A0A5K4FCS3_SCHMA Loading...

BRCA1-associated protein

AlphaFold DB , UniProt , Accession A0A5K4FCS3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 520 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.6	Very low	57.7	Low	226 Å²	226	64.5 Å²	64.5	100%	1.113	33%	0.332	S	S	*	.				0	79.7	0	-71.6	-159.3	176.4	0	0	104.6	T3	M1-T3 VanDerWaalsContact C-N 3.27Å; M1-T3 PolarHBondContact O-N 3.27Å
2	D	38.8	Very low	58.9	Low	130 Å²	130	59.3 Å²	59.3	70%	0.695	31%	0.305	S	S	*	.			trans	-78	90.6	-175.7	-65.2	-20.9	0	0	0	106.3	H4	D2-H4 PolarHBondContact O-CD2 3.36Å; D2-H4 PolarHBondContact O-N 2.96Å
3	T	41.3	Very low	59.9	Low	98 Å²	98	54.8 Å²	54.8	60%	0.601	28%	0.282	S	S	*	.			trans	-66	80.4	168.2	51	0	0	0	0	106.6	M1 S5	M1-T3 VanDerWaalsContact C-N 3.27Å; M1-T3 PolarHBondContact O-N 3.27Å; T3-S5 VanDerWaalsContact C-N 3.27Å; T3-S5 PolarHBondContact O-N 2.97Å
4	H	51.4	Low	60.5	Low	117 Å²	117	51.4 Å²	51.4	54%	0.542	26%	0.264	S	S	.	.			trans	-65.3	95.7	170	-75.4	-74.4	0	0	0	106.6	D2	D2-H4 PolarHBondContact O-CD2 3.36Å; D2-H4 PolarHBondContact O-N 2.96Å
5	S	53.8	Low	61.2	Low	42 Å²	42	48 Å²	48	29%	0.294	25%	0.247	S	C	.	.			trans	-67.3	140.3	170.1	-33.5	0	0	0	0	108.2	T3 E108	T3-S5 VanDerWaalsContact C-N 3.27Å; T3-S5 PolarHBondContact O-N 2.97Å; S5-E108 WeakPolarHBondContact CB-OE2 3.38Å; S5-E108 PolarHBondContact OG-OE2 3.4Å
6	L	63.7	Low	61.5	Low	19 Å²	19	47 Å²	47	10%	0.099	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-125.3	139.2	-171	-72.4	155.3	0	0	0	110.7	H8 V109 R111 V116 Y176 Y196	L6-H8 PolarHBondContact O-ND1 3.1Å; L6-V109 PolarHBondContact N-O 3.21Å; L6-V109 PolarHBondContact O-N 3.13Å; L6-V109 VanDerWaalsContact O-N 3.11Å; L6-R111 HydrophobicContact CD1-CG 4.33Å; L6-V116 HydrophobicContact CD1-CG2 3.96Å; L6-Y176 HydrophobicContact CD2-CE1 4.12Å; L6-Y176 VanDerWaalsContact CD2-OH 3.23Å; L6-Y176 WeakPolarHBondContact CD2-OH 3.45Å; L6-Y196 HydrophobicContact CB-CD2 4.39Å; L6-Y196 HydrophobicContact CD1-CD2 3.93Å; L6-Y196 HydrophobicContact CD1-CE2 3.51Å; L6-Y196 HydrophobicContact CD2-CD2 4.45Å; L6-Y196 HydrophobicContact CD2-CE2 4.39Å; L6-Y196 HydrophobicContact CG-CD2 4.49Å; L6-Y196 HydrophobicContact CG-CE2 4.43Å
7	Y	64.4	Low	61.7	Low	76 Å²	76	52 Å²	52	30%	0.298	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-82.3	121.5	172.6	-66.8	-83.6	0	0	0	109.4	K104 N105 E108	Y7-K104 HydrophobicContact CD1-CD 4.2Å; Y7-K104 HydrophobicContact CD1-CG 3.96Å; Y7-K104 HydrophobicContact CG-CD 4.19Å; Y7-K104 HydrophobicContact CG-CG 4.15Å; Y7-N105 VanDerWaalsContact CD1-O 3.23Å; Y7-N105 WeakPolarHBondContact CD1-O 3.36Å; Y7-E108 HydrophobicContact CD1-CG 4.32Å; Y7-E108 HydrophobicContact CD2-CG 4.33Å; Y7-E108 HydrophobicContact CE1-CG 3.68Å; Y7-E108 HydrophobicContact CE2-CG 3.65Å; Y7-E108 WeakPolarHBondContact CE2-OE1 3.44Å; Y7-E108 VanDerWaalsContact OH-CG 3.25Å; Y7-E108 WeakPolarHBondContact OH-CG 3.22Å; Y7-E108 PolarHBondContact OH-OE1 3.26Å
8	H	69.3	Low	61.7	Low	1 Å²	1	56.2 Å²	56.2	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	138	173.8	-62.9	61.6	0	0	0	109.8	L6 N105 V109 V116 Y196	L6-H8 PolarHBondContact O-ND1 3.1Å; H8-N105 PolarHBondContact O-N 3.25Å; H8-V109 WeakPolarHBondContact ND1-CG2 3.36Å; H8-V116 VanDerWaalsContact NE2-CG1 3.29Å; H8-V116 WeakPolarHBondContact NE2-CG1 3.27Å; H8-Y196 CarbonylContact C-O 3.55Å; H8-Y196 WeakPolarHBondContact CA-O 3.37Å
9	L	71.9	Confident	61.7	Low	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	141.6	173.7	-69.1	-179.3	0	0	0	111	I102 Y103 C122 F124 M195 Y196 V197 S198 L219	L9-I102 HydrophobicContact CD1-CG2 4.41Å; L9-I102 HydrophobicContact CD2-CG2 3.67Å; L9-I102 HydrophobicContact CG-CG2 4.45Å; L9-Y103 CarbonylContact C-O 3.55Å; L9-Y103 WeakPolarHBondContact CA-O 3.28Å; L9-C122 HydrophobicContact CD1-CB 4.28Å; L9-F124 HydrophobicContact CD1-CD2 4.11Å; L9-M195 HydrophobicContact CD1-CB 3.47Å; L9-M195 VanDerWaalsContact CD1-CB 3.47Å; L9-M195 HydrophobicContact CD1-CE 4.16Å; L9-M195 HydrophobicContact CD1-CG 4.15Å; L9-M195 HydrophobicContact CD1-SD 3.68Å; L9-M195 HydrophobicContact CD2-CE 3.5Å; L9-M195 VanDerWaalsContact CD2-CE 3.5Å; L9-M195 HydrophobicContact CD2-SD 4Å; L9-M195 HydrophobicContact CG-CB 3.86Å; L9-M195 HydrophobicContact CG-CE 3.79Å; L9-M195 HydrophobicContact CG-SD 4.01Å; L9-Y196 PolarHBondContact N-O 3.29Å; L9-V197 CarbonylContact O-C 3.56Å; L9-S198 WeakPolarHBondContact O-CB 3.4Å; L9-S198 PolarHBondContact O-N 2.94Å; L9-L219 HydrophobicContact CD2-CD1 4.16Å
10	V	72	Confident	61.6	Low	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	118.1	165.2	173.3	0	0	0	0	106.8	P34 F35 Y103 H199 L216	V10-P34 HydrophobicContact CG1-CB 4.39Å; V10-P34 HydrophobicContact CG1-CG 3.81Å; V10-P34 HydrophobicContact CG2-CB 4.25Å; V10-P34 HydrophobicContact CG2-CG 3.95Å; V10-F35 HydrophobicContact CG1-CE1 4.27Å; V10-F35 HydrophobicContact CG1-CE2 3.74Å; V10-F35 HydrophobicContact CG1-CZ 3.37Å; V10-Y103 HydrophobicContact CG1-CD2 4.44Å; V10-Y103 PolarHBondContact N-O 2.84Å; V10-Y103 PolarHBondContact O-N 3.35Å; V10-H199 CarbonylContact C-O 3.58Å; V10-H199 WeakPolarHBondContact CA-O 3.25Å; V10-H199 HydrophobicContact CG1-CB 4.21Å; V10-H199 HydrophobicContact CG2-CB 4.45Å; V10-L216 HydrophobicContact CG2-CD2 4.23Å
11	I	74.7	Confident	61.3	Low	1 Å²	1	56.3 Å²	56.3	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.6	-178.1	-52.6	175.6	0	0	0	107.9	F13 I100 I102 L163 V197 H199 V200 E201	I11-F13 HydrophobicContact CB-CE2 4.34Å; I11-F13 HydrophobicContact CG2-CD2 3.97Å; I11-F13 HydrophobicContact CG2-CE2 3.35Å; I11-F13 HydrophobicContact CG2-CZ 3.88Å; I11-I100 HydrophobicContact CG2-CG2 3.78Å; I11-I102 HydrophobicContact CG1-CG1 4.37Å; I11-I102 HydrophobicContact CG2-CG1 4.31Å; I11-L163 HydrophobicContact CD1-CD2 3.72Å; I11-V197 HydrophobicContact CD1-CG1 4.29Å; I11-V197 HydrophobicContact CD1-CG2 4.33Å; I11-V197 HydrophobicContact CG1-CG1 4.44Å; I11-H199 PolarHBondContact N-O 3.2Å; I11-V200 HydrophobicContact CB-CG2 4.33Å; I11-V200 HydrophobicContact CD1-CG2 4.49Å; I11-V200 VanDerWaalsContact O-CA 3.3Å; I11-V200 WeakPolarHBondContact O-CA 3.46Å; I11-E201 PolarHBondContact O-N 2.75Å
12	L	71.6	Confident	62.5	Low	1 Å²	1	55 Å²	55	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.1	177	-178.8	74.6	0	0	0	109.5	F35 H101 Y103 E201 T203 A210	L12-F35 HydrophobicContact CB-CE1 4.39Å; L12-F35 HydrophobicContact CB-CZ 4.01Å; L12-F35 HydrophobicContact CD1-CE1 4.08Å; L12-F35 HydrophobicContact CD1-CE2 4.33Å; L12-F35 HydrophobicContact CD1-CZ 3.81Å; L12-F35 HydrophobicContact CD2-CE1 4.22Å; L12-F35 HydrophobicContact CG-CE1 4.46Å; L12-F35 HydrophobicContact CG-CZ 4.35Å; L12-H101 HydrophobicContact CB-CB 4.18Å; L12-H101 PolarHBondContact N-O 3.06Å; L12-H101 PolarHBondContact O-N 3.32Å; L12-Y103 HydrophobicContact CB-CE2 4.05Å; L12-Y103 HydrophobicContact CD2-CE2 4.34Å; L12-E201 CarbonylContact C-O 3.59Å; L12-E201 WeakPolarHBondContact CA-O 3.28Å; L12-E201 HydrophobicContact CD1-CB 3.97Å; L12-T203 HydrophobicContact CD1-CG2 3.51Å; L12-A210 HydrophobicContact CD1-CB 4.4Å; L12-A210 HydrophobicContact CD2-CB 4.02Å
13	F	72.9	Confident	63.6	Low	1 Å²	1	50.2 Å²	50.2	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.9	172.4	-69.1	-95.6	0	0	0	108.5	I11 L20 L24 I63 I100 V152 V200 E201 I202 T203	I11-F13 HydrophobicContact CB-CE2 4.34Å; I11-F13 HydrophobicContact CG2-CD2 3.97Å; I11-F13 HydrophobicContact CG2-CE2 3.35Å; I11-F13 HydrophobicContact CG2-CZ 3.88Å; F13-L20 HydrophobicContact CD1-CD1 4.48Å; F13-L24 HydrophobicContact CD1-CD2 4.23Å; F13-L24 HydrophobicContact CD2-CD2 3.76Å; F13-L24 HydrophobicContact CE1-CD2 3.87Å; F13-L24 HydrophobicContact CE2-CD2 3.36Å; F13-L24 HydrophobicContact CE2-CG 4.31Å; F13-L24 HydrophobicContact CG-CD2 4.2Å; F13-L24 HydrophobicContact CZ-CD2 3.44Å; F13-L24 VanDerWaalsContact CZ-CD2 3.44Å; F13-I63 HydrophobicContact CD1-CD1 4.34Å; F13-I63 HydrophobicContact CD1-CG2 4.45Å; F13-I63 HydrophobicContact CE1-CG2 4.26Å; F13-I100 HydrophobicContact CD1-CD1 4.04Å; F13-I100 HydrophobicContact CD1-CG1 3.74Å; F13-I100 HydrophobicContact CD1-CG2 4.5Å; F13-I100 HydrophobicContact CE1-CD1 3.47Å; F13-I100 VanDerWaalsContact CE1-CD1 3.47Å; F13-I100 HydrophobicContact CE1-CG1 3.68Å; F13-I100 HydrophobicContact CE1-CG2 4.2Å; F13-I100 HydrophobicContact CZ-CD1 4.26Å; F13-I100 HydrophobicContact CZ-CG2 4.29Å; F13-V152 HydrophobicContact CE1-CG1 3.75Å; F13-V152 HydrophobicContact CZ-CG1 3.91Å; F13-V152 HydrophobicContact CZ-CG2 4.21Å; F13-V200 HydrophobicContact CD2-CG1 3.88Å; F13-V200 HydrophobicContact CE2-CG1 3.6Å; F13-E201 PolarHBondContact N-O 3.17Å; F13-I202 HydrophobicContact CB-CB 4.47Å; F13-I202 HydrophobicContact CB-CG1 3.86Å; F13-I202 HydrophobicContact CG-CG1 4.44Å; F13-I202 CarbonylContact O-C 3.55Å; F13-I202 VanDerWaalsContact O-CA 3.31Å; F13-I202 WeakPolarHBondContact O-CA 3.38Å; F13-T203 PolarHBondContact O-N 3.22Å; F13-T203 PolarHBondContact O-OG1 2.95Å
14	E	68	Low	64.6	Low	8 Å²	8	45.8 Å²	45.8	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	106.9	170	-172.9	178	-179.3	0	0	108.7	G98 I99 H101 T203	E14-G98 CarbonylContact O-C 3.56Å; E14-G98 WeakPolarHBondContact O-CA 3.47Å; E14-I99 PolarHBondContact N-O 2.89Å; E14-I99 PolarHBondContact O-N 2.87Å; E14-H101 IonicContact OE2-NE2 3.23Å; E14-T203 CarbonylContact C-O 3.59Å; E14-T203 WeakPolarHBondContact CA-O 3.48Å
15	E	70.5	Confident	65.2	Low	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	139.3	-178.2	-59.6	-165.3	127.5	0	0	112.2	K19 L20 T96 I202 T203 H204 P205	E15-K19 PolarHBondContact OE2-N 3.38Å; E15-L20 WeakPolarHBondContact OE1-CB 3.47Å; E15-L20 WeakPolarHBondContact OE1-CD1 3.5Å; E15-L20 WeakPolarHBondContact OE1-CG 3.32Å; E15-L20 PolarHBondContact OE2-N 3.46Å; E15-T96 WeakPolarHBondContact OE1-CB 3.49Å; E15-T96 WeakPolarHBondContact OE1-CG2 3.39Å; E15-T96 PolarHBondContact OE1-OG1 2.7Å; E15-I202 HydrophobicContact CB-CG2 4.46Å; E15-I202 HydrophobicContact CG-CG2 3.79Å; E15-T203 PolarHBondContact N-O 3.22Å; E15-H204 PolarHBondContact O-CD2 3.32Å; E15-P205 WeakPolarHBondContact O-CD 3.21Å
16	T	65.5	Low	65.5	Low	32 Å²	32	43.6 Å²	43.6	20%	0.196	22%	0.215	C	C	.	.	S	Bend	trans	-72.8	-29	169.5	57.8	0	0	0	0	113	F60 E97 H204	T16-F60 HydrophobicContact CG2-CB 3.88Å; T16-F60 HydrophobicContact CG2-CD1 3.48Å; T16-F60 VanDerWaalsContact CG2-CD1 3.48Å; T16-F60 HydrophobicContact CG2-CD2 3.47Å; T16-F60 VanDerWaalsContact CG2-CD2 3.47Å; T16-F60 HydrophobicContact CG2-CE1 3.78Å; T16-F60 HydrophobicContact CG2-CE2 3.77Å; T16-F60 HydrophobicContact CG2-CG 3.31Å; T16-F60 HydrophobicContact CG2-CZ 3.91Å; T16-E97 WeakPolarHBondContact CB-O 3.44Å; T16-E97 WeakPolarHBondContact CG2-O 3.49Å; T16-E97 PolarHBondContact N-O 2.63Å; T16-E97 PolarHBondContact OG1-O 2.91Å; T16-H204 PolarHBondContact O-CD2 2.8Å; T16-H204 PolarHBondContact O-NE2 3.05Å
17	K	66.5	Low	65.4	Low	132 Å²	132	49.6 Å²	49.6	57%	0.574	24%	0.236	S	C	*	.	S	Bend	trans	-135.4	120.9	178.8	-68.3	177.2	-175.9	164.3	0	107.7	K19	K17-K19 PolarHBondContact O-N 3.31Å
18	Q	61.2	Low	65	Low	128 Å²	128	46.1 Å²	46.1	60%	0.598	22%	0.223	S	C	*	.			trans	-63.7	95.1	177.7	-66.9	178.4	-19.1	0	0	110	H204	Q18-H204 HydrophobicContact CG-CB 4.34Å
19	K	62.3	Low	64.5	Low	114 Å²	114	51.9 Å²	51.9	50%	0.496	26%	0.261	S	S	.	.	S	Bend	trans	-117.2	-39.5	167.2	-49.5	-173.7	-169.2	163.5	0	111.3	E15 K17 S21 T95 T96	E15-K19 PolarHBondContact OE2-N 3.38Å; K17-K19 PolarHBondContact O-N 3.31Å; K19-S21 VanDerWaalsContact C-N 3.28Å; K19-S21 PolarHBondContact O-N 2.94Å; K19-T95 WeakPolarHBondContact CD-O 3.35Å; K19-T95 PolarHBondContact NZ-O 3.1Å; K19-T96 HydrophobicContact CB-CG2 3.45Å; K19-T96 VanDerWaalsContact CB-CG2 3.45Å; K19-T96 HydrophobicContact CD-CG2 3.79Å; K19-T96 HydrophobicContact CG-CG2 3.71Å
20	L	57.9	Low	63.9	Low	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-77.1	-12.2	-177	-63.5	178.8	0	0	0	113.2	F13 E15 K22 S23 L24 V65 E94 T96 I202	F13-L20 HydrophobicContact CD1-CD1 4.48Å; E15-L20 WeakPolarHBondContact OE1-CB 3.47Å; E15-L20 WeakPolarHBondContact OE1-CD1 3.5Å; E15-L20 WeakPolarHBondContact OE1-CG 3.32Å; E15-L20 PolarHBondContact OE2-N 3.46Å; L20-K22 PolarHBondContact O-N 3.3Å; L20-S23 WeakPolarHBondContact CA-OG 3.44Å; L20-S23 PolarHBondContact O-N 3.3Å; L20-S23 PolarHBondContact O-OG 3.39Å; L20-L24 HydrophobicContact CB-CB 4.45Å; L20-L24 HydrophobicContact CD1-CD2 4.36Å; L20-L24 PolarHBondContact O-N 3.33Å; L20-V65 HydrophobicContact CD1-CG2 3.64Å; L20-V65 HydrophobicContact CD2-CB 3.91Å; L20-V65 HydrophobicContact CD2-CG2 3.8Å; L20-V65 HydrophobicContact CG-CG2 4.42Å; L20-E94 HydrophobicContact CD2-CB 3.57Å; L20-E94 HydrophobicContact CD2-CG 4.45Å; L20-E94 WeakPolarHBondContact CD2-OE2 3.01Å; L20-T96 WeakPolarHBondContact CD1-OG1 3.44Å; L20-T96 HydrophobicContact CG-CG2 4.01Å; L20-I202 HydrophobicContact CB-CD1 3.5Å; L20-I202 HydrophobicContact CB-CG1 4.5Å; L20-I202 WeakPolarHBondContact O-CD1 3.22Å
21	S	57	Low	63.2	Low	56 Å²	56	56 Å²	56	39%	0.392	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-57.1	-23.5	-167.6	68.7	0	0	0	0	114.8	K19	K19-S21 VanDerWaalsContact C-N 3.28Å; K19-S21 PolarHBondContact O-N 2.94Å
22	K	57.4	Low	62.3	Low	199 Å²	199	61.3 Å²	61.3	87%	0.865	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-92.7	-25.3	175.8	-67.6	-174.6	-179.5	179.6	0	113.4	L20	L20-K22 PolarHBondContact O-N 3.3Å
23	S	61.8	Low	61.4	Low	29 Å²	29	65 Å²	65	20%	0.203	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-40.1	-173.6	61.9	0	0	0	0	112	L20 E94 K150	L20-S23 WeakPolarHBondContact CA-OG 3.44Å; L20-S23 PolarHBondContact O-N 3.3Å; L20-S23 PolarHBondContact O-OG 3.39Å; S23-E94 WeakPolarHBondContact CB-OE2 3.29Å; S23-E94 PolarHBondContact OG-OE2 3.41Å; S23-K150 WeakPolarHBondContact O-CE 3.48Å; S23-K150 PolarHBondContact O-NZ 3.1Å
24	L	62.2	Low	60.6	Low	6 Å²	6	65.4 Å²	65.4	3%	0.031	34%	0.339	C	S	.	.	S	Bend	trans	-118.9	72.4	-169.6	-173.2	76.8	0	0	0	111.8	F13 L20 V65 K150 L163 V200 I202	F13-L24 HydrophobicContact CD1-CD2 4.23Å; F13-L24 HydrophobicContact CD2-CD2 3.76Å; F13-L24 HydrophobicContact CE1-CD2 3.87Å; F13-L24 HydrophobicContact CE2-CD2 3.36Å; F13-L24 HydrophobicContact CE2-CG 4.31Å; F13-L24 HydrophobicContact CG-CD2 4.2Å; F13-L24 HydrophobicContact CZ-CD2 3.44Å; F13-L24 VanDerWaalsContact CZ-CD2 3.44Å; L20-L24 HydrophobicContact CB-CB 4.45Å; L20-L24 HydrophobicContact CD1-CD2 4.36Å; L20-L24 PolarHBondContact O-N 3.33Å; L24-V65 HydrophobicContact CD2-CG2 4.39Å; L24-K150 HydrophobicContact CD1-CB 4.47Å; L24-K150 HydrophobicContact CD1-CD 3.41Å; L24-K150 VanDerWaalsContact CD1-CD 3.41Å; L24-L163 HydrophobicContact CD1-CD1 3.89Å; L24-V200 HydrophobicContact CD1-CG1 4.39Å; L24-V200 HydrophobicContact CD2-CG1 4.31Å; L24-V200 HydrophobicContact CG-CG1 3.92Å; L24-I202 HydrophobicContact CB-CD1 4.04Å; L24-I202 WeakPolarHBondContact O-CD1 3.4Å
25	S	63.9	Low	60.1	Low	84 Å²	84	65.5 Å²	65.5	59%	0.587	34%	0.339	S	S	*	.			trans	-129.2	125.9	169.1	69.6	0	0	0	0	110.6
26	Y	60.9	Low	59	Low	29 Å²	29	71.6 Å²	71.6	11%	0.114	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.8	174.4	178.3	-102.5	0	0	0	110.7	T119 V120 H199 V200	Y26-T119 WeakPolarHBondContact CE2-OG1 3.36Å; Y26-T119 PolarHBondContact OH-N 3.29Å; Y26-T119 PolarHBondContact OH-OG1 2.86Å; Y26-V120 HydrophobicContact CD1-CB 4.03Å; Y26-V120 HydrophobicContact CD1-CG2 3.79Å; Y26-V120 HydrophobicContact CD2-CG2 3.44Å; Y26-V120 VanDerWaalsContact CD2-CG2 3.44Å; Y26-V120 HydrophobicContact CE1-CB 3.78Å; Y26-V120 HydrophobicContact CE1-CG2 3.66Å; Y26-V120 HydrophobicContact CE2-CB 4.29Å; Y26-V120 HydrophobicContact CE2-CG2 3.29Å; Y26-V120 HydrophobicContact CG-CB 4.38Å; Y26-V120 HydrophobicContact CG-CG2 3.67Å; Y26-H199 WeakPolarHBondContact O-CA 3.5Å; Y26-V200 PolarHBondContact N-O 3.48Å; Y26-V200 PolarHBondContact O-N 2.92Å; Y26-V200 VanDerWaalsContact O-O 3.14Å
27	R	61	Low	58.1	Low	144 Å²	144	75.3 Å²	75.3	54%	0.543	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	120.9	175.7	-60.5	-174.7	173.3	172.2	-3.4	108.6	P29 E201	R27-P29 WeakPolarHBondContact O-CD 3.21Å; R27-E201 IonicContact CZ-OE1 3.87Å; R27-E201 VanDerWaalsContact CZ-OE1 3.23Å; R27-E201 IonicContact NE-OE1 3.47Å; R27-E201 PolarHBondContact NE-OE1 2.93Å; R27-E201 IonicContact NH2-OE1 3.97Å; R27-E201 PolarHBondContact NH2-OE1 3.3Å
