04 -0.97 -1.87 117.51 121.29 1xm5 h ILE 4140Ca 0.44 -1.44 0.00 0.00 1.00 0.00 0.00 64.86 64.86 1xm5 h ILE 4140Cb 0.55 2.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.93 1xm5 h ILE 4140CO -0.32 0.39 -0.26 0.24 0.00 0.00 0.00 178.15 178.20 1xm5 h MET 4141N -0.42 -0.40 -0.07 2.37 2.86 -0.06 0.72 114.93 119.93 1xm5 h MET 4141Ca -0.00 0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1xm5 h MET 4141Cb 0.68 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.41 1xm5 h MET 4141CO 0.02 -0.27 -0.18 -0.07 1.06 0.00 0.00 176.91 177.47 1xm5 h LEU 4142N -0.42 -0.60 -1.37 1.22 3.38 -1.00 0.18 115.31 116.71 1xm5 h LEU 4142Ca -0.01 0.07 0.47 0.00 0.09 0.00 0.00 57.88 58.50 1xm5 h LEU 4142Cb 0.40 0.24 -0.13 0.00 0.09 0.00 0.00 40.66 41.25 1xm5 h LEU 4142CO -0.11 -0.16 0.89 0.00 0.09 0.00 0.00 178.44 179.15 1xm5 n ALA 4143N -2.75 1.35 -0.09 1.53 0.00 -0.70 0.17 120.51 120.02 1xm5 n ALA 4143Ca -0.02 0.83 -0.11 0.00 0.00 0.00 0.00 53.44 54.14 1xm5 n ALA 4143Cb 0.12 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 18.51 1xm5 n ALA 4143CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1xm5 h LEU 4144N 0.00 0.46 0.00 0.00 6.46 0.35 -3.47 115.31 119.11 1xm5 h LEU 4144Ca 0.85 -0.28 0.00 0.00 -0.12 0.00 0.00 57.88 58.33 1xm5 h LEU 4144Cb 2.80 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 42.60 1xm5 h LEU 4144CO -0.42 0.63 0.00 0.61 -0.62 0.00 0.00 178.44 178.64 1xm5 n GLY 4145N -0.40 0.40 3.96 3.75 0.00 0.46 -5.09 105.19 108.26 1xm5 n GLY 4145Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 1xm5 n GLY 4145CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xm5 s TYR 4146N 0.00 2.47 0.88 1.61 2.02 -1.12 -4.97 117.35 118.24 1xm5 s TYR 4146Ca 0.00 0.12 -0.14 0.00 -0.37 0.00 0.00 57.07 56.69 1xm5 s TYR 4146Cb 0.00 -3.09 0.14 0.00 -0.40 0.00 0.00 41.96 38.61 1xm5 s TYR 4146CO 0.00 -1.42 1.24 -1.83 -1.57 0.00 0.00 175.55 171.97 1xm5 s GLU 4147N -5.13 1.31 0.15 -0.62 1.03 -1.26 -3.54 118.70 110.64 1xm5 s GLU 4147Ca 0.62 -0.19 -0.31 0.00 0.03 0.00 0.00 54.97 55.13 1xm5 s GLU 4147Cb -0.09 -1.91 -0.08 0.00 -0.80 0.00 0.00 34.13 31.25 1xm5 s GLU 4147CO 0.43 -1.99 1.34 0.34 -1.33 0.00 0.00 175.26 174.06 1xm5 s ASP 4148N -4.74 6.87 0.00 0.83 -1.08 -1.26 -4.39 116.67 112.91 1xm5 s ASP 4148Ca 0.68 2.34 0.28 0.00 -0.52 0.00 0.00 52.55 55.33 1xm5 s ASP 4148Cb -0.07 -2.60 1.00 0.00 -1.46 0.00 0.00 42.92 39.79 1xm5 s ASP 4148CO 0.51 -0.59 1.72 -0.81 0.52 0.00 0.00 175.17 176.52 1xm5 n PRO 4149N 3.35 0.87 0.00 4.34 -0.04 -1.26 -4.89 135.00 137.37 1xm5 n PRO 4149Ca 0.09 -0.43 0.00 0.00 -0.04 0.00 0.00 63.50 63.12 1xm5 n PRO 4149Cb 0.43 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.40 1xm5 n PRO 4149CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1xm5 n TYR 4150N -0.69 0.00 -3.86 0.54 0.53 -1.26 -4.90 117.16 107.52 1xm5 n TYR 4150Ca 0.14 0.00 -0.30 0.00 -1.02 0.00 0.00 57.90 56.72 1xm5 n TYR 4150Cb 0.31 0.00 0.01 0.00 -1.03 0.00 0.00 39.34 38.63 1xm5 n TYR 4150CO 0.00 0.00 0.00 -0.89 -1.02 0.00 0.00 176.86 174.95 1xm5 n ILE 4151N 0.00 -3.27 -0.31 -0.72 5.41 -1.26 -5.19 119.36 114.02 1xm5 n ILE 4151Ca 0.00 -0.16 0.00 0.00 1.00 0.00 0.00 62.75 63.59 1xm5 n ILE 4151Cb 0.00 -2.83 0.00 0.00 -0.71 0.00 0.00 39.64 36.10 1xm5 n ILE 4151CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55