28	S	56.8	Low	56.8	Low	3 Å²	3	79.2 Å²	79.2	2%	0.021	40%	0.399	C	S	.	.			trans	-70.6	118.7	171.1	173.8	0	0	0	0	108.7	S30 L31 S198	S28-S30 PolarHBondContact O-N 2.97Å; S28-S30 PolarHBondContact OG-OG 3.47Å; S28-L31 PolarHBondContact O-N 2.86Å; S28-S198 WeakPolarHBondContact CB-O 2.88Å; S28-S198 PolarHBondContact N-O 3.36Å
29	P	59	Low	55.6	Low	123 Å²	123	81.9 Å²	81.9	80%	0.799	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-19.1	-173.1	26	-34.7	0	0	0	113.9	R27	R27-P29 WeakPolarHBondContact O-CD 3.21Å
30	S	58.2	Low	54.5	Low	63 Å²	63	81.4 Å²	81.4	44%	0.441	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-18.1	-174.8	44.5	0	0	0	0	113.8	S28 T117	S28-S30 PolarHBondContact O-N 2.97Å; S28-S30 PolarHBondContact OG-OG 3.47Å; S30-T117 VanDerWaalsContact CB-CB 3.48Å; S30-T117 WeakPolarHBondContact CB-OG1 3.46Å; S30-T117 WeakPolarHBondContact OG-CB 3.45Å; S30-T117 PolarHBondContact OG-O 3.2Å; S30-T117 PolarHBondContact OG-OG1 2.97Å
31	L	57.2	Low	53.5	Low	23 Å²	23	89.2 Å²	89.2	12%	0.12	46%	0.461	C	S	.	.	S	Bend	trans	-98	141.2	-179.8	-67.9	173.1	0	0	0	109.9	S28 Y33 V109 S198	S28-L31 PolarHBondContact O-N 2.86Å; L31-Y33 PolarHBondContact O-N 2.97Å; L31-V109 HydrophobicContact CD2-CG1 4.19Å; L31-V109 HydrophobicContact CD2-CG2 4.37Å; L31-S198 WeakPolarHBondContact CD1-OG 3.46Å
32	P	56.4	Low	52.5	Low	112 Å²	112	96.2 Å²	96.2	73%	0.727	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-61.1	138.4	178.1	25.5	-32.8	0	0	0	110.1	P34	P32-P34 WeakPolarHBondContact O-CD 3.46Å
33	Y	53.9	Low	51.3	Low	78 Å²	78	96.1 Å²	96.1	31%	0.306	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-65.6	121.2	-178.8	-177.7	-112.2	0	0	0	110.7	L31 F35 I37 H199 E201	L31-Y33 PolarHBondContact O-N 2.97Å; Y33-F35 VanDerWaalsContact C-N 3.32Å; Y33-F35 HydrophobicContact CD1-CB 4.47Å; Y33-F35 WeakPolarHBondContact CD1-O 3.46Å; Y33-F35 HydrophobicContact CE1-CB 3.77Å; Y33-F35 WeakPolarHBondContact CE1-O 3.07Å; Y33-F35 HydrophobicContact CE2-CD2 4.15Å; Y33-F35 PolarHBondContact O-N 3.42Å; Y33-I37 HydrophobicContact CE1-CD1 4.28Å; Y33-I37 HydrophobicContact CE1-CG1 4.2Å; Y33-H199 AromaticContact CD2-CD2 3.83Å; Y33-H199 AromaticContact CD2-NE2 3.88Å; Y33-E201 HydrophobicContact CE2-CG 4.39Å; Y33-E201 WeakPolarHBondContact CE2-OE1 3.26Å; Y33-E201 VanDerWaalsContact CZ-OE2 3.29Å; Y33-E201 PolarHBondContact OH-OE1 2.98Å; Y33-E201 PolarHBondContact OH-OE2 3.02Å
34	P	56	Low	49.8	Very low	10 Å²	10	99.5 Å²	99.5	7%	0.065	51%	0.513	C	S	.	.			trans	-83.5	-0.9	-167.6	30.1	-34.1	0	0	0	114.3	V10 P32 H199 T213 L216	V10-P34 HydrophobicContact CG1-CB 4.39Å; V10-P34 HydrophobicContact CG1-CG 3.81Å; V10-P34 HydrophobicContact CG2-CB 4.25Å; V10-P34 HydrophobicContact CG2-CG 3.95Å; P32-P34 WeakPolarHBondContact O-CD 3.46Å; P34-H199 VanDerWaalsContact CD-CG 3.49Å; P34-H199 WeakPolarHBondContact CD-ND1 3.38Å; P34-H199 HydrophobicContact CG-CB 3.93Å; P34-T213 WeakPolarHBondContact O-CB 3.34Å; P34-T213 WeakPolarHBondContact O-CG2 3.36Å; P34-T213 PolarHBondContact O-OG1 3.01Å; P34-L216 HydrophobicContact CB-CD1 4.09Å
35	F	55.7	Low	48.3	Very low	10 Å²	10	109.9 Å²	109.9	4%	0.044	55%	0.552	C	S	.	*			trans	-117.9	144.5	-174.7	-57.1	-69.1	0	0	0	112.1	V10 L12 Y33 E201 A210	V10-F35 HydrophobicContact CG1-CE1 4.27Å; V10-F35 HydrophobicContact CG1-CE2 3.74Å; V10-F35 HydrophobicContact CG1-CZ 3.37Å; L12-F35 HydrophobicContact CB-CE1 4.39Å; L12-F35 HydrophobicContact CB-CZ 4.01Å; L12-F35 HydrophobicContact CD1-CE1 4.08Å; L12-F35 HydrophobicContact CD1-CE2 4.33Å; L12-F35 HydrophobicContact CD1-CZ 3.81Å; L12-F35 HydrophobicContact CD2-CE1 4.22Å; L12-F35 HydrophobicContact CG-CE1 4.46Å; L12-F35 HydrophobicContact CG-CZ 4.35Å; Y33-F35 VanDerWaalsContact C-N 3.32Å; Y33-F35 HydrophobicContact CD1-CB 4.47Å; Y33-F35 WeakPolarHBondContact CD1-O 3.46Å; Y33-F35 HydrophobicContact CE1-CB 3.77Å; Y33-F35 WeakPolarHBondContact CE1-O 3.07Å; Y33-F35 HydrophobicContact CE2-CD2 4.15Å; Y33-F35 PolarHBondContact O-N 3.42Å; F35-E201 HydrophobicContact CD2-CB 4.24Å; F35-E201 HydrophobicContact CD2-CG 3.96Å; F35-E201 WeakPolarHBondContact CD2-OE2 3.46Å; F35-E201 HydrophobicContact CE2-CB 3.78Å; F35-E201 HydrophobicContact CE2-CG 3.76Å; F35-A210 HydrophobicContact CD1-CB 3.7Å; F35-A210 HydrophobicContact CE1-CB 4.2Å; F35-A210 HydrophobicContact CG-CB 4.33Å
36	I	49.2	Very low	46.7	Very low	129 Å²	129	114.5 Å²	114.5	66%	0.662	56%	0.564	S	S	*	*			trans	-97.9	109.9	169.5	-63.2	172.5	0	0	0	107.5	R38 T213	I36-R38 PolarHBondContact O-N 3.31Å; I36-T213 HydrophobicContact CD1-CG2 4.33Å; I36-T213 HydrophobicContact CG1-CG2 4.07Å
37	I	45.1	Very low	45.4	Very low	110 Å²	110	117.3 Å²	117.3	56%	0.564	59%	0.588	S	S	*	*			trans	-75.1	96.9	171.9	-56.6	171.7	0	0	0	107.8	Y33 K39	Y33-I37 HydrophobicContact CE1-CD1 4.28Å; Y33-I37 HydrophobicContact CE1-CG1 4.2Å; I37-K39 PolarHBondContact O-N 3.09Å; I37-K39 VanDerWaalsContact O-N 3.09Å
38	R	39.7	Very low	44	Very low	213 Å²	213	118.4 Å²	118.4	80%	0.804	60%	0.604	S	S	*	*			trans	-70.1	102.5	161.3	-81	-173	176.4	177.7	0.5	107.4	I36 S40	I36-R38 PolarHBondContact O-N 3.31Å; R38-S40 PolarHBondContact O-N 3.27Å
39	K	36	Very low	42.7	Very low	185 Å²	185	124.9 Å²	124.9	80%	0.804	64%	0.638	S	S	*	*			trans	-56.7	126	166	-75.5	-176.4	178.4	177	0	107.7	I37 L41	I37-K39 PolarHBondContact O-N 3.09Å; I37-K39 VanDerWaalsContact O-N 3.09Å; K39-L41 PolarHBondContact O-N 2.76Å
40	S	38.6	Very low	41.4	Very low	103 Å²	103	126.7 Å²	126.7	72%	0.72	64%	0.641	S	S	*	*			trans	-42.2	112.5	173.7	179	0	0	0	0	109.7	R38 K42	R38-S40 PolarHBondContact O-N 3.27Å; S40-K42 PolarHBondContact O-N 2.6Å
41	L	37.1	Very low	40	Very low	165 Å²	165	128.8 Å²	128.8	86%	0.864	65%	0.651	S	S	*	*			trans	-57.9	115.1	168.2	-83.7	156.3	0	0	0	106	K39 K43	K39-L41 PolarHBondContact O-N 2.76Å; L41-K43 PolarHBondContact O-N 3.04Å
42	K	35.8	Very low	38.8	Very low	203 Å²	203	132.2 Å²	132.2	88%	0.883	68%	0.677	S	S	*	*			trans	-43.6	118.4	176.3	-75.5	-179.1	175.7	178.4	0	108.6	S40 A44	S40-K42 PolarHBondContact O-N 2.6Å; K42-A44 PolarHBondContact O-N 3.42Å
43	K	33	Very low	37.7	Very low	197 Å²	197	133.2 Å²	133.2	86%	0.857	68%	0.677	S	S	*	*			trans	-16.6	92.5	173.3	-76.4	179.6	172.5	179.6	0	112.4	L41 R45	L41-K43 PolarHBondContact O-N 3.04Å; K43-R45 VanDerWaalsContact C-N 3.33Å; K43-R45 PolarHBondContact O-N 2.99Å
44	A	30.2	Very low	36.7	Very low	100 Å²	100	135.8 Å²	135.8	83%	0.826	69%	0.694	S	S	*	*			trans	-71.1	100	161.4	0	0	0	0	0	105.7	K42 H46	K42-A44 PolarHBondContact O-N 3.42Å; A44-H46 PolarHBondContact O-N 2.9Å
45	R	29.9	Very low	35.7	Very low	224 Å²	224	142.8 Å²	142.8	85%	0.845	73%	0.726	S	S	*	*			trans	-67.9	91.2	173.4	-72.1	176.7	172	-180	-3.1	108.2	K43	K43-R45 VanDerWaalsContact C-N 3.33Å; K43-R45 PolarHBondContact O-N 2.99Å
46	H	32.3	Very low	34.5	Very low	180 Å²	180	145.1 Å²	145.1	83%	0.833	75%	0.753	S	S	*	*			trans	-155.5	124.1	158.1	-89.2	-62	0	0	0	112.2	A44	A44-H46 PolarHBondContact O-N 2.9Å
47	S	32.1	Very low	34.2	Very low	88 Å²	88	144.1 Å²	144.1	62%	0.615	76%	0.757	S	S	*	*			trans	58.2	102.2	152.7	58.4	0	0	0	0	118.9	L49	S47-L49 VanDerWaalsContact C-N 3.27Å; S47-L49 PolarHBondContact O-N 3.43Å
48	D	31.2	Very low	34.6	Very low	167 Å²	167	146.4 Å²	146.4	89%	0.893	76%	0.759	S	S	*	*			trans	-9.3	72.6	135.2	-53.4	-36.5	0	0	0	115.7
49	L	31.2	Very low	35.5	Very low	139 Å²	139	144 Å²	144	73%	0.728	76%	0.756	S	S	*	*			trans	-92.7	109.6	151.2	-86.4	116.4	0	0	0	106	S47 T51	S47-L49 VanDerWaalsContact C-N 3.27Å; S47-L49 PolarHBondContact O-N 3.43Å; L49-T51 PolarHBondContact O-N 3.02Å
50	N	30.2	Very low	36.9	Very low	162 Å²	162	138.6 Å²	138.6	87%	0.866	73%	0.733	S	S	*	*			trans	-59.6	69.3	163.4	-77.8	-25.9	0	0	0	109.1	S52	N50-S52 PolarHBondContact O-N 3.17Å
51	T	29.5	Very low	38.4	Very low	106 Å²	106	136.5 Å²	136.5	65%	0.65	71%	0.714	S	S	*	*			trans	-71	94	152.2	49.7	0	0	0	0	104	L49 D53	L49-T51 PolarHBondContact O-N 3.02Å; T51-D53 PolarHBondContact O-N 2.79Å
52	S	32	Very low	40.1	Very low	95 Å²	95	134.6 Å²	134.6	66%	0.664	70%	0.701	S	S	*	*			trans	-38.1	105.5	162.1	42.2	0	0	0	0	107.7	N50 I54	N50-S52 PolarHBondContact O-N 3.17Å; S52-I54 PolarHBondContact O-N 3.01Å
53	D	33.5	Very low	41.9	Very low	134 Å²	134	125 Å²	125	72%	0.717	66%	0.659	S	S	*	*			trans	-62.7	81.5	176.1	-84.7	-41.2	0	0	0	107.2	T51 Q55	T51-D53 PolarHBondContact O-N 2.79Å; D53-Q55 PolarHBondContact O-N 2.86Å
54	I	33.5	Very low	44	Very low	131 Å²	131	116.7 Å²	116.7	67%	0.672	63%	0.625	S	S	*	*			trans	-75.1	59.2	157.4	-50.1	172.3	0	0	0	105	S52 G56	S52-I54 PolarHBondContact O-N 3.01Å; I54-G56 VanDerWaalsContact C-N 3.26Å; I54-G56 PolarHBondContact O-N 2.84Å
55	Q	33.7	Very low	46	Very low	158 Å²	158	111.9 Å²	111.9	74%	0.738	59%	0.585	S	S	*	*			trans	-65.2	101.6	157.2	-84.4	-173.7	-25.2	0	0	103.9	D53 S57	D53-Q55 PolarHBondContact O-N 2.86Å; Q55-S57 PolarHBondContact O-N 3.46Å
56	G	31.2	Very low	48.2	Very low	58 Å²	58	102.5 Å²	102.5	60%	0.598	55%	0.551	S	S	*	*			trans	-45.3	119.4	159.7	0	0	0	0	0	106.1	I54 R58	I54-G56 VanDerWaalsContact C-N 3.26Å; I54-G56 PolarHBondContact O-N 2.84Å; G56-R58 VanDerWaalsContact C-N 3.27Å; G56-R58 PolarHBondContact O-N 3.39Å
57	S	43.4	Very low	50.2	Low	108 Å²	108	95 Å²	95	76%	0.755	52%	0.518	S	S	*	.			trans	-64.5	91.1	-170.3	55.9	0	0	0	0	108.4	Q55 Q59	Q55-S57 PolarHBondContact O-N 3.46Å; S57-Q59 PolarHBondContact O-N 3.11Å; S57-Q59 VanDerWaalsContact O-N 3.17Å
58	R	53.3	Low	52.1	Low	158 Å²	158	94.2 Å²	94.2	60%	0.596	50%	0.502	S	S	*	.			trans	-65.9	115.9	175.6	-73.2	-173	173.7	-136.2	-4.3	106.9	G56 F60	G56-R58 VanDerWaalsContact C-N 3.27Å; G56-R58 PolarHBondContact O-N 3.39Å; R58-F60 PolarHBondContact O-N 2.92Å
59	Q	59.1	Low	54.1	Low	162 Å²	162	90.9 Å²	90.9	76%	0.757	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-77.1	117.7	173	-76	-176.8	-15.6	0	0	108.4	S57	S57-Q59 PolarHBondContact O-N 3.11Å; S57-Q59 VanDerWaalsContact O-N 3.17Å
60	F	63.6	Low	55.7	Low	73 Å²	73	85.8 Å²	85.8	32%	0.32	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-84.3	135.6	171.6	-64.9	-80	0	0	0	109	T16 R58 E97 I99	T16-F60 HydrophobicContact CG2-CB 3.88Å; T16-F60 HydrophobicContact CG2-CD1 3.48Å; T16-F60 VanDerWaalsContact CG2-CD1 3.48Å; T16-F60 HydrophobicContact CG2-CD2 3.47Å; T16-F60 VanDerWaalsContact CG2-CD2 3.47Å; T16-F60 HydrophobicContact CG2-CE1 3.78Å; T16-F60 HydrophobicContact CG2-CE2 3.77Å; T16-F60 HydrophobicContact CG2-CG 3.31Å; T16-F60 HydrophobicContact CG2-CZ 3.91Å; R58-F60 PolarHBondContact O-N 2.92Å; F60-E97 HydrophobicContact CB-CB 4.4Å; F60-I99 HydrophobicContact CD1-CD1 4.21Å; F60-I99 HydrophobicContact CD1-CG1 3.99Å; F60-I99 HydrophobicContact CE1-CD1 4.22Å; F60-I99 HydrophobicContact CE1-CG1 4.39Å
61	N	70.2	Confident	57	Low	58 Å²	58	82.5 Å²	82.5	31%	0.31	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	154.4	-178.3	-67	-36.6	0	0	0	110.7	I63 E97 G98 S155	N61-I63 PolarHBondContact O-N 2.86Å; N61-E97 CarbonylContact O-C 3.52Å; N61-E97 VanDerWaalsContact O-CA 3.28Å; N61-E97 WeakPolarHBondContact O-CA 3.42Å; N61-G98 PolarHBondContact N-O 3.21Å; N61-G98 PolarHBondContact O-N 3.38Å; N61-S155 WeakPolarHBondContact ND2-CB 3.49Å; N61-S155 PolarHBondContact ND2-OG 3.33Å
62	Q	74.4	Confident	57.8	Low	126 Å²	126	81.7 Å²	81.7	59%	0.589	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	117.6	175.4	-173.4	179.5	-12.2	0	0	110	T96	Q62-T96 CarbonylContact C-O 3.59Å; Q62-T96 WeakPolarHBondContact CA-O 3.13Å
63	I	73.5	Confident	58.2	Low	0 Å²	0	83.5 Å²	83.5	0%	0	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.3	174.4	-59.5	168	0	0	0	107.9	F13 N61 V65 T95 T96 I100 V152 K153	F13-I63 HydrophobicContact CD1-CD1 4.34Å; F13-I63 HydrophobicContact CD1-CG2 4.45Å; F13-I63 HydrophobicContact CE1-CG2 4.26Å; N61-I63 PolarHBondContact O-N 2.86Å; I63-V65 HydrophobicContact CG2-CG2 4.17Å; I63-T95 WeakPolarHBondContact O-CA 3.44Å; I63-T96 PolarHBondContact N-O 2.96Å; I63-T96 PolarHBondContact O-N 3.13Å; I63-I100 HydrophobicContact CD1-CD1 4.09Å; I63-I100 HydrophobicContact CD1-CG1 3.58Å; I63-I100 HydrophobicContact CG1-CD1 4.15Å; I63-I100 HydrophobicContact CG1-CG1 4.13Å; I63-I100 HydrophobicContact CG2-CD1 4.08Å; I63-V152 HydrophobicContact CG2-CG1 4.39Å; I63-K153 WeakPolarHBondContact CA-O 3.27Å
64	T	75.2	Confident	58.5	Low	23 Å²	23	84.5 Å²	84.5	14%	0.141	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.9	175.1	-53.8	0	0	0	0	109.7	E66 V93 E94 T95 K153	T64-E66 HydrophobicContact CG2-CG 4.37Å; T64-V93 HydrophobicContact CG2-CG1 3.56Å; T64-E94 WeakPolarHBondContact CA-O 3.32Å; T64-T95 HydrophobicContact CG2-CG2 3.91Å; T64-K153 PolarHBondContact N-O 3.46Å; T64-K153 PolarHBondContact O-N 2.77Å
65	V	73.7	Confident	58.5	Low	0 Å²	0	82.3 Å²	82.3	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116.8	177.9	-175.9	0	0	0	0	109.4	L20 L24 I63 V93 E94 K150 I151 V152	L20-V65 HydrophobicContact CD1-CG2 3.64Å; L20-V65 HydrophobicContact CD2-CB 3.91Å; L20-V65 HydrophobicContact CD2-CG2 3.8Å; L20-V65 HydrophobicContact CG-CG2 4.42Å; L24-V65 HydrophobicContact CD2-CG2 4.39Å; I63-V65 HydrophobicContact CG2-CG2 4.17Å; V65-V93 WeakPolarHBondContact O-CA 3.16Å; V65-E94 PolarHBondContact N-O 2.81Å; V65-E94 PolarHBondContact O-N 2.94Å; V65-K150 HydrophobicContact CG1-CB 4.39Å; V65-K150 HydrophobicContact CG1-CD 4.48Å; V65-I151 CarbonylContact C-O 3.56Å; V65-I151 VanDerWaalsContact CA-O 3.28Å; V65-I151 WeakPolarHBondContact CA-O 3.41Å; V65-V152 HydrophobicContact CG2-CG2 4.37Å
66	E	74.9	Confident	58.5	Low	27 Å²	27	86.8 Å²	86.8	13%	0.126	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	116.6	176.1	-49.8	178.3	-175	0	0	109.5	T64 Y68 T92 V93 K150 I151 K153	T64-E66 HydrophobicContact CG2-CG 4.37Å; E66-Y68 HydrophobicContact CB-CE2 3.96Å; E66-Y68 PolarHBondContact OE2-OH 3.39Å; E66-T92 CarbonylContact C-O 3.52Å; E66-T92 VanDerWaalsContact CA-O 3.31Å; E66-T92 WeakPolarHBondContact CA-O 3.43Å; E66-V93 HydrophobicContact CB-CG2 4.44Å; E66-V93 HydrophobicContact CG-CG1 4.18Å; E66-V93 HydrophobicContact CG-CG2 3.96Å; E66-K150 CarbonylContact O-C 3.53Å; E66-K150 WeakPolarHBondContact O-CA 3.42Å; E66-I151 HydrophobicContact CB-CB 4.24Å; E66-I151 PolarHBondContact N-O 3.14Å; E66-I151 PolarHBondContact O-N 3.37Å; E66-K153 IonicContact OE1-NZ 2.65Å; E66-K153 PolarHBondContact OE1-NZ 2.9Å; E66-K153 IonicContact OE2-NZ 2.86Å
67	T	74.9	Confident	58.8	Low	23 Å²	23	90.8 Å²	90.8	14%	0.141	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.7	-176.9	-57.6	0	0	0	0	111.6	T92 E148 K150	T67-T92 PolarHBondContact N-O 2.89Å; T67-T92 WeakPolarHBondContact O-CB 3.27Å; T67-E148 HydrophobicContact CG2-CG 3.96Å; T67-E148 WeakPolarHBondContact CG2-OE1 3.35Å; T67-K150 HydrophobicContact CG2-CG 4.08Å; T67-K150 WeakPolarHBondContact OG1-CE 3.49Å
68	Y	72.8	Confident	58.6	Low	70 Å²	70	93.2 Å²	93.2	28%	0.275	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	108.3	174.7	-63.4	-91.2	0	0	0	109.4	E66 V132 L149 I151	E66-Y68 HydrophobicContact CB-CE2 3.96Å; E66-Y68 PolarHBondContact OE2-OH 3.39Å; Y68-V132 HydrophobicContact CE2-CG1 3.82Å; Y68-L149 HydrophobicContact CD2-CD2 4.4Å; Y68-L149 PolarHBondContact N-O 3.33Å; Y68-L149 PolarHBondContact O-N 3.04Å; Y68-I151 HydrophobicContact CD2-CD1 4.35Å; Y68-I151 HydrophobicContact CE2-CD1 3.86Å; Y68-I151 HydrophobicContact CE2-CG1 4.31Å
69	T	72.4	Confident	58	Low	97 Å²	97	92.9 Å²	92.9	60%	0.595	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	125.3	169.4	49.1	0	0	0	0	109	D71	T69-D71 VanDerWaalsContact C-N 3.31Å
70	M	64.4	Low	57.1	Low	32 Å²	32	93 Å²	93	16%	0.158	47%	0.474	C	S	.	.			trans	-90.2	5	-177.9	-62.8	-91.6	79.9	0	0	112.8	T72 L136 R143 I146 E147	M70-T72 PolarHBondContact O-N 2.94Å; M70-L136 HydrophobicContact CE-CD2 4.19Å; M70-L136 HydrophobicContact SD-CD2 4.45Å; M70-R143 VanDerWaalsContact CE-NE 3.32Å; M70-R143 HydrophobicContact SD-CG 3.46Å; M70-R143 WeakPolarHBondContact SD-CG 3.48Å; M70-R143 PolarHBondContact SD-NE 2.81Å; M70-I146 VanDerWaalsContact CB-O 3.32Å; M70-I146 WeakPolarHBondContact CB-O 3.43Å; M70-I146 HydrophobicContact CG-CB 4.32Å; M70-I146 HydrophobicContact CG-CG2 4.06Å; M70-E147 PolarHBondContact N-O 3.36Å; M70-E147 VanDerWaalsContact N-O 3.16Å
71	D	56.8	Low	55.9	Low	94 Å²	94	94 Å²	94	50%	0.503	51%	0.505	S	S	.	.			trans	-57.1	137.5	178.7	-76.1	-28.2	0	0	0	111.5	T69 R167	T69-D71 VanDerWaalsContact C-N 3.31Å; D71-R167 IonicContact OD1-NH2 3.71Å; D71-R167 PolarHBondContact OD1-NH2 2.9Å
72	T	47.8	Very low	54.7	Low	88 Å²	88	98 Å²	98	54%	0.54	52%	0.522	S	S	.	.			trans	-51.9	134.8	162.1	41.2	0	0	0	0	107.4	M70 E74	M70-T72 PolarHBondContact O-N 2.94Å; T72-E74 PolarHBondContact O-N 3.08Å; T72-E74 PolarHBondContact OG1-OE1 3.14Å
73	P	40.3	Very low	53.1	Low	133 Å²	133	101 Å²	101	86%	0.864	54%	0.536	S	S	*	.			trans	-70.2	71.8	179.7	27.5	-32.2	0	0	0	109.5	S75	P73-S75 PolarHBondContact O-N 2.84Å
74	E	38.7	Very low	51.5	Low	155 Å²	155	108.9 Å²	108.9	72%	0.724	58%	0.576	S	S	*	*			trans	-82.1	104.4	174.4	-76.1	-177.6	-172.6	0	0	107.7	T72	T72-E74 PolarHBondContact O-N 3.08Å; T72-E74 PolarHBondContact OG1-OE1 3.14Å
75	S	33.4	Very low	50.3	Low	85 Å²	85	111.7 Å²	111.7	59%	0.594	60%	0.597	S	S	*	*			trans	55.7	93.4	155.3	48.5	0	0	0	0	115.3	P73 N77	P73-S75 PolarHBondContact O-N 2.84Å; S75-N77 PolarHBondContact O-N 2.82Å
76	W	35.5	Very low	48.5	Very low	253 Å²	253	120.2 Å²	120.2	96%	0.958	63%	0.634	S	S	*	*			trans	-53.4	91.9	147	-62.3	-20.7	0	0	0	108.1	L78	W76-L78 PolarHBondContact O-N 3.02Å
77	N	35.8	Very low	47	Very low	142 Å²	142	125.7 Å²	125.7	76%	0.759	66%	0.658	S	S	*	*			trans	-69.1	81.4	166.9	-101.3	-36.9	0	0	0	106.6	S75 D79	S75-N77 PolarHBondContact O-N 2.82Å; N77-D79 PolarHBondContact O-N 3.38Å
78	L	38.9	Very low	45.3	Very low	158 Å²	158	130.4 Å²	130.4	83%	0.827	69%	0.692	S	S	*	*			trans	-76.9	58.7	-178.6	-160.8	84.5	0	0	0	109.7	W76	W76-L78 PolarHBondContact O-N 3.02Å
79	D	40.9	Very low	44.1	Very low	152 Å²	152	130.1 Å²	130.1	81%	0.813	71%	0.71	S	S	*	*			trans	-138.7	22.1	-173.9	-106.1	-7.4	0	0	0	115.1	N77	N77-D79 PolarHBondContact O-N 3.38Å
80	K	40.3	Very low	43.4	Very low	163 Å²	163	129.9 Å²	129.9	71%	0.709	71%	0.705	S	S	*	*			trans	-127.3	119.1	163.9	-68.2	-172.6	179.2	-179.9	0	109.5	E82	K80-E82 HydrophobicContact CB-CG 4.12Å; K80-E82 PolarHBondContact O-N 2.97Å
81	G	39.9	Very low	43.1	Very low	94 Å²	94	132.5 Å²	132.5	97%	0.969	72%	0.724	S	S	*	*			trans	-68.2	50.8	175.2	0	0	0	0	0	113
82	E	44.2	Very low	43.3	Very low	143 Å²	143	130.3 Å²	130.3	67%	0.668	71%	0.714	S	S	*	*			trans	-89.8	143.9	178.2	-73	175.4	-175.7	0	0	109.4	K80 I84	K80-E82 HydrophobicContact CB-CG 4.12Å; K80-E82 PolarHBondContact O-N 2.97Å; E82-I84 PolarHBondContact O-N 3.37Å
83	E	40.4	Very low	44.2	Very low	190 Å²	190	128.4 Å²	128.4	89%	0.888	70%	0.703	S	S	*	*			trans	-41.1	121.3	-178.8	-68.1	173.8	147.5	0	0	111.5	S85	E83-S85 VanDerWaalsContact C-N 3.27Å; E83-S85 PolarHBondContact O-N 3.28Å
84	I	40.5	Very low	45.6	Very low	164 Å²	164	124.9 Å²	124.9	84%	0.841	68%	0.675	S	S	*	*			trans	-67.7	95.5	169.9	-56.6	169.1	0	0	0	105.8	E82 F86	E82-I84 PolarHBondContact O-N 3.37Å; I84-F86 PolarHBondContact O-N 2.84Å
85	S	49.3	Very low	47.1	Very low	83 Å²	83	120.2 Å²	120.2	58%	0.58	66%	0.657	S	S	*	*			trans	-64.2	106.3	171.2	36.8	0	0	0	0	107.6	E83	E83-S85 VanDerWaalsContact C-N 3.27Å; E83-S85 PolarHBondContact O-N 3.28Å
86	F	36.1	Very low	48.9	Very low	179 Å²	179	116.4 Å²	116.4	79%	0.785	63%	0.63	S	S	*	*			trans	-80.8	126.4	169.3	87.1	-86.5	0	0	0	107.6	I84	I84-F86 PolarHBondContact O-N 2.84Å
87	F	43.5	Very low	50.8	Low	141 Å²	141	109.3 Å²	109.3	62%	0.618	61%	0.607	S	S	*	*			trans	-102	133.2	170.6	-68	-91.2	0	0	0	108	P91	F87-P91 HydrophobicContact CB-CB 4.39Å; F87-P91 HydrophobicContact CD2-CB 4.5Å; F87-P91 HydrophobicContact CG-CB 4.35Å
88	S	39.9	Very low	52.5	Low	123 Å²	123	102.6 Å²	102.6	86%	0.86	57%	0.571	S	S	*	*	S	Bend	trans	-88.1	113.3	167.7	-171.4	0	0	0	0	108
89	G	47.7	Very low	54.1	Low	63 Å²	63	96.8 Å²	96.8	65%	0.649	54%	0.541	S	S	*	.	S	Bend	trans	110.2	-179.1	-174	0	0	0	0	0	112.7	P91	G89-P91 WeakPolarHBondContact O-CD 3.39Å
90	N	57.3	Low	55.7	Low	92 Å²	92	89.9 Å²	89.9	49%	0.492	50%	0.504	S	S	.	.			trans	-77.7	115.1	175.4	-174.9	-1.4	0	0	0	108.6	T92 V93	N90-T92 PolarHBondContact ND2-OG1 2.78Å; N90-T92 PolarHBondContact O-N 2.8Å; N90-T92 PolarHBondContact OD1-N 2.96Å; N90-T92 PolarHBondContact OD1-OG1 2.92Å; N90-V93 HydrophobicContact CB-CB 4.43Å; N90-V93 HydrophobicContact CB-CG2 4.04Å; N90-V93 PolarHBondContact O-N 3.45Å
91	P	57.1	Low	57.4	Low	88 Å²	88	83.1 Å²	83.1	57%	0.571	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.8	-176.7	26.9	-36.4	0	0	0	113.2	F87 G89 V93	F87-P91 HydrophobicContact CB-CB 4.39Å; F87-P91 HydrophobicContact CD2-CB 4.5Å; F87-P91 HydrophobicContact CG-CB 4.35Å; G89-P91 WeakPolarHBondContact O-CD 3.39Å; P91-V93 VanDerWaalsContact C-N 3.29Å
92	T	62.3	Low	59.1	Low	47 Å²	47	78.6 Å²	78.6	29%	0.288	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-16.2	175.3	68.9	0	0	0	0	113.1	E66 T67 N90	E66-T92 CarbonylContact C-O 3.52Å; E66-T92 VanDerWaalsContact CA-O 3.31Å; E66-T92 WeakPolarHBondContact CA-O 3.43Å; T67-T92 PolarHBondContact N-O 2.89Å; T67-T92 WeakPolarHBondContact O-CB 3.27Å; N90-T92 PolarHBondContact ND2-OG1 2.78Å; N90-T92 PolarHBondContact O-N 2.8Å; N90-T92 PolarHBondContact OD1-N 2.96Å; N90-T92 PolarHBondContact OD1-OG1 2.92Å
93	V	65.9	Low	60.5	Low	49 Å²	49	72.3 Å²	72.3	30%	0.297	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	108.5	-173.3	-174.4	0	0	0	0	109.7	T64 V65 E66 N90 P91 T95	T64-V93 HydrophobicContact CG2-CG1 3.56Å; V65-V93 WeakPolarHBondContact O-CA 3.16Å; E66-V93 HydrophobicContact CB-CG2 4.44Å; E66-V93 HydrophobicContact CG-CG1 4.18Å; E66-V93 HydrophobicContact CG-CG2 3.96Å; N90-V93 HydrophobicContact CB-CB 4.43Å; N90-V93 HydrophobicContact CB-CG2 4.04Å; N90-V93 PolarHBondContact O-N 3.45Å; P91-V93 VanDerWaalsContact C-N 3.29Å; V93-T95 HydrophobicContact CG1-CG2 4.48Å
94	E	69.9	Low	62.1	Low	59 Å²	59	64 Å²	64	28%	0.276	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	132.6	175.6	-64.4	-178.6	154.7	0	0	109.6	L20 S23 T64 V65	L20-E94 HydrophobicContact CD2-CB 3.57Å; L20-E94 HydrophobicContact CD2-CG 4.45Å; L20-E94 WeakPolarHBondContact CD2-OE2 3.01Å; S23-E94 WeakPolarHBondContact CB-OE2 3.29Å; S23-E94 PolarHBondContact OG-OE2 3.41Å; T64-E94 WeakPolarHBondContact CA-O 3.32Å; V65-E94 PolarHBondContact N-O 2.81Å; V65-E94 PolarHBondContact O-N 2.94Å
95	T	71.2	Confident	63.5	Low	56 Å²	56	57.9 Å²	57.9	34%	0.344	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.2	179.8	50.2	0	0	0	0	110.5	K19 I63 T64 V93	K19-T95 WeakPolarHBondContact CD-O 3.35Å; K19-T95 PolarHBondContact NZ-O 3.1Å; I63-T95 WeakPolarHBondContact O-CA 3.44Å; T64-T95 HydrophobicContact CG2-CG2 3.91Å; V93-T95 HydrophobicContact CG1-CG2 4.48Å
96	T	70.7	Confident	63.9	Low	5 Å²	5	59.2 Å²	59.2	3%	0.031	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	163.9	177.5	52.5	0	0	0	0	111.6	E15 K19 L20 Q62 I63	E15-T96 WeakPolarHBondContact OE1-CB 3.49Å; E15-T96 WeakPolarHBondContact OE1-CG2 3.39Å; E15-T96 PolarHBondContact OE1-OG1 2.7Å; K19-T96 HydrophobicContact CB-CG2 3.45Å; K19-T96 VanDerWaalsContact CB-CG2 3.45Å; K19-T96 HydrophobicContact CD-CG2 3.79Å; K19-T96 HydrophobicContact CG-CG2 3.71Å; L20-T96 WeakPolarHBondContact CD1-OG1 3.44Å; L20-T96 HydrophobicContact CG-CG2 4.01Å; Q62-T96 CarbonylContact C-O 3.59Å; Q62-T96 WeakPolarHBondContact CA-O 3.13Å; I63-T96 PolarHBondContact N-O 2.96Å; I63-T96 PolarHBondContact O-N 3.13Å
97	E	74.3	Confident	65	Low	105 Å²	105	59.6 Å²	59.6	49%	0.491	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.3	174.1	-71.3	169.4	-178.6	0	0	107.7	T16 F60 N61	T16-E97 WeakPolarHBondContact CB-O 3.44Å; T16-E97 WeakPolarHBondContact CG2-O 3.49Å; T16-E97 PolarHBondContact N-O 2.63Å; T16-E97 PolarHBondContact OG1-O 2.91Å; F60-E97 HydrophobicContact CB-CB 4.4Å; N61-E97 CarbonylContact O-C 3.52Å; N61-E97 VanDerWaalsContact O-CA 3.28Å; N61-E97 WeakPolarHBondContact O-CA 3.42Å
98	G	72.2	Confident	65.8	Low	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	-172.5	-170.3	0	0	0	0	0	114.9	E14 N61	E14-G98 CarbonylContact O-C 3.56Å; E14-G98 WeakPolarHBondContact O-CA 3.47Å; N61-G98 PolarHBondContact N-O 3.21Å; N61-G98 PolarHBondContact O-N 3.38Å
99	I	72.2	Confident	66.7	Low	36 Å²	36	53.1 Å²	53.1	19%	0.185	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136.8	173.9	-58.8	171.4	0	0	0	108.3	E14 F60	E14-I99 PolarHBondContact N-O 2.89Å; E14-I99 PolarHBondContact O-N 2.87Å; F60-I99 HydrophobicContact CD1-CD1 4.21Å; F60-I99 HydrophobicContact CD1-CG1 3.99Å; F60-I99 HydrophobicContact CE1-CD1 4.22Å; F60-I99 HydrophobicContact CE1-CG1 4.39Å
100	I	75.9	Confident	67	Low	7 Å²	7	54.5 Å²	54.5	4%	0.036	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	104.6	177.3	-52.1	177.2	0	0	0	110.3	I11 F13 I63 I102 V152 D154 M161 R228	I11-I100 HydrophobicContact CG2-CG2 3.78Å; F13-I100 HydrophobicContact CD1-CD1 4.04Å; F13-I100 HydrophobicContact CD1-CG1 3.74Å; F13-I100 HydrophobicContact CD1-CG2 4.5Å; F13-I100 HydrophobicContact CE1-CD1 3.47Å; F13-I100 VanDerWaalsContact CE1-CD1 3.47Å; F13-I100 HydrophobicContact CE1-CG1 3.68Å; F13-I100 HydrophobicContact CE1-CG2 4.2Å; F13-I100 HydrophobicContact CZ-CD1 4.26Å; F13-I100 HydrophobicContact CZ-CG2 4.29Å; I63-I100 HydrophobicContact CD1-CD1 4.09Å; I63-I100 HydrophobicContact CD1-CG1 3.58Å; I63-I100 HydrophobicContact CG1-CD1 4.15Å; I63-I100 HydrophobicContact CG1-CG1 4.13Å; I63-I100 HydrophobicContact CG2-CD1 4.08Å; I100-I102 HydrophobicContact CG2-CG1 4.15Å; I100-V152 HydrophobicContact CD1-CG1 3.66Å; I100-D154 HydrophobicContact CD1-CB 3.88Å; I100-M161 HydrophobicContact CD1-CE 3.94Å; I100-M161 HydrophobicContact CG2-CE 4.2Å; I100-R228 PolarHBondContact O-NH2 3.37Å
101	H	74.8	Confident	66.7	Low	21 Å²	21	51.8 Å²	51.8	10%	0.097	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	128.4	172.1	-63.2	-75.9	0	0	0	110.1	L12 E14 Y103 E218	L12-H101 HydrophobicContact CB-CB 4.18Å; L12-H101 PolarHBondContact N-O 3.06Å; L12-H101 PolarHBondContact O-N 3.32Å; E14-H101 IonicContact OE2-NE2 3.23Å; H101-Y103 HydrophobicContact CB-CD2 4.4Å; H101-Y103 HydrophobicContact CB-CE2 3.57Å; H101-E218 IonicContact CE1-OE1 3.77Å; H101-E218 IonicContact CG-OE1 2.7Å; H101-E218 IonicContact ND1-OE1 2.72Å; H101-E218 PolarHBondContact ND1-OE1 2.89Å
102	I	76.2	Confident	66.4	Low	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.7	175	-59.9	179.3	0	0	0	108.5	L9 I11 I100 F124 M161 L219 R228	L9-I102 HydrophobicContact CD1-CG2 4.41Å; L9-I102 HydrophobicContact CD2-CG2 3.67Å; L9-I102 HydrophobicContact CG-CG2 4.45Å; I11-I102 HydrophobicContact CG1-CG1 4.37Å; I11-I102 HydrophobicContact CG2-CG1 4.31Å; I100-I102 HydrophobicContact CG2-CG1 4.15Å; I102-F124 HydrophobicContact CD1-CE2 3.88Å; I102-F124 HydrophobicContact CG2-CE2 4.28Å; I102-M161 HydrophobicContact CD1-CE 4.28Å; I102-M161 HydrophobicContact CD1-SD 3.45Å; I102-M161 WeakPolarHBondContact CD1-SD 3.34Å; I102-L219 HydrophobicContact CG2-CD1 4.06Å; I102-L219 PolarHBondContact O-N 2.98Å; I102-R228 VanDerWaalsContact CB-NH1 3.34Å
103	Y	74.3	Confident	65.9	Low	10 Å²	10	56 Å²	56	4%	0.039	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	148.8	178.1	-55.7	-82.7	0	0	0	110.5	L9 V10 L12 H101 P212 L216 R217 E218	L9-Y103 CarbonylContact C-O 3.55Å; L9-Y103 WeakPolarHBondContact CA-O 3.28Å; V10-Y103 HydrophobicContact CG1-CD2 4.44Å; V10-Y103 PolarHBondContact N-O 2.84Å; V10-Y103 PolarHBondContact O-N 3.35Å; L12-Y103 HydrophobicContact CB-CE2 4.05Å; L12-Y103 HydrophobicContact CD2-CE2 4.34Å; H101-Y103 HydrophobicContact CB-CD2 4.4Å; H101-Y103 HydrophobicContact CB-CE2 3.57Å; Y103-P212 HydrophobicContact CD1-CB 3.99Å; Y103-P212 HydrophobicContact CD1-CG 4.47Å; Y103-P212 HydrophobicContact CE1-CB 3.62Å; Y103-P212 HydrophobicContact CE1-CG 3.7Å; Y103-L216 HydrophobicContact CD1-CB 4.17Å; Y103-L216 HydrophobicContact CG-CB 4.38Å; Y103-L216 HydrophobicContact CG-CD1 4.41Å; Y103-R217 CarbonylContact C-O 3.53Å; Y103-R217 WeakPolarHBondContact CA-O 3.25Å; Y103-E218 HydrophobicContact CD1-CB 3.96Å; Y103-E218 HydrophobicContact CD1-CG 4.49Å; Y103-E218 HydrophobicContact CE1-CB 3.95Å; Y103-E218 HydrophobicContact CE1-CG 4.32Å
104	K	73.1	Confident	65.2	Low	17 Å²	17	59.5 Å²	59.5	7%	0.074	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.2	171	-166.1	174.5	-174.1	169.7	0	108.2	Y7 Q106 R217 L219 D230 P232	Y7-K104 HydrophobicContact CD1-CD 4.2Å; Y7-K104 HydrophobicContact CD1-CG 3.96Å; Y7-K104 HydrophobicContact CG-CD 4.19Å; Y7-K104 HydrophobicContact CG-CG 4.15Å; K104-Q106 PolarHBondContact O-N 3.4Å; K104-R217 PolarHBondContact N-O 3.38Å; K104-R217 PolarHBondContact O-N 3.3Å; K104-L219 HydrophobicContact CB-CD2 4.46Å; K104-L219 HydrophobicContact CD-CD2 4.24Å; K104-D230 IonicContact NZ-OD1 3.6Å; K104-D230 PolarHBondContact NZ-OD1 3.26Å; K104-D230 IonicContact NZ-OD2 2.75Å; K104-P232 VanDerWaalsContact NZ-CD 3.32Å
105	N	68.9	Low	64.4	Low	34 Å²	34	60.1 Å²	60.1	18%	0.182	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	134	171.4	-73.8	-12	0	0	0	109.8	Y7 H8 R107 L216	Y7-N105 VanDerWaalsContact CD1-O 3.23Å; Y7-N105 WeakPolarHBondContact CD1-O 3.36Å; H8-N105 PolarHBondContact O-N 3.25Å; N105-R107 VanDerWaalsContact C-N 3.27Å; N105-R107 PolarHBondContact O-N 3.22Å; N105-L216 WeakPolarHBondContact OD1-CD2 3.34Å
106	Q	59.2	Low	63.9	Low	112 Å²	112	57.7 Å²	57.7	52%	0.523	29%	0.291	S	S	.	.	S	Bend	trans	-67.7	-29.9	175.8	-75.6	179.5	6	0	0	112.5	K104 D215	K104-Q106 PolarHBondContact O-N 3.4Å; Q106-D215 HydrophobicContact CB-CB 4.34Å; Q106-D215 WeakPolarHBondContact CB-O 3.36Å; Q106-D215 VanDerWaalsContact CG-O 3.26Å; Q106-D215 WeakPolarHBondContact CG-O 3.28Å; Q106-D215 PolarHBondContact N-O 2.9Å
107	R	58.4	Low	63.6	Low	187 Å²	187	59.9 Å²	59.9	71%	0.706	30%	0.304	S	S	*	.	S	Bend	trans	-97.4	130.6	177.1	-63.1	-174.8	-172.7	-175	3.5	110.1	N105 V109	N105-R107 VanDerWaalsContact C-N 3.27Å; N105-R107 PolarHBondContact O-N 3.22Å; R107-V109 PolarHBondContact O-N 2.83Å
108	E	59.8	Low	63.5	Low	91 Å²	91	54.9 Å²	54.9	43%	0.425	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-62	133.8	168.4	-61.6	176	173.1	0	0	109.6	S5 Y7 P110	S5-E108 WeakPolarHBondContact CB-OE2 3.38Å; S5-E108 PolarHBondContact OG-OE2 3.4Å; Y7-E108 HydrophobicContact CD1-CG 4.32Å; Y7-E108 HydrophobicContact CD2-CG 4.33Å; Y7-E108 HydrophobicContact CE1-CG 3.68Å; Y7-E108 HydrophobicContact CE2-CG 3.65Å; Y7-E108 WeakPolarHBondContact CE2-OE1 3.44Å; Y7-E108 VanDerWaalsContact OH-CG 3.25Å; Y7-E108 WeakPolarHBondContact OH-CG 3.22Å; Y7-E108 PolarHBondContact OH-OE1 3.26Å; E108-P110 WeakPolarHBondContact O-CD 3.49Å
109	V	60.3	Low	63.9	Low	36 Å²	36	56.5 Å²	56.5	22%	0.218	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-88.7	119.6	175	-178.2	0	0	0	0	107.1	L6 H8 L31 R107	L6-V109 PolarHBondContact N-O 3.21Å; L6-V109 PolarHBondContact O-N 3.13Å; L6-V109 VanDerWaalsContact O-N 3.11Å; H8-V109 WeakPolarHBondContact ND1-CG2 3.36Å; L31-V109 HydrophobicContact CD2-CG1 4.19Å; L31-V109 HydrophobicContact CD2-CG2 4.37Å; R107-V109 PolarHBondContact O-N 2.83Å
110	P	52.3	Low	64.5	Low	92 Å²	92	55.1 Å²	55.1	60%	0.597	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-65.1	137.5	178	24.1	-30.8	0	0	0	110.3	E108 C112	E108-P110 WeakPolarHBondContact O-CD 3.49Å; P110-C112 PolarHBondContact O-N 2.86Å
111	R	51.3	Low	65	Low	35 Å²	35	54.8 Å²	54.8	13%	0.132	28%	0.282	C	S	.	.			trans	-61.4	105.3	164.9	-85.6	-178.5	155.3	178.4	-4.1	108	L6 N113 V116 D177	L6-R111 HydrophobicContact CD1-CG 4.33Å; R111-N113 PolarHBondContact O-N 2.86Å; R111-V116 HydrophobicContact CG-CG2 3.77Å; R111-D177 IonicContact CZ-OD1 2.73Å; R111-D177 IonicContact NH1-OD1 3.65Å; R111-D177 IonicContact NH2-OD1 3.44Å; R111-D177 PolarHBondContact NH2-OD1 3.45Å; R111-D177 IonicContact NH2-OD2 3.57Å
112	C	50.9	Low	65.5	Low	84 Å²	84	53.8 Å²	53.8	57%	0.568	28%	0.278	S	S	*	.	B	Isolated β-bridge	trans	-83.5	114.4	175.2	-169.8	0	0	0	0	108.2	P110 D114 I115	P110-C112 PolarHBondContact O-N 2.86Å; C112-D114 VanDerWaalsContact C-N 3.33Å; C112-D114 PolarHBondContact O-N 2.84Å; C112-I115 PolarHBondContact O-N 3.29Å
113	N	51.2	Low	65.9	Low	141 Å²	141	53.8 Å²	53.8	75%	0.754	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	45.3	-178.8	-64.4	-14.6	0	0	0	113.9	R111 I115	R111-N113 PolarHBondContact O-N 2.86Å; N113-I115 PolarHBondContact O-N 3.45Å
114	D	52.7	Low	66.2	Low	122 Å²	122	53.5 Å²	53.5	65%	0.652	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	2	-176.9	-61.5	-42.6	0	0	0	115.7	C112	C112-D114 VanDerWaalsContact C-N 3.33Å; C112-D114 PolarHBondContact O-N 2.84Å
115	I	53.2	Low	66.5	Low	71 Å²	71	53.1 Å²	53.1	36%	0.364	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-103.1	112.5	179.6	-60.2	165.4	0	0	0	108.7	C112 N113 A169	C112-I115 PolarHBondContact O-N 3.29Å; N113-I115 PolarHBondContact O-N 3.45Å; I115-A169 HydrophobicContact CG2-CB 4.19Å
116	V	60	Low	67.3	Low	6 Å²	6	51.5 Å²	51.5	4%	0.036	27%	0.268	C	S	.	.			trans	-77.8	140.8	164.3	-172.7	0	0	0	0	107.9	L6 H8 R111 V173 Y196	L6-V116 HydrophobicContact CD1-CG2 3.96Å; H8-V116 VanDerWaalsContact NE2-CG1 3.29Å; H8-V116 WeakPolarHBondContact NE2-CG1 3.27Å; R111-V116 HydrophobicContact CG-CG2 3.77Å; V116-V173 HydrophobicContact CB-CG2 3.97Å; V116-V173 HydrophobicContact CG2-CG2 4.01Å; V116-Y196 HydrophobicContact CB-CD1 4.25Å; V116-Y196 HydrophobicContact CB-CE1 3.77Å; V116-Y196 HydrophobicContact CG1-CD1 3.63Å; V116-Y196 HydrophobicContact CG1-CD2 4.49Å; V116-Y196 HydrophobicContact CG1-CE1 3.68Å; V116-Y196 HydrophobicContact CG1-CG 4.01Å; V116-Y196 HydrophobicContact CG2-CE1 4.09Å; V116-Y196 HydrophobicContact CG2-CE2 4.35Å
117	T	64.6	Low	68.4	Low	50 Å²	50	46.8 Å²	46.8	31%	0.307	25%	0.246	S	C	.	.	S	Bend	trans	-92.1	-8.1	-166.2	68.9	0	0	0	0	114.8	S30	S30-T117 VanDerWaalsContact CB-CB 3.48Å; S30-T117 WeakPolarHBondContact CB-OG1 3.46Å; S30-T117 WeakPolarHBondContact OG-CB 3.45Å; S30-T117 PolarHBondContact OG-O 3.2Å; S30-T117 PolarHBondContact OG-OG1 2.97Å
118	S	71.8	Confident	69.6	Low	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.236	C	C	.	.			trans	-87.2	133.1	173.5	53.6	0	0	0	0	111.1	V120 Y196 V197	S118-V120 VanDerWaalsContact C-N 3.34Å; S118-Y196 WeakPolarHBondContact OG-CD1 3.42Å; S118-V197 VanDerWaalsContact CB-O 3.22Å; S118-V197 WeakPolarHBondContact CB-O 3.22Å
119	T	80.9	Confident	70.6	Confident	34 Å²	34	41.4 Å²	41.4	21%	0.209	24%	0.237	C	C	.	.			trans	-92.3	8.9	174.6	58.5	0	0	0	0	113.3	Y26 F166 A169 T172	Y26-T119 WeakPolarHBondContact CE2-OG1 3.36Å; Y26-T119 PolarHBondContact OH-N 3.29Å; Y26-T119 PolarHBondContact OH-OG1 2.86Å; T119-F166 PolarHBondContact O-N 3.1Å; T119-A169 HydrophobicContact CG2-CB 4.22Å; T119-T172 WeakPolarHBondContact CA-OG1 3.28Å
120	V	85	Confident	71.8	Confident	8 Å²	8	39.9 Å²	39.9	5%	0.048	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.5	-178.3	176	0	0	0	0	110.9	Y26 S118 L164 K165 V197	Y26-V120 HydrophobicContact CD1-CB 4.03Å; Y26-V120 HydrophobicContact CD1-CG2 3.79Å; Y26-V120 HydrophobicContact CD2-CG2 3.44Å; Y26-V120 VanDerWaalsContact CD2-CG2 3.44Å; Y26-V120 HydrophobicContact CE1-CB 3.78Å; Y26-V120 HydrophobicContact CE1-CG2 3.66Å; Y26-V120 HydrophobicContact CE2-CB 4.29Å; Y26-V120 HydrophobicContact CE2-CG2 3.29Å; Y26-V120 HydrophobicContact CG-CB 4.38Å; Y26-V120 HydrophobicContact CG-CG2 3.67Å; S118-V120 VanDerWaalsContact C-N 3.34Å; V120-L164 VanDerWaalsContact CA-O 3.24Å; V120-L164 WeakPolarHBondContact CA-O 3.3Å; V120-K165 HydrophobicContact CG2-CB 4.14Å; V120-K165 HydrophobicContact CG2-CG 4.04Å; V120-V197 HydrophobicContact CB-CB 4.23Å; V120-V197 HydrophobicContact CG1-CB 3.84Å; V120-V197 HydrophobicContact CG1-CG1 4.47Å; V120-V197 HydrophobicContact CG1-CG2 4.04Å; V120-V197 PolarHBondContact O-N 2.93Å
121	L	85.4	Confident	73.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	146.2	171	-66.1	174.8	0	0	0	110.4	L163 L164 F166 T172 F175 Y176 Y196	L121-L163 CarbonylContact O-C 3.59Å; L121-L163 WeakPolarHBondContact O-CA 3.35Å; L121-L164 PolarHBondContact N-O 2.96Å; L121-L164 PolarHBondContact O-N 2.98Å; L121-F166 HydrophobicContact CB-CE2 4.1Å; L121-F166 HydrophobicContact CD1-CE2 3.72Å; L121-F166 HydrophobicContact CD1-CZ 4.11Å; L121-F166 HydrophobicContact CG-CE2 3.97Å; L121-T172 HydrophobicContact CD1-CG2 3.81Å; L121-T172 HydrophobicContact CD2-CG2 3.9Å; L121-T172 HydrophobicContact CG-CG2 3.51Å; L121-F175 HydrophobicContact CD1-CB 4.42Å; L121-F175 HydrophobicContact CD1-CD1 3.64Å; L121-F175 HydrophobicContact CD1-CE1 4.43Å; L121-F175 HydrophobicContact CD1-CG 4.44Å; L121-Y176 HydrophobicContact CD2-CD2 4.12Å; L121-Y196 HydrophobicContact CD2-CD1 3.38Å; L121-Y196 HydrophobicContact CD2-CD2 4.19Å; L121-Y196 HydrophobicContact CD2-CE1 3.57Å; L121-Y196 HydrophobicContact CD2-CE2 4.26Å; L121-Y196 HydrophobicContact CD2-CG 3.77Å
122	C	85.7	Confident	74.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.1	170.6	-170.2	0	0	0	0	109.4	L9 F124 A162 L163 L194 M195 V197	L9-C122 HydrophobicContact CD1-CB 4.28Å; C122-F124 PolarHBondContact O-N 2.72Å; C122-A162 CarbonylContact C-O 3.38Å; C122-A162 WeakPolarHBondContact CA-O 3.48Å; C122-L163 HydrophobicContact CB-CD2 3.65Å; C122-L163 VanDerWaalsContact SG-CD2 3.59Å; C122-L194 WeakPolarHBondContact O-CA 3.35Å; C122-M195 PolarHBondContact N-O 2.89Å; C122-M195 PolarHBondContact O-N 2.8Å; C122-V197 HydrophobicContact CB-CG2 3.49Å; C122-V197 VanDerWaalsContact CB-CG2 3.49Å
123	F	85.4	Confident	76.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	111.9	153.3	-71.3	-94.5	0	0	0	107.8	V126 L135 F138 I139 M161 A162 L164 F175 Y184 C192 Q193 L194	F123-V126 HydrophobicContact CB-CG2 3.45Å; F123-V126 VanDerWaalsContact CB-CG2 3.45Å; F123-V126 HydrophobicContact CD1-CG2 4.17Å; F123-V126 HydrophobicContact CG-CG2 4.08Å; F123-L135 HydrophobicContact CD1-CD1 4.32Å; F123-L135 HydrophobicContact CE1-CD1 3.91Å; F123-L135 HydrophobicContact CE2-CD1 4.42Å; F123-L135 HydrophobicContact CZ-CD1 3.99Å; F123-F138 HydrophobicContact CE1-CD1 4.41Å; F123-F138 HydrophobicContact CE1-CE1 4.11Å; F123-F138 HydrophobicContact CZ-CD1 4.47Å; F123-F138 HydrophobicContact CZ-CE1 4.38Å; F123-I139 HydrophobicContact CE2-CG2 4.33Å; F123-I139 HydrophobicContact CZ-CG2 3.92Å; F123-M161 WeakPolarHBondContact O-CA 3.26Å; F123-A162 HydrophobicContact CB-CB 4.06Å; F123-A162 HydrophobicContact CD2-CB 4.12Å; F123-A162 HydrophobicContact CG-CB 4.41Å; F123-A162 PolarHBondContact N-O 3.4Å; F123-A162 PolarHBondContact O-N 2.86Å; F123-A162 VanDerWaalsContact O-N 3.08Å; F123-L164 HydrophobicContact CD2-CD1 3.36Å; F123-L164 HydrophobicContact CE2-CD1 3.3Å; F123-L164 HydrophobicContact CE2-CD2 3.89Å; F123-L164 HydrophobicContact CE2-CG 4.24Å; F123-F175 HydrophobicContact CE2-CE1 4.36Å; F123-F175 HydrophobicContact CE2-CZ 4.42Å; F123-F175 HydrophobicContact CZ-CE1 4.16Å; F123-F175 HydrophobicContact CZ-CZ 4.09Å; F123-Y184 HydrophobicContact CD1-CE1 4.15Å; F123-Y184 VanDerWaalsContact CD1-OH 3.3Å; F123-Y184 WeakPolarHBondContact CD1-OH 3.45Å; F123-Y184 AromaticContact CE1-CE1 3.92Å; F123-Y184 HydrophobicContact CE1-CE1 3.92Å; F123-C192 VanDerWaalsContact CD1-SG 3.54Å; F123-C192 WeakPolarHBondContact CE1-SG 3.38Å; F123-Q193 WeakPolarHBondContact CA-O 3.45Å; F123-L194 HydrophobicContact CD1-CD2 3.61Å; F123-L194 HydrophobicContact CD2-CD2 3.85Å; F123-L194 HydrophobicContact CE1-CD2 3.7Å; F123-L194 HydrophobicContact CE2-CD2 3.83Å; F123-L194 HydrophobicContact CG-CD2 3.74Å; F123-L194 HydrophobicContact CZ-CD2 3.79Å
124	F	81.2	Confident	78	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-41.1	-169.5	-173.9	-109.6	0	0	0	113.2	L9 I102 C122 M161 Q193 M195 L219 R228	L9-F124 HydrophobicContact CD1-CD2 4.11Å; I102-F124 HydrophobicContact CD1-CE2 3.88Å; I102-F124 HydrophobicContact CG2-CE2 4.28Å; C122-F124 PolarHBondContact O-N 2.72Å; F124-M161 WeakPolarHBondContact O-CG 3.41Å; F124-Q193 PolarHBondContact N-O 2.93Å; F124-Q193 VanDerWaalsContact N-O 3.11Å; F124-M195 HydrophobicContact CB-CG 4.42Å; F124-M195 HydrophobicContact CB-SD 4.12Å; F124-M195 HydrophobicContact CD1-SD 4.44Å; F124-M195 HydrophobicContact CD2-SD 3.97Å; F124-M195 HydrophobicContact CE2-SD 4.5Å; F124-M195 HydrophobicContact CG-SD 3.93Å; F124-L219 HydrophobicContact CE2-CD1 4.04Å; F124-L219 HydrophobicContact CZ-CD1 3.79Å; F124-R228 HydrophobicContact CE1-CB 3.85Å; F124-R228 HydrophobicContact CZ-CB 3.61Å; F124-R228 HydrophobicContact CZ-CG 4.21Å
125	S	78.3	Confident	79.6	Confident	9 Å²	9	30.1 Å²	30.1	6%	0.063	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	72.3	-174.4	-75	0	0	0	0	110.8	P127 Q159	S125-P127 WeakPolarHBondContact O-CD 3.3Å; S125-Q159 VanDerWaalsContact CB-OE1 3.24Å; S125-Q159 PolarHBondContact OG-OE1 2.73Å
126	V	85.1	Confident	81.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	123.6	173.7	-167.4	0	0	0	0	108.9	F123 V130 Q159 Y160 Y184	F123-V126 HydrophobicContact CB-CG2 3.45Å; F123-V126 VanDerWaalsContact CB-CG2 3.45Å; F123-V126 HydrophobicContact CD1-CG2 4.17Å; F123-V126 HydrophobicContact CG-CG2 4.08Å; V126-V130 HydrophobicContact CG1-CB 4.03Å; V126-V130 HydrophobicContact CG1-CG1 4.13Å; V126-Q159 CarbonylContact O-C 3.57Å; V126-Q159 VanDerWaalsContact O-CA 3.26Å; V126-Q159 WeakPolarHBondContact O-CA 3.49Å; V126-Y160 HydrophobicContact CB-CD1 4.15Å; V126-Y160 HydrophobicContact CB-CD2 4.11Å; V126-Y160 HydrophobicContact CB-CE1 3.82Å; V126-Y160 HydrophobicContact CB-CE2 3.78Å; V126-Y160 HydrophobicContact CB-CG 4.3Å; V126-Y160 WeakPolarHBondContact CB-O 3.33Å; V126-Y160 HydrophobicContact CG1-CD1 4.42Å; V126-Y160 HydrophobicContact CG1-CE1 3.62Å; V126-Y160 HydrophobicContact CG1-CE2 3.97Å; V126-Y160 WeakPolarHBondContact CG1-OH 3.38Å; V126-Y160 HydrophobicContact CG2-CD2 4.47Å; V126-Y160 HydrophobicContact CG2-CE2 4.08Å; V126-Y160 PolarHBondContact N-O 3.48Å; V126-Y160 WeakPolarHBondContact O-CD1 3.4Å; V126-Y160 PolarHBondContact O-N 2.87Å; V126-Y184 HydrophobicContact CG1-CE1 4.44Å
127	P	83.7	Confident	82.3	Confident	12 Å²	12	35 Å²	35	8%	0.078	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	144.2	178.6	-24	35.1	0	0	0	112.9	S125 H129 V130 N158 V190	S125-P127 WeakPolarHBondContact O-CD 3.3Å; P127-H129 WeakPolarHBondContact CB-CE1 3.32Å; P127-H129 WeakPolarHBondContact CB-ND1 3.28Å; P127-H129 PolarHBondContact O-N 3.5Å; P127-H129 VanDerWaalsContact O-N 3.16Å; P127-V130 HydrophobicContact CB-CG2 4.37Å; P127-V130 HydrophobicContact CG-CG2 4.49Å; P127-V130 WeakPolarHBondContact O-CB 3.43Å; P127-V130 PolarHBondContact O-N 2.8Å; P127-N158 CarbonylContact C-O 3.59Å; P127-V190 HydrophobicContact CG-CG1 3.89Å
128	S	82.1	Confident	83.3	Confident	69 Å²	69	34.1 Å²	34.1	48%	0.483	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.2	-176.7	59.3	0	0	0	0	114.7	N158	S128-N158 WeakPolarHBondContact CB-O 3.47Å; S128-N158 PolarHBondContact N-O 2.82Å; S128-N158 WeakPolarHBondContact OG-CA 3.27Å; S128-N158 PolarHBondContact OG-O 2.88Å
129	H	81.9	Confident	83.9	Confident	96 Å²	96	34.1 Å²	34.1	44%	0.444	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-23.2	175.3	64.1	-85.6	0	0	0	112.9	P127 T131 E188	P127-H129 WeakPolarHBondContact CB-CE1 3.32Å; P127-H129 WeakPolarHBondContact CB-ND1 3.28Å; P127-H129 PolarHBondContact O-N 3.5Å; P127-H129 VanDerWaalsContact O-N 3.16Å; H129-T131 PolarHBondContact O-N 3.32Å; H129-T131 VanDerWaalsContact O-N 3.16Å; H129-E188 IonicContact CD2-OE1 3.62Å; H129-E188 IonicContact CD2-OE2 2.81Å; H129-E188 IonicContact CE1-OE2 3.53Å; H129-E188 IonicContact NE2-OE1 3.12Å; H129-E188 PolarHBondContact NE2-OE1 3.41Å; H129-E188 IonicContact NE2-OE2 3.7Å; H129-E188 PolarHBondContact NE2-OE2 3.42Å
130	V	85.3	Confident	84.1	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.024	18%	0.184	C	C	.	.	S	Bend	trans	-74	105.8	170.3	179.8	0	0	0	0	106.7	V126 P127 D134 Y160 Y184	V126-V130 HydrophobicContact CG1-CB 4.03Å; V126-V130 HydrophobicContact CG1-CG1 4.13Å; P127-V130 HydrophobicContact CB-CG2 4.37Å; P127-V130 HydrophobicContact CG-CG2 4.49Å; P127-V130 WeakPolarHBondContact O-CB 3.43Å; P127-V130 PolarHBondContact O-N 2.8Å; V130-D134 HydrophobicContact CG1-CB 4.13Å; V130-Y160 WeakPolarHBondContact O-CE1 3.24Å; V130-Y160 PolarHBondContact O-OH 3.38Å; V130-Y160 VanDerWaalsContact O-OH 3.1Å; V130-Y184 HydrophobicContact CG2-CG 4.46Å
131	T	83.2	Confident	84.1	Confident	68 Å²	68	40 Å²	40	42%	0.417	21%	0.213	S	C	.	.			trans	-73.3	160.8	-178.9	71.5	0	0	0	0	110.6	H129 K133 D134 L135	H129-T131 PolarHBondContact O-N 3.32Å; H129-T131 VanDerWaalsContact O-N 3.16Å; T131-K133 PolarHBondContact O-N 3.41Å; T131-K133 VanDerWaalsContact O-N 3.09Å; T131-K133 PolarHBondContact OG1-N 3.43Å; T131-D134 PolarHBondContact N-OD2 3.41Å; T131-D134 PolarHBondContact O-N 3.27Å; T131-D134 VanDerWaalsContact OG1-CG 3.31Å; T131-D134 PolarHBondContact OG1-N 3.35Å; T131-D134 PolarHBondContact OG1-OD2 3.25Å; T131-L135 PolarHBondContact O-N 2.97Å
132	V	83.2	Confident	84	Confident	25 Å²	25	41.5 Å²	41.5	15%	0.152	22%	0.22	C	C	.	.	H	α-helix	trans	-51.5	-36.3	172.2	-179.9	0	0	0	0	111.8	Y68 L135 L136 I151	Y68-V132 HydrophobicContact CE2-CG1 3.82Å; V132-L135 PolarHBondContact O-N 2.87Å; V132-L136 HydrophobicContact CG1-CD1 4.09Å; V132-L136 HydrophobicContact CG1-CG 4.36Å; V132-L136 WeakPolarHBondContact O-CB 3.24Å; V132-L136 VanDerWaalsContact O-CG 3.25Å; V132-L136 WeakPolarHBondContact O-CG 3.46Å; V132-L136 PolarHBondContact O-N 2.73Å; V132-I151 HydrophobicContact CB-CD1 3.84Å; V132-I151 HydrophobicContact CG1-CD1 3.32Å; V132-I151 HydrophobicContact CG2-CD1 3.37Å
133	K	83.8	Confident	83.7	Confident	128 Å²	128	46.7 Å²	46.7	56%	0.557	24%	0.24	S	C	*	.	H	α-helix	trans	-65.6	-39	177.7	-173.6	-177.4	-175.4	-178.5	0	112.1	T131 R137	T131-K133 PolarHBondContact O-N 3.41Å; T131-K133 VanDerWaalsContact O-N 3.09Å; T131-K133 PolarHBondContact OG1-N 3.43Å; K133-R137 VanDerWaalsContact CE-NH2 3.34Å; K133-R137 VanDerWaalsContact O-CG 3.32Å; K133-R137 WeakPolarHBondContact O-CG 3.49Å; K133-R137 PolarHBondContact O-N 3.22Å
134	D	86.3	Confident	83.7	Confident	48 Å²	48	53.3 Å²	53.3	26%	0.257	28%	0.275	S	S	.	.	H	α-helix	trans	-73.7	-38.9	179.4	-57.3	-44.5	0	0	0	110.6	V130 T131 L136 R137 F138	V130-D134 HydrophobicContact CG1-CB 4.13Å; T131-D134 PolarHBondContact N-OD2 3.41Å; T131-D134 PolarHBondContact O-N 3.27Å; T131-D134 VanDerWaalsContact OG1-CG 3.31Å; T131-D134 PolarHBondContact OG1-N 3.35Å; T131-D134 PolarHBondContact OG1-OD2 3.25Å; D134-L136 PolarHBondContact O-N 3.45Å; D134-R137 WeakPolarHBondContact O-CB 3.22Å; D134-R137 PolarHBondContact O-N 3.29Å; D134-R137 IonicContact OD1-NH1 2.74Å; D134-R137 PolarHBondContact OD1-NH1 2.86Å; D134-F138 WeakPolarHBondContact O-CB 3.4Å; D134-F138 PolarHBondContact O-N 3.34Å
135	L	85.5	Confident	83.9	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-43.6	171.1	-173.5	65.2	0	0	0	111.8	F123 T131 V132 R137 F138 I139 Y160 A162 Y184	F123-L135 HydrophobicContact CD1-CD1 4.32Å; F123-L135 HydrophobicContact CE1-CD1 3.91Å; F123-L135 HydrophobicContact CE2-CD1 4.42Å; F123-L135 HydrophobicContact CZ-CD1 3.99Å; T131-L135 PolarHBondContact O-N 2.97Å; V132-L135 PolarHBondContact O-N 2.87Å; L135-R137 VanDerWaalsContact C-N 3.29Å; L135-R137 PolarHBondContact O-N 2.7Å; L135-F138 WeakPolarHBondContact O-CB 3.36Å; L135-F138 PolarHBondContact O-N 3.38Å; L135-I139 WeakPolarHBondContact O-CG1 3.49Å; L135-I139 PolarHBondContact O-N 2.85Å; L135-Y160 HydrophobicContact CD2-CE2 4.19Å; L135-A162 HydrophobicContact CD2-CB 3.89Å; L135-Y184 HydrophobicContact CD1-CD1 4.48Å; L135-Y184 HydrophobicContact CD1-CE1 3.94Å
136	L	84.3	Confident	84.2	Confident	33 Å²	33	54.4 Å²	54.4	17%	0.173	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-34.2	175.7	-76.8	172.9	0	0	0	112.7	M70 V132 D134 I139 S140 L149	M70-L136 HydrophobicContact CE-CD2 4.19Å; M70-L136 HydrophobicContact SD-CD2 4.45Å; V132-L136 HydrophobicContact CG1-CD1 4.09Å; V132-L136 HydrophobicContact CG1-CG 4.36Å; V132-L136 WeakPolarHBondContact O-CB 3.24Å; V132-L136 VanDerWaalsContact O-CG 3.25Å; V132-L136 WeakPolarHBondContact O-CG 3.46Å; V132-L136 PolarHBondContact O-N 2.73Å; D134-L136 PolarHBondContact O-N 3.45Å; L136-I139 HydrophobicContact CD2-CD1 4.12Å; L136-S140 PolarHBondContact O-N 2.87Å; L136-S140 VanDerWaalsContact O-N 3.16Å; L136-L149 HydrophobicContact CD2-CD2 3.57Å; L136-L149 HydrophobicContact CG-CD2 4.3Å
137	R	85.5	Confident	84.2	Confident	145 Å²	145	57.7 Å²	57.7	55%	0.547	30%	0.297	S	S	.	.	H	α-helix	trans	-70	-40.2	173.3	-73.9	165.2	174	167.7	-14.6	111.6	K133 D134 L135 S140	K133-R137 VanDerWaalsContact CE-NH2 3.34Å; K133-R137 VanDerWaalsContact O-CG 3.32Å; K133-R137 WeakPolarHBondContact O-CG 3.49Å; K133-R137 PolarHBondContact O-N 3.22Å; D134-R137 WeakPolarHBondContact O-CB 3.22Å; D134-R137 PolarHBondContact O-N 3.29Å; D134-R137 IonicContact OD1-NH1 2.74Å; D134-R137 PolarHBondContact OD1-NH1 2.86Å; L135-R137 VanDerWaalsContact C-N 3.29Å; L135-R137 PolarHBondContact O-N 2.7Å; R137-S140 WeakPolarHBondContact O-CB 3.24Å; R137-S140 PolarHBondContact O-N 2.79Å
138	F	85.4	Confident	84.2	Confident	32 Å²	32	59.1 Å²	59.1	14%	0.14	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-44.2	178.6	-179.5	-103.7	0	0	0	111.9	F123 D134 L135 S140 P141 Y179 T182 Y184 C192	F123-F138 HydrophobicContact CE1-CD1 4.41Å; F123-F138 HydrophobicContact CE1-CE1 4.11Å; F123-F138 HydrophobicContact CZ-CD1 4.47Å; F123-F138 HydrophobicContact CZ-CE1 4.38Å; D134-F138 WeakPolarHBondContact O-CB 3.4Å; D134-F138 PolarHBondContact O-N 3.34Å; L135-F138 WeakPolarHBondContact O-CB 3.36Å; L135-F138 PolarHBondContact O-N 3.38Å; F138-S140 VanDerWaalsContact C-N 3.31Å; F138-S140 PolarHBondContact O-N 3.3Å; F138-P141 WeakPolarHBondContact O-CD 3.46Å; F138-Y179 HydrophobicContact CD1-CD1 4.17Å; F138-Y179 HydrophobicContact CD1-CE1 4.3Å; F138-Y179 AromaticContact CE1-CD1 3.48Å; F138-Y179 HydrophobicContact CE1-CD1 3.48Å; F138-Y179 VanDerWaalsContact CE1-CD1 3.48Å; F138-Y179 HydrophobicContact CE1-CE1 4.05Å; F138-Y179 HydrophobicContact CE1-CG 4.33Å; F138-Y179 HydrophobicContact CE2-CD1 4.19Å; F138-Y179 HydrophobicContact CE2-CE1 4.43Å; F138-Y179 AromaticContact CZ-CD1 3.52Å; F138-Y179 HydrophobicContact CZ-CD1 3.52Å; F138-Y179 HydrophobicContact CZ-CE1 4.14Å; F138-Y179 VanDerWaalsContact O-CE1 3.32Å; F138-Y179 WeakPolarHBondContact O-CE1 3.48Å; F138-Y179 PolarHBondContact O-OH 2.92Å; F138-T182 WeakPolarHBondContact CZ-OG1 3.25Å; F138-Y184 HydrophobicContact CD1-CD1 4.09Å; F138-Y184 HydrophobicContact CD1-CE1 4.29Å; F138-Y184 HydrophobicContact CD2-CD1 4.34Å; F138-Y184 HydrophobicContact CE1-CD1 4.14Å; F138-Y184 HydrophobicContact CE1-CE1 4.18Å; F138-Y184 HydrophobicContact CE2-CD1 4.39Å; F138-Y184 HydrophobicContact CG-CD1 4.17Å; F138-Y184 HydrophobicContact CZ-CD1 4.26Å; F138-C192 HydrophobicContact CE1-CB 4.31Å; F138-C192 HydrophobicContact CZ-CB 4.11Å
139	I	85.2	Confident	84.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-3	177.8	73.1	-175	0	0	0	113.8	F123 L135 L136 P141 M142 R143 I146 L149 L164 F175	F123-I139 HydrophobicContact CE2-CG2 4.33Å; F123-I139 HydrophobicContact CZ-CG2 3.92Å; L135-I139 WeakPolarHBondContact O-CG1 3.49Å; L135-I139 PolarHBondContact O-N 2.85Å; L136-I139 HydrophobicContact CD2-CD1 4.12Å; I139-P141 VanDerWaalsContact C-N 3.33Å; I139-M142 PolarHBondContact O-N 3.13Å; I139-M142 VanDerWaalsContact O-N 3.14Å; I139-R143 PolarHBondContact O-N 2.95Å; I139-I146 HydrophobicContact CB-CD1 4.17Å; I139-I146 HydrophobicContact CD1-CD1 3.93Å; I139-I146 HydrophobicContact CG1-CD1 4.21Å; I139-L149 HydrophobicContact CD1-CD2 4.18Å; I139-L164 HydrophobicContact CD1-CD2 4.29Å; I139-L164 HydrophobicContact CG2-CD2 4.41Å; I139-F175 HydrophobicContact CB-CE2 4.25Å; I139-F175 HydrophobicContact CB-CZ 4.34Å; I139-F175 HydrophobicContact CG2-CE2 4.21Å; I139-F175 HydrophobicContact CG2-CZ 3.8Å
140	S	84	Confident	84.3	Confident	66 Å²	66	52 Å²	52	46%	0.462	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-53.2	-37.4	-174.2	-172.2	0	0	0	0	115	L136 R137 F138 M142 R143	L136-S140 PolarHBondContact O-N 2.87Å; L136-S140 VanDerWaalsContact O-N 3.16Å; R137-S140 WeakPolarHBondContact O-CB 3.24Å; R137-S140 PolarHBondContact O-N 2.79Å; F138-S140 VanDerWaalsContact C-N 3.31Å; F138-S140 PolarHBondContact O-N 3.3Å; S140-M142 VanDerWaalsContact C-N 3.26Å; S140-M142 PolarHBondContact O-N 3.46Å; S140-R143 WeakPolarHBondContact O-CB 3.39Å; S140-R143 PolarHBondContact O-N 3.19Å
141	P	85.1	Confident	84.3	Confident	101 Å²	101	51.9 Å²	51.9	66%	0.656	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-60.7	-29.1	179.1	-26.3	35.3	0	0	0	115.1	F138 I139 Y179	F138-P141 WeakPolarHBondContact O-CD 3.46Å; I139-P141 VanDerWaalsContact C-N 3.33Å; P141-Y179 WeakPolarHBondContact CD-OH 3.33Å; P141-Y179 WeakPolarHBondContact CG-OH 3.06Å
142	M	83.1	Confident	84.3	Confident	31 Å²	31	48.7 Å²	48.7	15%	0.153	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-114.3	25	179.9	-66.8	-169.8	-176.4	0	0	112.4	I139 S140 D144 V145 H174 F175 T178 Y179	I139-M142 PolarHBondContact O-N 3.13Å; I139-M142 VanDerWaalsContact O-N 3.14Å; S140-M142 VanDerWaalsContact C-N 3.26Å; S140-M142 PolarHBondContact O-N 3.46Å; M142-D144 VanDerWaalsContact C-N 3.34Å; M142-D144 PolarHBondContact O-N 3.49Å; M142-V145 WeakPolarHBondContact O-CB 3.23Å; M142-V145 PolarHBondContact O-N 2.61Å; M142-H174 WeakPolarHBondContact CE-CD2 3.35Å; M142-H174 VanDerWaalsContact CE-NE2 3.31Å; M142-H174 WeakPolarHBondContact CE-NE2 3.45Å; M142-F175 HydrophobicContact CB-CD2 4.05Å; M142-F175 HydrophobicContact CB-CE2 4.46Å; M142-F175 HydrophobicContact CG-CD2 4.45Å; M142-F175 HydrophobicContact SD-CB 4.07Å; M142-F175 HydrophobicContact SD-CD2 3.77Å; M142-F175 HydrophobicContact SD-CG 4.38Å; M142-T178 HydrophobicContact CE-CG2 4.28Å; M142-Y179 HydrophobicContact CE-CE2 4.4Å; M142-Y179 HydrophobicContact CG-CE2 4.28Å; M142-Y179 HydrophobicContact SD-CE2 4.02Å
143	R	81.1	Confident	84.2	Confident	109 Å²	109	51 Å²	51	41%	0.411	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-61.3	-39.4	-174.2	-164.1	-176.8	-159.9	-169.2	5	113.7	M70 I139 S140 V145 I146	M70-R143 VanDerWaalsContact CE-NE 3.32Å; M70-R143 HydrophobicContact SD-CG 3.46Å; M70-R143 WeakPolarHBondContact SD-CG 3.48Å; M70-R143 PolarHBondContact SD-NE 2.81Å; I139-R143 PolarHBondContact O-N 2.95Å; S140-R143 WeakPolarHBondContact O-CB 3.39Å; S140-R143 PolarHBondContact O-N 3.19Å; R143-V145 PolarHBondContact O-N 3.43Å; R143-I146 PolarHBondContact O-N 3.15Å; R143-I146 VanDerWaalsContact O-N 3.14Å
144	D	84.4	Confident	83.9	Confident	139 Å²	139	46.1 Å²	46.1	74%	0.743	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-64.3	-15.3	-175.3	-60	-30.6	0	0	0	113.4	M142	M142-D144 VanDerWaalsContact C-N 3.34Å; M142-D144 PolarHBondContact O-N 3.49Å
145	V	85.7	Confident	83.1	Confident	35 Å²	35	47 Å²	47	21%	0.212	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-97.5	-18.5	-174.6	-166.2	0	0	0	0	112	M142 R143 F166 R167 D171	M142-V145 WeakPolarHBondContact O-CB 3.23Å; M142-V145 PolarHBondContact O-N 2.61Å; R143-V145 PolarHBondContact O-N 3.43Å; V145-F166 HydrophobicContact CG1-CD1 4.35Å; V145-R167 PolarHBondContact O-N 3.09Å; V145-R167 VanDerWaalsContact O-N 3.12Å; V145-D171 HydrophobicContact CG1-CB 3.19Å; V145-D171 WeakPolarHBondContact CG1-OD2 3.28Å
146	I	84.3	Confident	82.4	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	127.6	179.1	-59	165.2	0	0	0	107.8	M70 I139 R143 L164 F166	M70-I146 VanDerWaalsContact CB-O 3.32Å; M70-I146 WeakPolarHBondContact CB-O 3.43Å; M70-I146 HydrophobicContact CG-CB 4.32Å; M70-I146 HydrophobicContact CG-CG2 4.06Å; I139-I146 HydrophobicContact CB-CD1 4.17Å; I139-I146 HydrophobicContact CD1-CD1 3.93Å; I139-I146 HydrophobicContact CG1-CD1 4.21Å; R143-I146 PolarHBondContact O-N 3.15Å; R143-I146 VanDerWaalsContact O-N 3.14Å; I146-L164 HydrophobicContact CD1-CD2 3.7Å; I146-L164 HydrophobicContact CG1-CD2 4.25Å; I146-L164 HydrophobicContact CG2-CD2 4.47Å; I146-L164 HydrophobicContact CG2-CG 4.48Å; I146-F166 HydrophobicContact CD1-CE1 4.46Å; I146-F166 HydrophobicContact CG1-CD1 4.09Å; I146-F166 HydrophobicContact CG1-CE1 3.67Å; I146-F166 HydrophobicContact CG1-CZ 4.21Å
147	E	84.3	Confident	81.7	Confident	68 Å²	68	49.1 Å²	49.1	32%	0.318	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-47.7	175.6	-170.8	-173	158.1	0	0	110.2	M70 K165 R167	M70-E147 PolarHBondContact N-O 3.36Å; M70-E147 VanDerWaalsContact N-O 3.16Å; E147-K165 PolarHBondContact N-O 2.73Å; E147-K165 IonicContact OE1-NZ 2.77Å; E147-K165 PolarHBondContact OE1-NZ 3.32Å; E147-K165 WeakPolarHBondContact OE2-CD 3.37Å; E147-K165 WeakPolarHBondContact OE2-CE 3.43Å; E147-K165 IonicContact OE2-NZ 3.75Å; E147-K165 PolarHBondContact OE2-NZ 3.13Å; E147-R167 HydrophobicContact CB-CG 4.36Å
148	E	83.3	Confident	81.1	Confident	42 Å²	42	47.6 Å²	47.6	20%	0.196	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	137.6	-171.3	-160.9	-179	-154.4	0	0	111.1	T67 K150 L164 K165	T67-E148 HydrophobicContact CG2-CG 3.96Å; T67-E148 WeakPolarHBondContact CG2-OE1 3.35Å; E148-K150 HydrophobicContact CG-CG 4.3Å; E148-K150 WeakPolarHBondContact OE1-CE 3.27Å; E148-K150 IonicContact OE1-NZ 3.9Å; E148-K150 PolarHBondContact OE1-NZ 3.5Å; E148-K150 WeakPolarHBondContact OE2-CE 3.36Å; E148-K150 IonicContact OE2-NZ 3.61Å; E148-K150 PolarHBondContact OE2-NZ 3.11Å; E148-L164 WeakPolarHBondContact O-CA 3.43Å; E148-K165 HydrophobicContact CB-CB 4.12Å; E148-K165 PolarHBondContact N-O 3.02Å; E148-K165 PolarHBondContact O-N 3.15Å
149	L	84.6	Confident	81	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122	171.6	168.5	68.8	0	0	0	108.8	Y68 L136 I139 I151 A162 L163 L164	Y68-L149 HydrophobicContact CD2-CD2 4.4Å; Y68-L149 PolarHBondContact N-O 3.33Å; Y68-L149 PolarHBondContact O-N 3.04Å; L136-L149 HydrophobicContact CD2-CD2 3.57Å; L136-L149 HydrophobicContact CG-CD2 4.3Å; I139-L149 HydrophobicContact CD1-CD2 4.18Å; L149-I151 HydrophobicContact CG-CG1 4.35Å; L149-A162 HydrophobicContact CD1-CB 4.12Å; L149-L163 CarbonylContact C-O 3.6Å; L149-L163 WeakPolarHBondContact CA-O 3.26Å; L149-L164 HydrophobicContact CD1-CD1 3.41Å; L149-L164 VanDerWaalsContact CD1-CD1 3.41Å; L149-L164 HydrophobicContact CD1-CG 3.82Å
150	K	82.8	Confident	81	Confident	17 Å²	17	48.2 Å²	48.2	7%	0.074	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.8	176.6	-70.5	-172.1	167.7	128.4	0	111.1	S23 L24 V65 E66 T67 E148 A162 L163	S23-K150 WeakPolarHBondContact O-CE 3.48Å; S23-K150 PolarHBondContact O-NZ 3.1Å; L24-K150 HydrophobicContact CD1-CB 4.47Å; L24-K150 HydrophobicContact CD1-CD 3.41Å; L24-K150 VanDerWaalsContact CD1-CD 3.41Å; V65-K150 HydrophobicContact CG1-CB 4.39Å; V65-K150 HydrophobicContact CG1-CD 4.48Å; E66-K150 CarbonylContact O-C 3.53Å; E66-K150 WeakPolarHBondContact O-CA 3.42Å; T67-K150 HydrophobicContact CG2-CG 4.08Å; T67-K150 WeakPolarHBondContact OG1-CE 3.49Å; E148-K150 HydrophobicContact CG-CG 4.3Å; E148-K150 WeakPolarHBondContact OE1-CE 3.27Å; E148-K150 IonicContact OE1-NZ 3.9Å; E148-K150 PolarHBondContact OE1-NZ 3.5Å; E148-K150 WeakPolarHBondContact OE2-CE 3.36Å; E148-K150 IonicContact OE2-NZ 3.61Å; E148-K150 PolarHBondContact OE2-NZ 3.11Å; K150-A162 CarbonylContact O-C 3.55Å; K150-A162 WeakPolarHBondContact O-CA 3.31Å; K150-L163 HydrophobicContact CB-CB 4.31Å; K150-L163 PolarHBondContact N-O 3.14Å; K150-L163 PolarHBondContact O-N 3.5Å
151	I	84.7	Confident	81.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.9	179.5	-57.3	-172.9	0	0	0	107.9	V65 E66 Y68 V132 L149 K153 Y160 A162	V65-I151 CarbonylContact C-O 3.56Å; V65-I151 VanDerWaalsContact CA-O 3.28Å; V65-I151 WeakPolarHBondContact CA-O 3.41Å; E66-I151 HydrophobicContact CB-CB 4.24Å; E66-I151 PolarHBondContact N-O 3.14Å; E66-I151 PolarHBondContact O-N 3.37Å; Y68-I151 HydrophobicContact CD2-CD1 4.35Å; Y68-I151 HydrophobicContact CE2-CD1 3.86Å; Y68-I151 HydrophobicContact CE2-CG1 4.31Å; V132-I151 HydrophobicContact CB-CD1 3.84Å; V132-I151 HydrophobicContact CG1-CD1 3.32Å; V132-I151 HydrophobicContact CG2-CD1 3.37Å; L149-I151 HydrophobicContact CG-CG1 4.35Å; I151-K153 HydrophobicContact CG2-CG 4.39Å; I151-Y160 HydrophobicContact CG2-CD2 3.54Å; I151-Y160 HydrophobicContact CG2-CE2 3.77Å; I151-Y160 HydrophobicContact CG2-CG 4.39Å; I151-A162 HydrophobicContact CG1-CB 4.5Å
152	V	82.9	Confident	81.1	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.012	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.9	-177.7	-178.3	0	0	0	0	108.3	F13 I63 V65 I100 M161 L163	F13-V152 HydrophobicContact CE1-CG1 3.75Å; F13-V152 HydrophobicContact CZ-CG1 3.91Å; F13-V152 HydrophobicContact CZ-CG2 4.21Å; I63-V152 HydrophobicContact CG2-CG1 4.39Å; V65-V152 HydrophobicContact CG2-CG2 4.37Å; I100-V152 HydrophobicContact CD1-CG1 3.66Å; V152-M161 HydrophobicContact CB-CB 4.27Å; V152-M161 HydrophobicContact CB-CE 4.39Å; V152-M161 HydrophobicContact CG1-CE 3.9Å; V152-M161 PolarHBondContact N-O 2.9Å; V152-M161 PolarHBondContact O-N 3.48Å; V152-L163 HydrophobicContact CG2-CD1 4.14Å
153	K	81.1	Confident	81.3	Confident	73 Å²	73	39.7 Å²	39.7	32%	0.317	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.3	174.1	-65.2	171.4	-176.2	163.1	0	108.5	I63 T64 E66 I151	I63-K153 WeakPolarHBondContact CA-O 3.27Å; T64-K153 PolarHBondContact N-O 3.46Å; T64-K153 PolarHBondContact O-N 2.77Å; E66-K153 IonicContact OE1-NZ 2.65Å; E66-K153 PolarHBondContact OE1-NZ 2.9Å; E66-K153 IonicContact OE2-NZ 2.86Å; I151-K153 HydrophobicContact CG2-CG 4.39Å
154	D	77.7	Confident	81.6	Confident	26 Å²	26	34.5 Å²	34.5	14%	0.139	19%	0.185	C	C	.	.			trans	-110.4	-173.9	177.9	-164.7	4.6	0	0	0	109.8	I100 T156 R228	I100-D154 HydrophobicContact CD1-CB 3.88Å; D154-T156 PolarHBondContact O-N 2.78Å; D154-R228 IonicContact OD2-NH2 2.7Å
155	S	69.9	Low	81.7	Confident	65 Å²	65	31 Å²	31	46%	0.455	16%	0.163	S	C	.	.	S	Bend	trans	-70	-6.2	171.2	58.2	0	0	0	0	114.6	N61 P157	N61-S155 WeakPolarHBondContact ND2-CB 3.49Å; N61-S155 PolarHBondContact ND2-OG 3.33Å; S155-P157 WeakPolarHBondContact O-CD 3.39Å
156	T	71	Confident	81.8	Confident	27 Å²	27	29.4 Å²	29.4	17%	0.166	15%	0.153	C	C	.	.			trans	-61.8	119.2	177.9	49.3	0	0	0	0	109.5	D154 Q159	D154-T156 PolarHBondContact O-N 2.78Å; T156-Q159 PolarHBondContact OG1-O 3.49Å
157	P	70	Confident	81.8	Confident	53 Å²	53	36.1 Å²	36.1	34%	0.344	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	148.3	-179.2	28.2	-33.8	0	0	0	110.5	S155 Q159 L226	S155-P157 WeakPolarHBondContact O-CD 3.39Å; P157-Q159 PolarHBondContact O-N 3.13Å; P157-L226 HydrophobicContact CG-CB 4.17Å
158	N	73.4	Confident	81.8	Confident	112 Å²	112	35.7 Å²	35.7	60%	0.599	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	5.8	171.6	-56.5	-27	0	0	0	117.4	P127 S128	P127-N158 CarbonylContact C-O 3.59Å; S128-N158 WeakPolarHBondContact CB-O 3.47Å; S128-N158 PolarHBondContact N-O 2.82Å; S128-N158 WeakPolarHBondContact OG-CA 3.27Å; S128-N158 PolarHBondContact OG-O 2.88Å
159	Q	82	Confident	81.7	Confident	33 Å²	33	34.7 Å²	34.7	15%	0.154	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	150.1	179.4	-61.9	-173.7	-0.1	0	0	111.7	S125 V126 T156 P157 E227	S125-Q159 VanDerWaalsContact CB-OE1 3.24Å; S125-Q159 PolarHBondContact OG-OE1 2.73Å; V126-Q159 CarbonylContact O-C 3.57Å; V126-Q159 VanDerWaalsContact O-CA 3.26Å; V126-Q159 WeakPolarHBondContact O-CA 3.49Å; T156-Q159 PolarHBondContact OG1-O 3.49Å; P157-Q159 PolarHBondContact O-N 3.13Å; Q159-E227 PolarHBondContact NE2-OE1 3.28Å; Q159-E227 PolarHBondContact NE2-OE2 3.16Å
160	Y	85	Confident	81.6	Confident	13 Å²	13	41.1 Å²	41.1	5%	0.051	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	160.1	170.9	69.9	-90.8	0	0	0	110.6	V126 V130 L135 I151 A162	V126-Y160 HydrophobicContact CB-CD1 4.15Å; V126-Y160 HydrophobicContact CB-CD2 4.11Å; V126-Y160 HydrophobicContact CB-CE1 3.82Å; V126-Y160 HydrophobicContact CB-CE2 3.78Å; V126-Y160 HydrophobicContact CB-CG 4.3Å; V126-Y160 WeakPolarHBondContact CB-O 3.33Å; V126-Y160 HydrophobicContact CG1-CD1 4.42Å; V126-Y160 HydrophobicContact CG1-CE1 3.62Å; V126-Y160 HydrophobicContact CG1-CE2 3.97Å; V126-Y160 WeakPolarHBondContact CG1-OH 3.38Å; V126-Y160 HydrophobicContact CG2-CD2 4.47Å; V126-Y160 HydrophobicContact CG2-CE2 4.08Å; V126-Y160 PolarHBondContact N-O 3.48Å; V126-Y160 WeakPolarHBondContact O-CD1 3.4Å; V126-Y160 PolarHBondContact O-N 2.87Å; V130-Y160 WeakPolarHBondContact O-CE1 3.24Å; V130-Y160 PolarHBondContact O-OH 3.38Å; V130-Y160 VanDerWaalsContact O-OH 3.1Å; L135-Y160 HydrophobicContact CD2-CE2 4.19Å; I151-Y160 HydrophobicContact CG2-CD2 3.54Å; I151-Y160 HydrophobicContact CG2-CE2 3.77Å; I151-Y160 HydrophobicContact CG2-CG 4.39Å; Y160-A162 HydrophobicContact CE2-CB 4.44Å
161	M	85.6	Confident	81.7	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.039	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	149.7	177.3	-63.9	178.9	-65.6	0	0	110.1	I100 I102 F123 F124 V152	I100-M161 HydrophobicContact CD1-CE 3.94Å; I100-M161 HydrophobicContact CG2-CE 4.2Å; I102-M161 HydrophobicContact CD1-CE 4.28Å; I102-M161 HydrophobicContact CD1-SD 3.45Å; I102-M161 WeakPolarHBondContact CD1-SD 3.34Å; F123-M161 WeakPolarHBondContact O-CA 3.26Å; F124-M161 WeakPolarHBondContact O-CG 3.41Å; V152-M161 HydrophobicContact CB-CB 4.27Å; V152-M161 HydrophobicContact CB-CE 4.39Å; V152-M161 HydrophobicContact CG1-CE 3.9Å; V152-M161 PolarHBondContact N-O 2.9Å; V152-M161 PolarHBondContact O-N 3.48Å
162	A	86.3	Confident	81.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	127.4	171.9	0	0	0	0	0	111	C122 F123 L135 L149 K150 I151 Y160 L164	C122-A162 CarbonylContact C-O 3.38Å; C122-A162 WeakPolarHBondContact CA-O 3.48Å; F123-A162 HydrophobicContact CB-CB 4.06Å; F123-A162 HydrophobicContact CD2-CB 4.12Å; F123-A162 HydrophobicContact CG-CB 4.41Å; F123-A162 PolarHBondContact N-O 3.4Å; F123-A162 PolarHBondContact O-N 2.86Å; F123-A162 VanDerWaalsContact O-N 3.08Å; L135-A162 HydrophobicContact CD2-CB 3.89Å; L149-A162 HydrophobicContact CD1-CB 4.12Å; K150-A162 CarbonylContact O-C 3.55Å; K150-A162 WeakPolarHBondContact O-CA 3.31Å; I151-A162 HydrophobicContact CG1-CB 4.5Å; Y160-A162 HydrophobicContact CE2-CB 4.44Å; A162-L164 HydrophobicContact CB-CD1 4.47Å
163	L	87.2	Confident	81.7	Confident	11 Å²	11	43.4 Å²	43.4	6%	0.058	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.6	178.7	-60.9	171	0	0	0	109.3	I11 L24 L121 C122 L149 K150 V152 V197 V200	I11-L163 HydrophobicContact CD1-CD2 3.72Å; L24-L163 HydrophobicContact CD1-CD1 3.89Å; L121-L163 CarbonylContact O-C 3.59Å; L121-L163 WeakPolarHBondContact O-CA 3.35Å; C122-L163 HydrophobicContact CB-CD2 3.65Å; C122-L163 VanDerWaalsContact SG-CD2 3.59Å; L149-L163 CarbonylContact C-O 3.6Å; L149-L163 WeakPolarHBondContact CA-O 3.26Å; K150-L163 HydrophobicContact CB-CB 4.31Å; K150-L163 PolarHBondContact N-O 3.14Å; K150-L163 PolarHBondContact O-N 3.5Å; V152-L163 HydrophobicContact CG2-CD1 4.14Å; L163-V197 HydrophobicContact CD2-CG2 4.01Å; L163-V200 HydrophobicContact CD1-CG2 4.37Å
164	L	87.7	Confident	81.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.8	176.7	-79	73.6	0	0	0	109	V120 L121 F123 I139 I146 E148 L149 A162 F166 F175	V120-L164 VanDerWaalsContact CA-O 3.24Å; V120-L164 WeakPolarHBondContact CA-O 3.3Å; L121-L164 PolarHBondContact N-O 2.96Å; L121-L164 PolarHBondContact O-N 2.98Å; F123-L164 HydrophobicContact CD2-CD1 3.36Å; F123-L164 HydrophobicContact CE2-CD1 3.3Å; F123-L164 HydrophobicContact CE2-CD2 3.89Å; F123-L164 HydrophobicContact CE2-CG 4.24Å; I139-L164 HydrophobicContact CD1-CD2 4.29Å; I139-L164 HydrophobicContact CG2-CD2 4.41Å; I146-L164 HydrophobicContact CD1-CD2 3.7Å; I146-L164 HydrophobicContact CG1-CD2 4.25Å; I146-L164 HydrophobicContact CG2-CD2 4.47Å; I146-L164 HydrophobicContact CG2-CG 4.48Å; E148-L164 WeakPolarHBondContact O-CA 3.43Å; L149-L164 HydrophobicContact CD1-CD1 3.41Å; L149-L164 VanDerWaalsContact CD1-CD1 3.41Å; L149-L164 HydrophobicContact CD1-CG 3.82Å; A162-L164 HydrophobicContact CB-CD1 4.47Å; L164-F166 HydrophobicContact CB-CD2 4.38Å; L164-F166 HydrophobicContact CB-CE2 3.66Å; L164-F166 HydrophobicContact CB-CZ 4.12Å; L164-F166 HydrophobicContact CD2-CE2 4.38Å; L164-F166 HydrophobicContact CD2-CZ 4Å; L164-F175 HydrophobicContact CD2-CE1 4.43Å; L164-F175 HydrophobicContact CD2-CZ 4.12Å
165	K	86.7	Confident	82.3	Confident	64 Å²	64	44 Å²	44	28%	0.278	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.4	170.7	-171.6	-172.7	177.7	-154.9	0	109.1	V120 E147 E148	V120-K165 HydrophobicContact CG2-CB 4.14Å; V120-K165 HydrophobicContact CG2-CG 4.04Å; E147-K165 PolarHBondContact N-O 2.73Å; E147-K165 IonicContact OE1-NZ 2.77Å; E147-K165 PolarHBondContact OE1-NZ 3.32Å; E147-K165 WeakPolarHBondContact OE2-CD 3.37Å; E147-K165 WeakPolarHBondContact OE2-CE 3.43Å; E147-K165 IonicContact OE2-NZ 3.75Å; E147-K165 PolarHBondContact OE2-NZ 3.13Å; E148-K165 HydrophobicContact CB-CB 4.12Å; E148-K165 PolarHBondContact N-O 3.02Å; E148-K165 PolarHBondContact O-N 3.15Å
166	F	86.4	Confident	83	Confident	3 Å²	3	42.4 Å²	42.4	1%	0.013	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	154.4	178	-67	-94.6	0	0	0	111	T119 L121 V145 I146 L164 D171 T172 F175	T119-F166 PolarHBondContact O-N 3.1Å; L121-F166 HydrophobicContact CB-CE2 4.1Å; L121-F166 HydrophobicContact CD1-CE2 3.72Å; L121-F166 HydrophobicContact CD1-CZ 4.11Å; L121-F166 HydrophobicContact CG-CE2 3.97Å; V145-F166 HydrophobicContact CG1-CD1 4.35Å; I146-F166 HydrophobicContact CD1-CE1 4.46Å; I146-F166 HydrophobicContact CG1-CD1 4.09Å; I146-F166 HydrophobicContact CG1-CE1 3.67Å; I146-F166 HydrophobicContact CG1-CZ 4.21Å; L164-F166 HydrophobicContact CB-CD2 4.38Å; L164-F166 HydrophobicContact CB-CE2 3.66Å; L164-F166 HydrophobicContact CB-CZ 4.12Å; L164-F166 HydrophobicContact CD2-CE2 4.38Å; L164-F166 HydrophobicContact CD2-CZ 4Å; F166-D171 HydrophobicContact CD1-CB 4.47Å; F166-T172 VanDerWaalsContact CB-OG1 3.28Å; F166-T172 WeakPolarHBondContact CB-OG1 3.39Å; F166-T172 HydrophobicContact CD2-CG2 3.92Å; F166-T172 HydrophobicContact CE2-CG2 4.34Å; F166-T172 HydrophobicContact CG-CG2 4.49Å; F166-F175 HydrophobicContact CE1-CB 3.75Å; F166-F175 HydrophobicContact CE1-CD1 4.39Å; F166-F175 AromaticContact CE1-CD2 3.82Å; F166-F175 HydrophobicContact CE1-CD2 3.82Å; F166-F175 AromaticContact CE1-CG 3.73Å; F166-F175 HydrophobicContact CE1-CG 3.73Å; F166-F175 HydrophobicContact CE2-CD1 4.5Å; F166-F175 HydrophobicContact CZ-CB 3.78Å; F166-F175 AromaticContact CZ-CD1 3.67Å; F166-F175 HydrophobicContact CZ-CD1 3.67Å; F166-F175 AromaticContact CZ-CD2 3.83Å; F166-F175 HydrophobicContact CZ-CD2 3.83Å; F166-F175 HydrophobicContact CZ-CE1 4.18Å; F166-F175 HydrophobicContact CZ-CE2 4.34Å; F166-F175 AromaticContact CZ-CG 3.47Å; F166-F175 HydrophobicContact CZ-CG 3.47Å; F166-F175 VanDerWaalsContact CZ-CG 3.47Å; F166-F175 HydrophobicContact CZ-CZ 4.49Å
167	R	86.1	Confident	83.6	Confident	141 Å²	141	45.5 Å²	45.5	53%	0.532	23%	0.226	S	C	.	.	S	Bend	trans	-68.3	-39.2	178.2	-68	177.6	175.6	-156.2	-5.2	112.5	D71 V145 E147	D71-R167 IonicContact OD1-NH2 3.71Å; D71-R167 PolarHBondContact OD1-NH2 2.9Å; V145-R167 PolarHBondContact O-N 3.09Å; V145-R167 VanDerWaalsContact O-N 3.12Å; E147-R167 HydrophobicContact CB-CG 4.36Å
168	T	84.2	Confident	84.3	Confident	59 Å²	59	46 Å²	46	36%	0.362	23%	0.228	S	C	.	.			trans	-129.6	157.5	178.2	82.1	0	0	0	0	112.4	D171 T172	T168-D171 WeakPolarHBondContact CB-OD2 3.33Å; T168-D171 WeakPolarHBondContact OG1-CB 3.31Å; T168-D171 PolarHBondContact OG1-N 2.85Å; T168-D171 PolarHBondContact OG1-OD2 2.71Å; T168-T172 PolarHBondContact O-N 2.88Å; T168-T172 PolarHBondContact O-OG1 2.97Å
169	A	81.2	Confident	84.9	Confident	22 Å²	22	41.7 Å²	41.7	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-70.2	-33.2	177	0	0	0	0	0	112.3	I115 T119 T172 V173	I115-A169 HydrophobicContact CG2-CB 4.19Å; T119-A169 HydrophobicContact CG2-CB 4.22Å; A169-T172 VanDerWaalsContact O-CB 3.29Å; A169-T172 WeakPolarHBondContact O-CB 3.3Å; A169-T172 PolarHBondContact O-N 3.01Å; A169-V173 WeakPolarHBondContact O-CG2 3.43Å; A169-V173 PolarHBondContact O-N 3.5Å; A169-V173 VanDerWaalsContact O-N 3.09Å
170	E	82.7	Confident	85	Confident	135 Å²	135	43 Å²	43	63%	0.631	21%	0.212	S	C	*	.	H	α-helix	trans	-63.1	-44.8	177.8	-64	176.7	-172.5	0	0	111	T172 V173 H174	E170-T172 VanDerWaalsContact C-N 3.27Å; E170-T172 PolarHBondContact O-N 3Å; E170-V173 PolarHBondContact O-N 2.72Å; E170-H174 PolarHBondContact O-N 3.36Å
171	D	84.9	Confident	84.8	Confident	51 Å²	51	44.9 Å²	44.9	27%	0.273	24%	0.235	S	C	.	.	H	α-helix	trans	-60.3	-38.2	174.4	-68.5	-36.9	0	0	0	112.8	V145 F166 T168 V173 H174 F175	V145-D171 HydrophobicContact CG1-CB 3.19Å; V145-D171 WeakPolarHBondContact CG1-OD2 3.28Å; F166-D171 HydrophobicContact CD1-CB 4.47Å; T168-D171 WeakPolarHBondContact CB-OD2 3.33Å; T168-D171 WeakPolarHBondContact OG1-CB 3.31Å; T168-D171 PolarHBondContact OG1-N 2.85Å; T168-D171 PolarHBondContact OG1-OD2 2.71Å; D171-V173 VanDerWaalsContact C-N 3.34Å; D171-H174 PolarHBondContact O-N 3.06Å; D171-F175 WeakPolarHBondContact O-CB 3.36Å; D171-F175 PolarHBondContact O-N 3.02Å
172	T	83.8	Confident	84.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.6	-44.7	177.8	-50.8	0	0	0	0	110.5	T119 L121 F166 T168 A169 E170 F175 Y176 Y196	T119-T172 WeakPolarHBondContact CA-OG1 3.28Å; L121-T172 HydrophobicContact CD1-CG2 3.81Å; L121-T172 HydrophobicContact CD2-CG2 3.9Å; L121-T172 HydrophobicContact CG-CG2 3.51Å; F166-T172 VanDerWaalsContact CB-OG1 3.28Å; F166-T172 WeakPolarHBondContact CB-OG1 3.39Å; F166-T172 HydrophobicContact CD2-CG2 3.92Å; F166-T172 HydrophobicContact CE2-CG2 4.34Å; F166-T172 HydrophobicContact CG-CG2 4.49Å; T168-T172 PolarHBondContact O-N 2.88Å; T168-T172 PolarHBondContact O-OG1 2.97Å; A169-T172 VanDerWaalsContact O-CB 3.29Å; A169-T172 WeakPolarHBondContact O-CB 3.3Å; A169-T172 PolarHBondContact O-N 3.01Å; E170-T172 VanDerWaalsContact C-N 3.27Å; E170-T172 PolarHBondContact O-N 3Å; T172-F175 PolarHBondContact O-N 3.41Å; T172-Y176 WeakPolarHBondContact O-CB 3.48Å; T172-Y176 PolarHBondContact O-N 2.85Å; T172-Y196 HydrophobicContact CG2-CD1 4.37Å; T172-Y196 HydrophobicContact CG2-CE1 3.92Å
173	V	83.6	Confident	84.5	Confident	16 Å²	16	49.3 Å²	49.3	10%	0.097	26%	0.264	C	S	.	.	H	α-helix	trans	-63.5	-46.4	176.8	173.1	0	0	0	0	110.7	V116 A169 E170 D171 F175 Y176 D177	V116-V173 HydrophobicContact CB-CG2 3.97Å; V116-V173 HydrophobicContact CG2-CG2 4.01Å; A169-V173 WeakPolarHBondContact O-CG2 3.43Å; A169-V173 PolarHBondContact O-N 3.5Å; A169-V173 VanDerWaalsContact O-N 3.09Å; E170-V173 PolarHBondContact O-N 2.72Å; D171-V173 VanDerWaalsContact C-N 3.34Å; V173-F175 VanDerWaalsContact C-N 3.32Å; V173-F175 PolarHBondContact O-N 3.2Å; V173-Y176 PolarHBondContact O-N 3.34Å; V173-D177 PolarHBondContact O-N 3.3Å
174	H	84.9	Confident	84.1	Confident	110 Å²	110	49.6 Å²	49.6	51%	0.509	27%	0.265	S	S	.	.	H	α-helix	trans	-61.5	-41.2	179.6	-171.6	44.5	0	0	0	112.4	M142 E170 D171 T178	M142-H174 WeakPolarHBondContact CE-CD2 3.35Å; M142-H174 VanDerWaalsContact CE-NE2 3.31Å; M142-H174 WeakPolarHBondContact CE-NE2 3.45Å; E170-H174 PolarHBondContact O-N 3.36Å; D171-H174 PolarHBondContact O-N 3.06Å; H174-T178 WeakPolarHBondContact O-CB 3.49Å; H174-T178 PolarHBondContact O-N 2.65Å; H174-T178 VanDerWaalsContact O-N 3.12Å; H174-T178 PolarHBondContact O-OG1 2.9Å
175	F	85.7	Confident	83.6	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.3	-46.2	174.8	-173.3	-85.4	0	0	0	111.5	L121 F123 I139 M142 L164 F166 D171 T172 V173 D177 T178 Y179 L194	L121-F175 HydrophobicContact CD1-CB 4.42Å; L121-F175 HydrophobicContact CD1-CD1 3.64Å; L121-F175 HydrophobicContact CD1-CE1 4.43Å; L121-F175 HydrophobicContact CD1-CG 4.44Å; F123-F175 HydrophobicContact CE2-CE1 4.36Å; F123-F175 HydrophobicContact CE2-CZ 4.42Å; F123-F175 HydrophobicContact CZ-CE1 4.16Å; F123-F175 HydrophobicContact CZ-CZ 4.09Å; I139-F175 HydrophobicContact CB-CE2 4.25Å; I139-F175 HydrophobicContact CB-CZ 4.34Å; I139-F175 HydrophobicContact CG2-CE2 4.21Å; I139-F175 HydrophobicContact CG2-CZ 3.8Å; M142-F175 HydrophobicContact CB-CD2 4.05Å; M142-F175 HydrophobicContact CB-CE2 4.46Å; M142-F175 HydrophobicContact CG-CD2 4.45Å; M142-F175 HydrophobicContact SD-CB 4.07Å; M142-F175 HydrophobicContact SD-CD2 3.77Å; M142-F175 HydrophobicContact SD-CG 4.38Å; L164-F175 HydrophobicContact CD2-CE1 4.43Å; L164-F175 HydrophobicContact CD2-CZ 4.12Å; F166-F175 HydrophobicContact CE1-CB 3.75Å; F166-F175 HydrophobicContact CE1-CD1 4.39Å; F166-F175 AromaticContact CE1-CD2 3.82Å; F166-F175 HydrophobicContact CE1-CD2 3.82Å; F166-F175 AromaticContact CE1-CG 3.73Å; F166-F175 HydrophobicContact CE1-CG 3.73Å; F166-F175 HydrophobicContact CE2-CD1 4.5Å; F166-F175 HydrophobicContact CZ-CB 3.78Å; F166-F175 AromaticContact CZ-CD1 3.67Å; F166-F175 HydrophobicContact CZ-CD1 3.67Å; F166-F175 AromaticContact CZ-CD2 3.83Å; F166-F175 HydrophobicContact CZ-CD2 3.83Å; F166-F175 HydrophobicContact CZ-CE1 4.18Å; F166-F175 HydrophobicContact CZ-CE2 4.34Å; F166-F175 AromaticContact CZ-CG 3.47Å; F166-F175 HydrophobicContact CZ-CG 3.47Å; F166-F175 VanDerWaalsContact CZ-CG 3.47Å; F166-F175 HydrophobicContact CZ-CZ 4.49Å; D171-F175 WeakPolarHBondContact O-CB 3.36Å; D171-F175 PolarHBondContact O-N 3.02Å; T172-F175 PolarHBondContact O-N 3.41Å; V173-F175 VanDerWaalsContact C-N 3.32Å; V173-F175 PolarHBondContact O-N 3.2Å; F175-D177 PolarHBondContact O-N 2.86Å; F175-T178 PolarHBondContact O-N 2.92Å; F175-Y179 HydrophobicContact CD1-CD2 4.07Å; F175-Y179 AromaticContact CD2-CD2 3.48Å; F175-Y179 HydrophobicContact CD2-CD2 3.48Å; F175-Y179 VanDerWaalsContact CD2-CD2 3.48Å; F175-Y179 AromaticContact CD2-CE2 3.58Å; F175-Y179 HydrophobicContact CD2-CE2 3.58Å; F175-Y179 HydrophobicContact CE1-CD2 4.02Å; F175-Y179 HydrophobicContact CE1-CG 4.22Å; F175-Y179 AromaticContact CE2-CD2 3.41Å; F175-Y179 HydrophobicContact CE2-CD2 3.41Å; F175-Y179 VanDerWaalsContact CE2-CD2 3.41Å; F175-Y179 AromaticContact CE2-CE2 3.44Å; F175-Y179 HydrophobicContact CE2-CE2 3.44Å; F175-Y179 VanDerWaalsContact CE2-CE2 3.44Å; F175-Y179 HydrophobicContact CE2-CG 4.14Å; F175-Y179 AromaticContact CG-CD2 3.82Å; F175-Y179 HydrophobicContact CG-CD2 3.82Å; F175-Y179 HydrophobicContact CG-CE2 4.36Å; F175-Y179 AromaticContact CZ-CD2 3.7Å; F175-Y179 HydrophobicContact CZ-CD2 3.7Å; F175-Y179 HydrophobicContact CZ-CE2 4.11Å; F175-Y179 AromaticContact CZ-CG 3.98Å; F175-Y179 HydrophobicContact CZ-CG 3.98Å; F175-Y179 WeakPolarHBondContact O-CB 2.98Å; F175-Y179 WeakPolarHBondContact O-CD2 3.26Å; F175-Y179 PolarHBondContact O-N 2.83Å; F175-L194 HydrophobicContact CD1-CD1 3.85Å; F175-L194 HydrophobicContact CE1-CD1 3.68Å; F175-L194 HydrophobicContact CE1-CD2 4.29Å
176	Y	84.4	Confident	83.1	Confident	33 Å²	33	57.1 Å²	57.1	13%	0.129	31%	0.314	C	S	.	.	H	α-helix	trans	-58.7	-49.9	178.2	-179.4	-90.3	0	0	0	111.8	L6 L121 T172 V173 T178 Y179 N180 L194 Y196	L6-Y176 HydrophobicContact CD2-CE1 4.12Å; L6-Y176 VanDerWaalsContact CD2-OH 3.23Å; L6-Y176 WeakPolarHBondContact CD2-OH 3.45Å; L121-Y176 HydrophobicContact CD2-CD2 4.12Å; T172-Y176 WeakPolarHBondContact O-CB 3.48Å; T172-Y176 PolarHBondContact O-N 2.85Å; V173-Y176 PolarHBondContact O-N 3.34Å; Y176-T178 PolarHBondContact O-N 3.17Å; Y176-Y179 PolarHBondContact O-N 3.26Å; Y176-N180 HydrophobicContact CD1-CB 4.44Å; Y176-N180 HydrophobicContact CD2-CB 4.23Å; Y176-N180 HydrophobicContact CE1-CB 4.35Å; Y176-N180 HydrophobicContact CE2-CB 4.14Å; Y176-N180 HydrophobicContact CG-CB 4.39Å; Y176-N180 VanDerWaalsContact CZ-ND2 3.3Å; Y176-N180 WeakPolarHBondContact O-CB 3.29Å; Y176-N180 PolarHBondContact O-N 2.85Å; Y176-N180 PolarHBondContact OH-ND2 3.37Å; Y176-N180 VanDerWaalsContact OH-ND2 3.13Å; Y176-L194 HydrophobicContact CD2-CB 3.76Å; Y176-L194 HydrophobicContact CE2-CB 3.97Å; Y176-L194 WeakPolarHBondContact CE2-O 3.22Å; Y176-Y196 WeakPolarHBondContact CB-OH 3.34Å; Y176-Y196 AromaticContact CD1-CE2 3.85Å; Y176-Y196 HydrophobicContact CD1-CE2 3.85Å; Y176-Y196 HydrophobicContact CD2-CD2 4.08Å; Y176-Y196 AromaticContact CD2-CE2 3.4Å; Y176-Y196 HydrophobicContact CD2-CE2 3.4Å; Y176-Y196 VanDerWaalsContact CD2-CE2 3.4Å; Y176-Y196 AromaticContact CD2-CZ 3.9Å; Y176-Y196 HydrophobicContact CE1-CE2 4.04Å; Y176-Y196 HydrophobicContact CE2-CD2 4.02Å; Y176-Y196 AromaticContact CE2-CE2 3.61Å; Y176-Y196 HydrophobicContact CE2-CE2 3.61Å; Y176-Y196 AromaticContact CG-CE2 3.53Å; Y176-Y196 HydrophobicContact CG-CE2 3.53Å; Y176-Y196 AromaticContact CG-CZ 3.68Å; Y176-Y196 AromaticContact CZ-CE2 3.93Å
177	D	84	Confident	82.4	Confident	92 Å²	92	64.9 Å²	64.9	49%	0.492	35%	0.354	S	S	.	.	H	α-helix	trans	-66.6	-26.5	-177.7	-66.4	-22.7	0	0	0	112.3	R111 V173 F175	R111-D177 IonicContact CZ-OD1 2.73Å; R111-D177 IonicContact NH1-OD1 3.65Å; R111-D177 IonicContact NH2-OD1 3.44Å; R111-D177 PolarHBondContact NH2-OD1 3.45Å; R111-D177 IonicContact NH2-OD2 3.57Å; V173-D177 PolarHBondContact O-N 3.3Å; F175-D177 PolarHBondContact O-N 2.86Å
178	T	85.1	Confident	81.4	Confident	64 Å²	64	61.7 Å²	61.7	39%	0.393	35%	0.346	S	S	.	.	H	α-helix	trans	-83.8	-40.9	179.5	-55.4	0	0	0	0	112.9	M142 H174 F175 Y176 T182	M142-T178 HydrophobicContact CE-CG2 4.28Å; H174-T178 WeakPolarHBondContact O-CB 3.49Å; H174-T178 PolarHBondContact O-N 2.65Å; H174-T178 VanDerWaalsContact O-N 3.12Å; H174-T178 PolarHBondContact O-OG1 2.9Å; F175-T178 PolarHBondContact O-N 2.92Å; Y176-T178 PolarHBondContact O-N 3.17Å; T178-T182 VanDerWaalsContact O-CG2 3.27Å; T178-T182 WeakPolarHBondContact O-CG2 3.4Å
179	Y	84.7	Confident	80.7	Confident	21 Å²	21	68.5 Å²	68.5	8%	0.082	37%	0.373	C	S	.	.	H	α-helix	trans	-105.8	-22.8	-168.5	-74.5	-80.2	0	0	0	114.5	F138 P141 M142 F175 Y176 G181 T182	F138-Y179 HydrophobicContact CD1-CD1 4.17Å; F138-Y179 HydrophobicContact CD1-CE1 4.3Å; F138-Y179 AromaticContact CE1-CD1 3.48Å; F138-Y179 HydrophobicContact CE1-CD1 3.48Å; F138-Y179 VanDerWaalsContact CE1-CD1 3.48Å; F138-Y179 HydrophobicContact CE1-CE1 4.05Å; F138-Y179 HydrophobicContact CE1-CG 4.33Å; F138-Y179 HydrophobicContact CE2-CD1 4.19Å; F138-Y179 HydrophobicContact CE2-CE1 4.43Å; F138-Y179 AromaticContact CZ-CD1 3.52Å; F138-Y179 HydrophobicContact CZ-CD1 3.52Å; F138-Y179 HydrophobicContact CZ-CE1 4.14Å; F138-Y179 VanDerWaalsContact O-CE1 3.32Å; F138-Y179 WeakPolarHBondContact O-CE1 3.48Å; F138-Y179 PolarHBondContact O-OH 2.92Å; P141-Y179 WeakPolarHBondContact CD-OH 3.33Å; P141-Y179 WeakPolarHBondContact CG-OH 3.06Å; M142-Y179 HydrophobicContact CE-CE2 4.4Å; M142-Y179 HydrophobicContact CG-CE2 4.28Å; M142-Y179 HydrophobicContact SD-CE2 4.02Å; F175-Y179 HydrophobicContact CD1-CD2 4.07Å; F175-Y179 AromaticContact CD2-CD2 3.48Å; F175-Y179 HydrophobicContact CD2-CD2 3.48Å; F175-Y179 VanDerWaalsContact CD2-CD2 3.48Å; F175-Y179 AromaticContact CD2-CE2 3.58Å; F175-Y179 HydrophobicContact CD2-CE2 3.58Å; F175-Y179 HydrophobicContact CE1-CD2 4.02Å; F175-Y179 HydrophobicContact CE1-CG 4.22Å; F175-Y179 AromaticContact CE2-CD2 3.41Å; F175-Y179 HydrophobicContact CE2-CD2 3.41Å; F175-Y179 VanDerWaalsContact CE2-CD2 3.41Å; F175-Y179 AromaticContact CE2-CE2 3.44Å; F175-Y179 HydrophobicContact CE2-CE2 3.44Å; F175-Y179 VanDerWaalsContact CE2-CE2 3.44Å; F175-Y179 HydrophobicContact CE2-CG 4.14Å; F175-Y179 AromaticContact CG-CD2 3.82Å; F175-Y179 HydrophobicContact CG-CD2 3.82Å; F175-Y179 HydrophobicContact CG-CE2 4.36Å; F175-Y179 AromaticContact CZ-CD2 3.7Å; F175-Y179 HydrophobicContact CZ-CD2 3.7Å; F175-Y179 HydrophobicContact CZ-CE2 4.11Å; F175-Y179 AromaticContact CZ-CG 3.98Å; F175-Y179 HydrophobicContact CZ-CG 3.98Å; F175-Y179 WeakPolarHBondContact O-CB 2.98Å; F175-Y179 WeakPolarHBondContact O-CD2 3.26Å; F175-Y179 PolarHBondContact O-N 2.83Å; Y176-Y179 PolarHBondContact O-N 3.26Å; Y179-G181 PolarHBondContact O-N 2.93Å; Y179-T182 PolarHBondContact O-N 2.84Å; Y179-T182 VanDerWaalsContact O-N 3.15Å; Y179-T182 PolarHBondContact O-OG1 2.72Å
180	N	83.9	Confident	80.2	Confident	60 Å²	60	70.7 Å²	70.7	32%	0.321	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	129.1	180	-170.1	43.7	0	0	0	110.3	Y176 T182 L194	Y176-N180 HydrophobicContact CD1-CB 4.44Å; Y176-N180 HydrophobicContact CD2-CB 4.23Å; Y176-N180 HydrophobicContact CE1-CB 4.35Å; Y176-N180 HydrophobicContact CE2-CB 4.14Å; Y176-N180 HydrophobicContact CG-CB 4.39Å; Y176-N180 VanDerWaalsContact CZ-ND2 3.3Å; Y176-N180 WeakPolarHBondContact O-CB 3.29Å; Y176-N180 PolarHBondContact O-N 2.85Å; Y176-N180 PolarHBondContact OH-ND2 3.37Å; Y176-N180 VanDerWaalsContact OH-ND2 3.13Å; N180-T182 VanDerWaalsContact C-N 3.28Å; N180-T182 PolarHBondContact O-N 2.8Å; N180-L194 HydrophobicContact CB-CB 4.23Å; N180-L194 HydrophobicContact CB-CD1 4.21Å; N180-L194 HydrophobicContact CB-CG 4.48Å; N180-L194 PolarHBondContact OD1-N 2.96Å
181	G	81.1	Confident	80.2	Confident	52 Å²	52	66 Å²	66	54%	0.536	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	-1.9	-176.7	0	0	0	0	0	115.2	Y179 C192	Y179-G181 PolarHBondContact O-N 2.93Å; G181-C192 PolarHBondContact N-O 3.02Å
182	T	84.2	Confident	80	Confident	49 Å²	49	63.7 Å²	63.7	30%	0.301	36%	0.356	S	S	.	.			trans	-85.1	143.8	177.2	64.3	0	0	0	0	111.7	F138 T178 Y179 N180 C192	F138-T182 WeakPolarHBondContact CZ-OG1 3.25Å; T178-T182 VanDerWaalsContact O-CG2 3.27Å; T178-T182 WeakPolarHBondContact O-CG2 3.4Å; Y179-T182 PolarHBondContact O-N 2.84Å; Y179-T182 VanDerWaalsContact O-N 3.15Å; Y179-T182 PolarHBondContact O-OG1 2.72Å; N180-T182 VanDerWaalsContact C-N 3.28Å; N180-T182 PolarHBondContact O-N 2.8Å; T182-C192 WeakPolarHBondContact O-CB 3.33Å; T182-C192 PolarHBondContact O-N 2.9Å
183	S	82.8	Confident	79.9	Confident	52 Å²	52	65.7 Å²	65.7	36%	0.364	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-72.6	138	176.7	56.7	0	0	0	0	111.4	N185 E188	S183-N185 WeakPolarHBondContact CB-O 3.41Å; S183-N185 PolarHBondContact O-N 3.47Å; S183-N185 PolarHBondContact OG-O 3.33Å; S183-E188 WeakPolarHBondContact CB-O 3.43Å
184	Y	79.3	Confident	79.9	Confident	17 Å²	17	65.1 Å²	65.1	7%	0.067	36%	0.362	C	S	.	.	S	Bend	trans	-60	-36.8	175.3	-66.9	-79.5	0	0	0	112.9	F123 V126 V130 L135 F138 C192	F123-Y184 HydrophobicContact CD1-CE1 4.15Å; F123-Y184 VanDerWaalsContact CD1-OH 3.3Å; F123-Y184 WeakPolarHBondContact CD1-OH 3.45Å; F123-Y184 AromaticContact CE1-CE1 3.92Å; F123-Y184 HydrophobicContact CE1-CE1 3.92Å; V126-Y184 HydrophobicContact CG1-CE1 4.44Å; V130-Y184 HydrophobicContact CG2-CG 4.46Å; L135-Y184 HydrophobicContact CD1-CD1 4.48Å; L135-Y184 HydrophobicContact CD1-CE1 3.94Å; F138-Y184 HydrophobicContact CD1-CD1 4.09Å; F138-Y184 HydrophobicContact CD1-CE1 4.29Å; F138-Y184 HydrophobicContact CD2-CD1 4.34Å; F138-Y184 HydrophobicContact CE1-CD1 4.14Å; F138-Y184 HydrophobicContact CE1-CE1 4.18Å; F138-Y184 HydrophobicContact CE2-CD1 4.39Å; F138-Y184 HydrophobicContact CG-CD1 4.17Å; F138-Y184 HydrophobicContact CZ-CD1 4.26Å; Y184-C192 HydrophobicContact CE1-CB 4.12Å; Y184-C192 HydrophobicContact CE2-CB 4.07Å
185	N	76.9	Confident	79.8	Confident	75 Å²	75	60.9 Å²	60.9	40%	0.401	34%	0.343	S	S	.	.	S	Bend	trans	-135.3	147.6	177.8	-70.9	-41.1	0	0	0	109.1	S183 L187 E188	S183-N185 WeakPolarHBondContact CB-O 3.41Å; S183-N185 PolarHBondContact O-N 3.47Å; S183-N185 PolarHBondContact OG-O 3.33Å; N185-L187 PolarHBondContact O-N 3.22Å; N185-L187 VanDerWaalsContact O-N 3.15Å; N185-E188 PolarHBondContact O-N 3.24Å
186	T	74.4	Confident	79.7	Confident	147 Å²	147	60.9 Å²	60.9	90%	0.902	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.7	178	36	0	0	0	0	114.6
187	L	71.8	Confident	79.6	Confident	166 Å²	166	59.3 Å²	59.3	87%	0.869	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-25.8	-179.1	-80.7	143.5	0	0	0	113.4	N185	N185-L187 PolarHBondContact O-N 3.22Å; N185-L187 VanDerWaalsContact O-N 3.15Å
188	E	67.1	Low	79.2	Confident	75 Å²	75	55.1 Å²	55.1	35%	0.35	31%	0.314	S	S	.	.			trans	-113.6	144.3	-173	-72.4	-179.9	177.3	0	0	111.5	H129 S183 N185 V190	H129-E188 IonicContact CD2-OE1 3.62Å; H129-E188 IonicContact CD2-OE2 2.81Å; H129-E188 IonicContact CE1-OE2 3.53Å; H129-E188 IonicContact NE2-OE1 3.12Å; H129-E188 PolarHBondContact NE2-OE1 3.41Å; H129-E188 IonicContact NE2-OE2 3.7Å; H129-E188 PolarHBondContact NE2-OE2 3.42Å; S183-E188 WeakPolarHBondContact CB-O 3.43Å; N185-E188 PolarHBondContact O-N 3.24Å; E188-V190 VanDerWaalsContact C-N 3.3Å; E188-V190 PolarHBondContact O-N 3.11Å
189	Q	67.6	Low	78.7	Confident	202 Å²	202	52.2 Å²	52.2	94%	0.944	30%	0.297	S	S	*	.			trans	-88	4.2	-178.7	-63.5	-177.4	-0.7	0	0	113.3	A191	Q189-A191 PolarHBondContact O-N 3.47Å; Q189-A191 VanDerWaalsContact O-N 3.13Å
190	V	72.5	Confident	78.3	Confident	67 Å²	67	51.3 Å²	51.3	41%	0.406	29%	0.293	S	S	.	.			trans	-74.7	108.1	177.3	-174.4	0	0	0	0	108.8	P127 E188	P127-V190 HydrophobicContact CG-CG1 3.89Å; E188-V190 VanDerWaalsContact C-N 3.3Å; E188-V190 PolarHBondContact O-N 3.11Å
191	A	80.9	Confident	77.6	Confident	38 Å²	38	49.2 Å²	49.2	31%	0.314	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-76.9	141.4	175.8	0	0	0	0	0	111.1	Q189 Q193	Q189-A191 PolarHBondContact O-N 3.47Å; Q189-A191 VanDerWaalsContact O-N 3.13Å; A191-Q193 PolarHBondContact O-N 3.46Å
192	C	82.4	Confident	77.1	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.007	26%	0.264	C	S	.	.			trans	-61.7	124.3	168.9	171	0	0	0	0	109.9	F123 F138 G181 T182 Y184	F123-C192 VanDerWaalsContact CD1-SG 3.54Å; F123-C192 WeakPolarHBondContact CE1-SG 3.38Å; F138-C192 HydrophobicContact CE1-CB 4.31Å; F138-C192 HydrophobicContact CZ-CB 4.11Å; G181-C192 PolarHBondContact N-O 3.02Å; T182-C192 WeakPolarHBondContact O-CB 3.33Å; T182-C192 PolarHBondContact O-N 2.9Å; Y184-C192 HydrophobicContact CE1-CB 4.12Å; Y184-C192 HydrophobicContact CE2-CB 4.07Å
193	Q	80.9	Confident	76.3	Confident	42 Å²	42	47.1 Å²	47.1	20%	0.196	26%	0.257	C	S	.	.			trans	-107.9	109.2	176.6	-66	178.7	-3.4	0	0	109.3	F123 F124 A191 V233	F123-Q193 WeakPolarHBondContact CA-O 3.45Å; F124-Q193 PolarHBondContact N-O 2.93Å; F124-Q193 VanDerWaalsContact N-O 3.11Å; A191-Q193 PolarHBondContact O-N 3.46Å; Q193-V233 HydrophobicContact CG-CG1 4.46Å
194	L	83.8	Confident	75.4	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.026	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	139.4	175.8	-63.6	175.2	0	0	0	109.8	C122 F123 F175 Y176 N180	C122-L194 WeakPolarHBondContact O-CA 3.35Å; F123-L194 HydrophobicContact CD1-CD2 3.61Å; F123-L194 HydrophobicContact CD2-CD2 3.85Å; F123-L194 HydrophobicContact CE1-CD2 3.7Å; F123-L194 HydrophobicContact CE2-CD2 3.83Å; F123-L194 HydrophobicContact CG-CD2 3.74Å; F123-L194 HydrophobicContact CZ-CD2 3.79Å; F175-L194 HydrophobicContact CD1-CD1 3.85Å; F175-L194 HydrophobicContact CE1-CD1 3.68Å; F175-L194 HydrophobicContact CE1-CD2 4.29Å; Y176-L194 HydrophobicContact CD2-CB 3.76Å; Y176-L194 HydrophobicContact CE2-CB 3.97Å; Y176-L194 WeakPolarHBondContact CE2-O 3.22Å; N180-L194 HydrophobicContact CB-CB 4.23Å; N180-L194 HydrophobicContact CB-CD1 4.21Å; N180-L194 HydrophobicContact CB-CG 4.48Å; N180-L194 PolarHBondContact OD1-N 2.96Å
195	M	83.2	Confident	74.5	Confident	20 Å²	20	48 Å²	48	10%	0.099	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	140.5	173.7	-62.1	-174.7	78.4	0	0	109.8	L9 C122 F124	L9-M195 HydrophobicContact CD1-CB 3.47Å; L9-M195 VanDerWaalsContact CD1-CB 3.47Å; L9-M195 HydrophobicContact CD1-CE 4.16Å; L9-M195 HydrophobicContact CD1-CG 4.15Å; L9-M195 HydrophobicContact CD1-SD 3.68Å; L9-M195 HydrophobicContact CD2-CE 3.5Å; L9-M195 VanDerWaalsContact CD2-CE 3.5Å; L9-M195 HydrophobicContact CD2-SD 4Å; L9-M195 HydrophobicContact CG-CB 3.86Å; L9-M195 HydrophobicContact CG-CE 3.79Å; L9-M195 HydrophobicContact CG-SD 4.01Å; C122-M195 PolarHBondContact N-O 2.89Å; C122-M195 PolarHBondContact O-N 2.8Å; F124-M195 HydrophobicContact CB-CG 4.42Å; F124-M195 HydrophobicContact CB-SD 4.12Å; F124-M195 HydrophobicContact CD1-SD 4.44Å; F124-M195 HydrophobicContact CD2-SD 3.97Å; F124-M195 HydrophobicContact CE2-SD 4.5Å; F124-M195 HydrophobicContact CG-SD 3.93Å
196	Y	83.5	Confident	73.5	Confident	1 Å²	1	49 Å²	49	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	135.2	176.3	-73.6	-86.3	0	0	0	110.5	L6 H8 L9 V116 S118 L121 T172 Y176	L6-Y196 HydrophobicContact CB-CD2 4.39Å; L6-Y196 HydrophobicContact CD1-CD2 3.93Å; L6-Y196 HydrophobicContact CD1-CE2 3.51Å; L6-Y196 HydrophobicContact CD2-CD2 4.45Å; L6-Y196 HydrophobicContact CD2-CE2 4.39Å; L6-Y196 HydrophobicContact CG-CD2 4.49Å; L6-Y196 HydrophobicContact CG-CE2 4.43Å; H8-Y196 CarbonylContact C-O 3.55Å; H8-Y196 WeakPolarHBondContact CA-O 3.37Å; L9-Y196 PolarHBondContact N-O 3.29Å; V116-Y196 HydrophobicContact CB-CD1 4.25Å; V116-Y196 HydrophobicContact CB-CE1 3.77Å; V116-Y196 HydrophobicContact CG1-CD1 3.63Å; V116-Y196 HydrophobicContact CG1-CD2 4.49Å; V116-Y196 HydrophobicContact CG1-CE1 3.68Å; V116-Y196 HydrophobicContact CG1-CG 4.01Å; V116-Y196 HydrophobicContact CG2-CE1 4.09Å; V116-Y196 HydrophobicContact CG2-CE2 4.35Å; S118-Y196 WeakPolarHBondContact OG-CD1 3.42Å; L121-Y196 HydrophobicContact CD2-CD1 3.38Å; L121-Y196 HydrophobicContact CD2-CD2 4.19Å; L121-Y196 HydrophobicContact CD2-CE1 3.57Å; L121-Y196 HydrophobicContact CD2-CE2 4.26Å; L121-Y196 HydrophobicContact CD2-CG 3.77Å; T172-Y196 HydrophobicContact CG2-CD1 4.37Å; T172-Y196 HydrophobicContact CG2-CE1 3.92Å; Y176-Y196 WeakPolarHBondContact CB-OH 3.34Å; Y176-Y196 AromaticContact CD1-CE2 3.85Å; Y176-Y196 HydrophobicContact CD1-CE2 3.85Å; Y176-Y196 HydrophobicContact CD2-CD2 4.08Å; Y176-Y196 AromaticContact CD2-CE2 3.4Å; Y176-Y196 HydrophobicContact CD2-CE2 3.4Å; Y176-Y196 VanDerWaalsContact CD2-CE2 3.4Å; Y176-Y196 AromaticContact CD2-CZ 3.9Å; Y176-Y196 HydrophobicContact CE1-CE2 4.04Å; Y176-Y196 HydrophobicContact CE2-CD2 4.02Å; Y176-Y196 AromaticContact CE2-CE2 3.61Å; Y176-Y196 HydrophobicContact CE2-CE2 3.61Å; Y176-Y196 AromaticContact CG-CE2 3.53Å; Y176-Y196 HydrophobicContact CG-CE2 3.53Å; Y176-Y196 AromaticContact CG-CZ 3.68Å; Y176-Y196 AromaticContact CZ-CE2 3.93Å
197	V	81.8	Confident	72.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120	178.7	-173.6	0	0	0	0	109.4	L9 I11 S118 V120 C122 L163 V200	L9-V197 CarbonylContact O-C 3.56Å; I11-V197 HydrophobicContact CD1-CG1 4.29Å; I11-V197 HydrophobicContact CD1-CG2 4.33Å; I11-V197 HydrophobicContact CG1-CG1 4.44Å; S118-V197 VanDerWaalsContact CB-O 3.22Å; S118-V197 WeakPolarHBondContact CB-O 3.22Å; V120-V197 HydrophobicContact CB-CB 4.23Å; V120-V197 HydrophobicContact CG1-CB 3.84Å; V120-V197 HydrophobicContact CG1-CG1 4.47Å; V120-V197 HydrophobicContact CG1-CG2 4.04Å; V120-V197 PolarHBondContact O-N 2.93Å; C122-V197 HydrophobicContact CB-CG2 3.49Å; C122-V197 VanDerWaalsContact CB-CG2 3.49Å; L163-V197 HydrophobicContact CD2-CG2 4.01Å; V197-V200 HydrophobicContact CG1-CG2 3.51Å
198	S	76.7	Confident	71.7	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-54.2	174.3	-178.9	0	0	0	0	111	L9 S28 L31	L9-S198 WeakPolarHBondContact O-CB 3.4Å; L9-S198 PolarHBondContact O-N 2.94Å; S28-S198 WeakPolarHBondContact CB-O 2.88Å; S28-S198 PolarHBondContact N-O 3.36Å; L31-S198 WeakPolarHBondContact CD1-OG 3.46Å
199	H	74	Confident	70.9	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.019	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	137.5	-173.7	-71.6	81.2	0	0	0	110.5	V10 I11 Y26 Y33 P34	V10-H199 CarbonylContact C-O 3.58Å; V10-H199 WeakPolarHBondContact CA-O 3.25Å; V10-H199 HydrophobicContact CG1-CB 4.21Å; V10-H199 HydrophobicContact CG2-CB 4.45Å; I11-H199 PolarHBondContact N-O 3.2Å; Y26-H199 WeakPolarHBondContact O-CA 3.5Å; Y33-H199 AromaticContact CD2-CD2 3.83Å; Y33-H199 AromaticContact CD2-NE2 3.88Å; P34-H199 VanDerWaalsContact CD-CG 3.49Å; P34-H199 WeakPolarHBondContact CD-ND1 3.38Å; P34-H199 HydrophobicContact CG-CB 3.93Å
200	V	74.8	Confident	70.1	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	114.4	167.7	-175.3	0	0	0	0	107.7	I11 F13 L24 Y26 L163 V197	I11-V200 HydrophobicContact CB-CG2 4.33Å; I11-V200 HydrophobicContact CD1-CG2 4.49Å; I11-V200 VanDerWaalsContact O-CA 3.3Å; I11-V200 WeakPolarHBondContact O-CA 3.46Å; F13-V200 HydrophobicContact CD2-CG1 3.88Å; F13-V200 HydrophobicContact CE2-CG1 3.6Å; L24-V200 HydrophobicContact CD1-CG1 4.39Å; L24-V200 HydrophobicContact CD2-CG1 4.31Å; L24-V200 HydrophobicContact CG-CG1 3.92Å; Y26-V200 PolarHBondContact N-O 3.48Å; Y26-V200 PolarHBondContact O-N 2.92Å; Y26-V200 VanDerWaalsContact O-O 3.14Å; L163-V200 HydrophobicContact CD1-CG2 4.37Å; V197-V200 HydrophobicContact CG1-CG2 3.51Å
201	E	70.9	Confident	69.1	Low	15 Å²	15	34.6 Å²	34.6	7%	0.07	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	152.1	-179.7	-71	-139.8	136	0	0	112.7	I11 L12 F13 R27 Y33 F35	I11-E201 PolarHBondContact O-N 2.75Å; L12-E201 CarbonylContact C-O 3.59Å; L12-E201 WeakPolarHBondContact CA-O 3.28Å; L12-E201 HydrophobicContact CD1-CB 3.97Å; F13-E201 PolarHBondContact N-O 3.17Å; R27-E201 IonicContact CZ-OE1 3.87Å; R27-E201 VanDerWaalsContact CZ-OE1 3.23Å; R27-E201 IonicContact NE-OE1 3.47Å; R27-E201 PolarHBondContact NE-OE1 2.93Å; R27-E201 IonicContact NH2-OE1 3.97Å; R27-E201 PolarHBondContact NH2-OE1 3.3Å; Y33-E201 HydrophobicContact CE2-CG 4.39Å; Y33-E201 WeakPolarHBondContact CE2-OE1 3.26Å; Y33-E201 VanDerWaalsContact CZ-OE2 3.29Å; Y33-E201 PolarHBondContact OH-OE1 2.98Å; Y33-E201 PolarHBondContact OH-OE2 3.02Å; F35-E201 HydrophobicContact CD2-CB 4.24Å; F35-E201 HydrophobicContact CD2-CG 3.96Å; F35-E201 WeakPolarHBondContact CD2-OE2 3.46Å; F35-E201 HydrophobicContact CE2-CB 3.78Å; F35-E201 HydrophobicContact CE2-CG 3.76Å
202	I	70	Confident	67.7	Low	35 Å²	35	35.4 Å²	35.4	18%	0.179	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.8	177	-62.2	160.1	0	0	0	108.3	F13 E15 L20 L24	F13-I202 HydrophobicContact CB-CB 4.47Å; F13-I202 HydrophobicContact CB-CG1 3.86Å; F13-I202 HydrophobicContact CG-CG1 4.44Å; F13-I202 CarbonylContact O-C 3.55Å; F13-I202 VanDerWaalsContact O-CA 3.31Å; F13-I202 WeakPolarHBondContact O-CA 3.38Å; E15-I202 HydrophobicContact CB-CG2 4.46Å; E15-I202 HydrophobicContact CG-CG2 3.79Å; L20-I202 HydrophobicContact CB-CD1 3.5Å; L20-I202 HydrophobicContact CB-CG1 4.5Å; L20-I202 WeakPolarHBondContact O-CD1 3.22Å; L24-I202 HydrophobicContact CB-CD1 4.04Å; L24-I202 WeakPolarHBondContact O-CD1 3.4Å
203	T	66.7	Low	66.4	Low	23 Å²	23	37.3 Å²	37.3	14%	0.141	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	158.2	175.8	54.9	0	0	0	0	109.7	L12 F13 E14 E15 A210	L12-T203 HydrophobicContact CD1-CG2 3.51Å; F13-T203 PolarHBondContact O-N 3.22Å; F13-T203 PolarHBondContact O-OG1 2.95Å; E14-T203 CarbonylContact C-O 3.59Å; E14-T203 WeakPolarHBondContact CA-O 3.48Å; E15-T203 PolarHBondContact N-O 3.22Å; T203-A210 HydrophobicContact CG2-CB 3.8Å
204	H	63.8	Low	65.1	Low	36 Å²	36	44.7 Å²	44.7	17%	0.167	25%	0.252	C	S	.	.			trans	-124.8	139.8	176.1	177.4	-82.7	0	0	0	107.2	E15 T16 Q18 S206 T207	E15-H204 PolarHBondContact O-CD2 3.32Å; T16-H204 PolarHBondContact O-CD2 2.8Å; T16-H204 PolarHBondContact O-NE2 3.05Å; Q18-H204 HydrophobicContact CG-CB 4.34Å; H204-S206 PolarHBondContact CE1-OG 2.77Å; H204-S206 VanDerWaalsContact ND1-CB 3.34Å; H204-S206 WeakPolarHBondContact ND1-CB 3.46Å; H204-S206 PolarHBondContact ND1-N 3.44Å; H204-S206 PolarHBondContact ND1-OG 3Å; H204-S206 PolarHBondContact O-N 2.73Å; H204-T207 WeakPolarHBondContact O-CB 3.5Å; H204-T207 PolarHBondContact O-N 2.8Å; H204-T207 PolarHBondContact O-OG1 3.35Å
205	P	60	Low	64.1	Low	51 Å²	51	48.1 Å²	48.1	33%	0.331	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-54.3	-33.9	-175	14.5	-27.5	0	0	0	113	E15 T207 G208	E15-P205 WeakPolarHBondContact O-CD 3.21Å; P205-T207 VanDerWaalsContact C-N 3.35Å; P205-T207 PolarHBondContact O-N 3Å; P205-G208 PolarHBondContact O-N 3.15Å
206	S	57.9	Low	63.3	Low	96 Å²	96	48.1 Å²	48.1	67%	0.671	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-70.4	-22.9	177.3	76.5	0	0	0	0	115.3	H204 G208	H204-S206 PolarHBondContact CE1-OG 2.77Å; H204-S206 VanDerWaalsContact ND1-CB 3.34Å; H204-S206 WeakPolarHBondContact ND1-CB 3.46Å; H204-S206 PolarHBondContact ND1-N 3.44Å; H204-S206 PolarHBondContact ND1-OG 3Å; H204-S206 PolarHBondContact O-N 2.73Å; S206-G208 PolarHBondContact O-N 2.84Å
207	T	57.1	Low	62.5	Low	78 Å²	78	52.1 Å²	52.1	48%	0.479	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-76.2	-10.4	177.2	-40.5	0	0	0	0	111.1	H204 P205	H204-T207 WeakPolarHBondContact O-CB 3.5Å; H204-T207 PolarHBondContact O-N 2.8Å; H204-T207 PolarHBondContact O-OG1 3.35Å; P205-T207 VanDerWaalsContact C-N 3.35Å; P205-T207 PolarHBondContact O-N 3Å
208	G	50	Low	61.9	Low	41 Å²	41	56.6 Å²	56.6	42%	0.423	31%	0.307	S	S	.	.			trans	95.7	134.3	-168.4	0	0	0	0	0	109.7	P205 S206 A210	P205-G208 PolarHBondContact O-N 3.15Å; S206-G208 PolarHBondContact O-N 2.84Å; G208-A210 PolarHBondContact O-N 2.71Å
209	V	50.9	Low	61.7	Low	67 Å²	67	56.8 Å²	56.8	41%	0.406	31%	0.308	S	S	.	.			trans	-59.3	125.4	175.7	-148	0	0	0	0	107.9	F211	V209-F211 HydrophobicContact CB-CD2 4.41Å; V209-F211 HydrophobicContact CB-CE2 4.14Å; V209-F211 HydrophobicContact CB-CZ 4.46Å; V209-F211 HydrophobicContact CG2-CE2 4.41Å; V209-F211 WeakPolarHBondContact O-CD2 3.08Å; V209-F211 PolarHBondContact O-N 2.97Å
210	A	50.9	Low	61.6	Low	11 Å²	11	59 Å²	59	9%	0.091	32%	0.322	C	S	.	.			trans	-71.2	89.4	168.3	0	0	0	0	0	107.1	L12 F35 T203 G208	L12-A210 HydrophobicContact CD1-CB 4.4Å; L12-A210 HydrophobicContact CD2-CB 4.02Å; F35-A210 HydrophobicContact CD1-CB 3.7Å; F35-A210 HydrophobicContact CE1-CB 4.2Å; F35-A210 HydrophobicContact CG-CB 4.33Å; T203-A210 HydrophobicContact CG2-CB 3.8Å; G208-A210 PolarHBondContact O-N 2.71Å
211	F	50.6	Low	61.4	Low	158 Å²	158	62.3 Å²	62.3	69%	0.693	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-58.9	135.1	170.4	-72.7	-84.1	0	0	0	108.3	V209 T213	V209-F211 HydrophobicContact CB-CD2 4.41Å; V209-F211 HydrophobicContact CB-CE2 4.14Å; V209-F211 HydrophobicContact CB-CZ 4.46Å; V209-F211 HydrophobicContact CG2-CE2 4.41Å; V209-F211 WeakPolarHBondContact O-CD2 3.08Å; V209-F211 PolarHBondContact O-N 2.97Å; F211-T213 PolarHBondContact O-N 2.9Å
212	P	52.3	Low	61.5	Low	55 Å²	55	61.6 Å²	61.6	36%	0.357	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-51.8	134.3	172.6	18.9	-29.2	0	0	0	109.5	Y103 L216	Y103-P212 HydrophobicContact CD1-CB 3.99Å; Y103-P212 HydrophobicContact CD1-CG 4.47Å; Y103-P212 HydrophobicContact CE1-CB 3.62Å; Y103-P212 HydrophobicContact CE1-CG 3.7Å; P212-L216 HydrophobicContact CB-CB 3.91Å; P212-L216 HydrophobicContact CB-CD1 4.08Å
213	T	53.9	Low	61.6	Low	40 Å²	40	62.7 Å²	62.7	25%	0.245	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-61.7	159.1	169.7	39.5	0	0	0	0	110.2	P34 I36 F211 D215 L216	P34-T213 WeakPolarHBondContact O-CB 3.34Å; P34-T213 WeakPolarHBondContact O-CG2 3.36Å; P34-T213 PolarHBondContact O-OG1 3.01Å; I36-T213 HydrophobicContact CD1-CG2 4.33Å; I36-T213 HydrophobicContact CG1-CG2 4.07Å; F211-T213 PolarHBondContact O-N 2.9Å; T213-D215 PolarHBondContact O-N 2.82Å; T213-L216 PolarHBondContact O-N 2.83Å
214	K	54.2	Low	62	Low	197 Å²	197	64.3 Å²	64.3	86%	0.857	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	129.1	167.7	-68.2	-177.5	176	-176.9	0	107.5
215	D	62.6	Low	62.3	Low	78 Å²	78	64 Å²	64	42%	0.417	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.4	13.8	177.6	-44.4	-18.6	0	0	0	117.4	Q106 T213	Q106-D215 HydrophobicContact CB-CB 4.34Å; Q106-D215 WeakPolarHBondContact CB-O 3.36Å; Q106-D215 VanDerWaalsContact CG-O 3.26Å; Q106-D215 WeakPolarHBondContact CG-O 3.28Å; Q106-D215 PolarHBondContact N-O 2.9Å; T213-D215 PolarHBondContact O-N 2.82Å
216	L	66.2	Low	62.7	Low	19 Å²	19	66.3 Å²	66.3	10%	0.099	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.4	168.1	-69.4	171.8	0	0	0	111.6	V10 P34 Y103 N105 P212 T213	V10-L216 HydrophobicContact CG2-CD2 4.23Å; P34-L216 HydrophobicContact CB-CD1 4.09Å; Y103-L216 HydrophobicContact CD1-CB 4.17Å; Y103-L216 HydrophobicContact CG-CB 4.38Å; Y103-L216 HydrophobicContact CG-CD1 4.41Å; N105-L216 WeakPolarHBondContact OD1-CD2 3.34Å; P212-L216 HydrophobicContact CB-CB 3.91Å; P212-L216 HydrophobicContact CB-CD1 4.08Å; T213-L216 PolarHBondContact O-N 2.83Å
217	R	66.7	Low	63.2	Low	86 Å²	86	63.7 Å²	63.7	33%	0.325	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.7	172.3	-175.6	-174.8	-173.8	-79.1	15.4	109	Y103 K104 E231	Y103-R217 CarbonylContact C-O 3.53Å; Y103-R217 WeakPolarHBondContact CA-O 3.25Å; K104-R217 PolarHBondContact N-O 3.38Å; K104-R217 PolarHBondContact O-N 3.3Å; R217-E231 IonicContact CZ-OE1 2.93Å; R217-E231 IonicContact CZ-OE2 3.01Å; R217-E231 IonicContact NE-OE2 2.9Å; R217-E231 IonicContact NH2-OE1 2.72Å; R217-E231 PolarHBondContact NH2-OE1 3.33Å; R217-E231 IonicContact NH2-OE2 3.6Å; R217-E231 PolarHBondContact NH2-OE2 2.73Å
218	E	69	Low	63.9	Low	93 Å²	93	61.3 Å²	61.3	44%	0.435	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	140.8	171.5	-170	170.4	-163.3	0	0	110.1	H101 Y103 P220	H101-E218 IonicContact CE1-OE1 3.77Å; H101-E218 IonicContact CG-OE1 2.7Å; H101-E218 IonicContact ND1-OE1 2.72Å; H101-E218 PolarHBondContact ND1-OE1 2.89Å; Y103-E218 HydrophobicContact CD1-CB 3.96Å; Y103-E218 HydrophobicContact CD1-CG 4.49Å; Y103-E218 HydrophobicContact CE1-CB 3.95Å; Y103-E218 HydrophobicContact CE1-CG 4.32Å; E218-P220 WeakPolarHBondContact O-CD 3.41Å
219	L	73.1	Confident	64.6	Low	8 Å²	8	59.4 Å²	59.4	4%	0.042	31%	0.311	C	S	.	.			trans	-83.7	114	175.9	-68	175.7	0	0	0	109.6	L9 I102 K104 F124	L9-L219 HydrophobicContact CD2-CD1 4.16Å; I102-L219 HydrophobicContact CG2-CD1 4.06Å; I102-L219 PolarHBondContact O-N 2.98Å; K104-L219 HydrophobicContact CB-CD2 4.46Å; K104-L219 HydrophobicContact CD-CD2 4.24Å; F124-L219 HydrophobicContact CE2-CD1 4.04Å; F124-L219 HydrophobicContact CZ-CD1 3.79Å
220	P	71.2	Confident	65.3	Low	51 Å²	51	56.5 Å²	56.5	33%	0.331	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-71.1	156.7	179.8	29.3	-32.4	0	0	0	111.3	E218 L229	E218-P220 WeakPolarHBondContact O-CD 3.41Å; P220-L229 HydrophobicContact CB-CD1 4.49Å; P220-L229 HydrophobicContact CG-CB 4.27Å; P220-L229 HydrophobicContact CG-CD1 4.2Å; P220-L229 WeakPolarHBondContact O-CB 3.39Å; P220-L229 PolarHBondContact O-N 2.99Å
221	S	72.2	Confident	65.5	Low	71 Å²	71	61.2 Å²	61.2	50%	0.497	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-89	145.4	170	55.2	0	0	0	0	111.5	E227	S221-E227 CarbonylContact C-O 3.52Å; S221-E227 WeakPolarHBondContact CA-O 3.42Å
222	C	72.3	Confident	65.4	Low	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-68.8	126.6	172.9	-179.7	0	0	0	0	109.7	V224 C225 L226 E227 L229 H247	C222-V224 PolarHBondContact O-N 3.03Å; C222-C225 VanDerWaalsContact CB-SG 3.56Å; C222-C225 VanDerWaalsContact SG-SG 3.67Å; C222-L226 WeakPolarHBondContact O-CA 3.17Å; C222-L226 PolarHBondContact O-N 2.82Å; C222-E227 WeakPolarHBondContact CB-O 3.19Å; C222-E227 PolarHBondContact N-O 2.89Å; C222-L229 HydrophobicContact CB-CD1 4.28Å; C222-L229 HydrophobicContact CB-CD2 3.88Å; C222-L229 HydrophobicContact CB-CG 3.85Å; C222-H247 WeakPolarHBondContact CB-CE1 3.34Å; C222-H247 VanDerWaalsContact CB-ND1 3.25Å; C222-H247 WeakPolarHBondContact CB-ND1 3.48Å; C222-H247 PolarHBondContact SG-ND1 2.81Å
223	P	73	Confident	65.3	Low	58 Å²	58	59.1 Å²	59.1	38%	0.377	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-13	-178.9	29	-37.9	0	0	0	114.1	F246 V261	P223-F246 HydrophobicContact CG-CD1 3.62Å; P223-F246 HydrophobicContact CG-CE1 3.31Å; P223-F246 HydrophobicContact CG-CZ 4.17Å; P223-V261 HydrophobicContact CB-CG2 3.96Å; P223-V261 HydrophobicContact CG-CG2 3.76Å
224	V	73.2	Confident	65.2	Low	56 Å²	56	59.1 Å²	59.1	34%	0.339	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-55.5	-178.3	175.7	0	0	0	0	111.3	C222 F246 C250 V254 P260	C222-V224 PolarHBondContact O-N 3.03Å; V224-F246 HydrophobicContact CG2-CD1 3.66Å; V224-F246 HydrophobicContact CG2-CE1 3.91Å; V224-C250 HydrophobicContact CB-CB 3.91Å; V224-C250 HydrophobicContact CG1-CB 3.89Å; V224-V254 HydrophobicContact CG1-CG2 4.46Å; V224-V254 HydrophobicContact CG2-CG2 4.32Å; V224-P260 HydrophobicContact CG2-CG 4.14Å
225	C	71.2	Confident	65	Low	31 Å²	31	52.2 Å²	52.2	21%	0.209	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-8.9	-179.8	62.3	0	0	0	0	114	C222 E227 H247 C250	C222-C225 VanDerWaalsContact CB-SG 3.56Å; C222-C225 VanDerWaalsContact SG-SG 3.67Å; C225-E227 HydrophobicContact CB-CG 4.01Å; C225-E227 PolarHBondContact O-N 3.16Å; C225-E227 VanDerWaalsContact O-N 3.11Å; C225-E227 VanDerWaalsContact SG-CB 3.53Å; C225-E227 PolarHBondContact SG-N 2.72Å; C225-H247 PolarHBondContact SG-CE1 3.39Å; C225-H247 PolarHBondContact SG-ND1 2.81Å; C225-C250 PolarHBondContact SG-SG 3.4Å
226	L	67.3	Low	64.5	Low	98 Å²	98	50.3 Å²	50.3	51%	0.513	29%	0.285	S	S	.	.			trans	61.6	8.9	-173.3	-51.4	177.3	0	0	0	114.4	P157 C222	P157-L226 HydrophobicContact CG-CB 4.17Å; C222-L226 WeakPolarHBondContact O-CA 3.17Å; C222-L226 PolarHBondContact O-N 2.82Å
227	E	70.2	Confident	63.8	Low	41 Å²	41	53.1 Å²	53.1	19%	0.192	30%	0.3	C	S	.	.			trans	-81.3	159	172.5	-53.4	176.8	170	0	0	110.7	Q159 S221 C222 C225	Q159-E227 PolarHBondContact NE2-OE1 3.28Å; Q159-E227 PolarHBondContact NE2-OE2 3.16Å; S221-E227 CarbonylContact C-O 3.52Å; S221-E227 WeakPolarHBondContact CA-O 3.42Å; C222-E227 WeakPolarHBondContact CB-O 3.19Å; C222-E227 PolarHBondContact N-O 2.89Å; C225-E227 HydrophobicContact CB-CG 4.01Å; C225-E227 PolarHBondContact O-N 3.16Å; C225-E227 VanDerWaalsContact O-N 3.11Å; C225-E227 VanDerWaalsContact SG-CB 3.53Å; C225-E227 PolarHBondContact SG-N 2.72Å
228	R	71.6	Confident	62.9	Low	28 Å²	28	52 Å²	52	11%	0.106	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-74	139.4	-175.4	-63.8	174.1	-177.2	-108.4	4.8	111.5	I100 I102 F124 D154 Q234 H247	I100-R228 PolarHBondContact O-NH2 3.37Å; I102-R228 VanDerWaalsContact CB-NH1 3.34Å; F124-R228 HydrophobicContact CE1-CB 3.85Å; F124-R228 HydrophobicContact CZ-CB 3.61Å; F124-R228 HydrophobicContact CZ-CG 4.21Å; D154-R228 IonicContact OD2-NH2 2.7Å; R228-Q234 PolarHBondContact O-OE1 3.34Å; R228-H247 PolarHBondContact O-NE2 2.82Å
229	L	64.8	Low	62.1	Low	1 Å²	1	49 Å²	49	1%	0.005	29%	0.291	C	S	.	.			trans	-92.6	113.1	177	-69.1	160.8	0	0	0	109.8	P220 C222 I236 T245	P220-L229 HydrophobicContact CB-CD1 4.49Å; P220-L229 HydrophobicContact CG-CB 4.27Å; P220-L229 HydrophobicContact CG-CD1 4.2Å; P220-L229 WeakPolarHBondContact O-CB 3.39Å; P220-L229 PolarHBondContact O-N 2.99Å; C222-L229 HydrophobicContact CB-CD1 4.28Å; C222-L229 HydrophobicContact CB-CD2 3.88Å; C222-L229 HydrophobicContact CB-CG 3.85Å; L229-I236 HydrophobicContact CB-CD1 4.04Å; L229-I236 HydrophobicContact CD2-CD1 4.42Å; L229-I236 HydrophobicContact CD2-CG1 4.43Å; L229-T245 WeakPolarHBondContact CD1-O 3.33Å; L229-T245 WeakPolarHBondContact CD1-OG1 3.43Å
230	D	64	Low	61.1	Low	6 Å²	6	55.5 Å²	55.5	3%	0.032	32%	0.324	C	S	.	.			trans	-111.1	116.7	169.8	-166.4	25.5	0	0	0	111.3	K104 P232 V233 Q234	K104-D230 IonicContact NZ-OD1 3.6Å; K104-D230 PolarHBondContact NZ-OD1 3.26Å; K104-D230 IonicContact NZ-OD2 2.75Å; D230-P232 VanDerWaalsContact C-CD 3.46Å; D230-P232 WeakPolarHBondContact OD1-CD 3.31Å; D230-V233 PolarHBondContact O-N 2.91Å; D230-Q234 PolarHBondContact O-N 3.46Å
231	E	55.9	Low	60.2	Low	110 Å²	110	61.5 Å²	61.5	51%	0.514	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-40.5	-174.3	-88.2	169.6	167.4	0	0	116	R217 I236	R217-E231 IonicContact CZ-OE1 2.93Å; R217-E231 IonicContact CZ-OE2 3.01Å; R217-E231 IonicContact NE-OE2 2.9Å; R217-E231 IonicContact NH2-OE1 2.72Å; R217-E231 PolarHBondContact NH2-OE1 3.33Å; R217-E231 IonicContact NH2-OE2 3.6Å; R217-E231 PolarHBondContact NH2-OE2 2.73Å; E231-I236 HydrophobicContact CB-CD1 4.21Å; E231-I236 HydrophobicContact CG-CD1 3.57Å
232	P	49.4	Very low	59.7	Low	84 Å²	84	59.9 Å²	59.9	55%	0.545	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-15	-176.4	29.7	-27.7	0	0	0	115	K104 D230	K104-P232 VanDerWaalsContact NZ-CD 3.32Å; D230-P232 VanDerWaalsContact C-CD 3.46Å; D230-P232 WeakPolarHBondContact OD1-CD 3.31Å
233	V	50	Low	59.2	Low	86 Å²	86	66 Å²	66	52%	0.521	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-42.5	-171.1	-170	0	0	0	0	112.4	Q193 D230	Q193-V233 HydrophobicContact CG-CG1 4.46Å; D230-V233 PolarHBondContact O-N 2.91Å
234	Q	51.1	Low	59	Low	40 Å²	40	66.2 Å²	66.2	19%	0.187	37%	0.369	C	S	.	.	S	Bend	trans	-104	112.5	176	-67.3	169.2	-27.4	0	0	106.3	R228 D230 I236 H247	R228-Q234 PolarHBondContact O-OE1 3.34Å; D230-Q234 PolarHBondContact O-N 3.46Å; Q234-I236 WeakPolarHBondContact O-CG1 3.17Å; Q234-I236 PolarHBondContact O-N 2.82Å; Q234-H247 PolarHBondContact OE1-CD2 3.48Å; Q234-H247 PolarHBondContact OE1-NE2 3.24Å
235	G	50	Low	58.7	Low	51 Å²	51	65.5 Å²	65.5	53%	0.526	37%	0.365	S	S	.	.			trans	-47.8	109.5	175.8	0	0	0	0	0	109.6	D248	G235-D248 WeakPolarHBondContact O-CB 3.45Å; G235-D248 PolarHBondContact O-N 3.45Å
236	I	52.6	Low	58.7	Low	38 Å²	38	64 Å²	64	20%	0.195	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	124.5	178.4	-60.7	-172.4	0	0	0	106.6	L229 E231 Q234 T245 F246	L229-I236 HydrophobicContact CB-CD1 4.04Å; L229-I236 HydrophobicContact CD2-CD1 4.42Å; L229-I236 HydrophobicContact CD2-CG1 4.43Å; E231-I236 HydrophobicContact CB-CD1 4.21Å; E231-I236 HydrophobicContact CG-CD1 3.57Å; Q234-I236 WeakPolarHBondContact O-CG1 3.17Å; Q234-I236 PolarHBondContact O-N 2.82Å; I236-T245 HydrophobicContact CG2-CG2 3.92Å; I236-F246 WeakPolarHBondContact CA-O 3.44Å; I236-F246 WeakPolarHBondContact CG2-O 3.48Å
237	L	50.1	Low	59	Low	79 Å²	79	60 Å²	60	41%	0.414	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	108.5	164.3	-89.8	172.1	0	0	0	108	T239 F246 D248 I251	L237-T239 PolarHBondContact O-N 3.05Å; L237-F246 PolarHBondContact N-O 3.47Å; L237-F246 PolarHBondContact O-N 3.03Å; L237-D248 HydrophobicContact CD1-CB 4.2Å; L237-D248 WeakPolarHBondContact CD1-OD1 3.2Å; L237-D248 HydrophobicContact CG-CB 4.41Å; L237-I251 HydrophobicContact CB-CG2 3.79Å; L237-I251 HydrophobicContact CD1-CG2 3.47Å; L237-I251 VanDerWaalsContact CD1-CG2 3.47Å; L237-I251 HydrophobicContact CG-CG2 4.27Å
238	T	49.2	Very low	58.9	Low	61 Å²	61	61.8 Å²	61.8	37%	0.374	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	116.9	164.9	-36.2	0	0	0	0	107.5	I240 H244 T245	T238-I240 PolarHBondContact O-N 2.87Å; T238-H244 WeakPolarHBondContact CA-O 3.16Å; T238-T245 HydrophobicContact CG2-CG2 3.92Å
239	T	51.9	Low	59	Low	30 Å²	30	62.4 Å²	62.4	18%	0.184	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	110.4	173.7	48	0	0	0	0	109.3	L237 L241 C242 N243 H244 F246 I251	L237-T239 PolarHBondContact O-N 3.05Å; T239-L241 PolarHBondContact O-N 2.88Å; T239-C242 PolarHBondContact O-N 3.04Å; T239-C242 VanDerWaalsContact O-N 3.14Å; T239-C242 PolarHBondContact OG1-SG 2.82Å; T239-N243 PolarHBondContact O-N 3.3Å; T239-N243 VanDerWaalsContact O-N 3.1Å; T239-H244 PolarHBondContact N-O 3.43Å; T239-H244 PolarHBondContact OG1-O 2.89Å; T239-H244 VanDerWaalsContact OG1-O 3.09Å; T239-F246 HydrophobicContact CG2-CD2 3.81Å; T239-F246 HydrophobicContact CG2-CE2 3.59Å; T239-F246 WeakPolarHBondContact OG1-CE2 2.89Å; T239-I251 HydrophobicContact CG2-CD1 3.94Å; T239-I251 HydrophobicContact CG2-CG1 4.23Å
240	I	51.6	Low	59.5	Low	146 Å²	146	63.1 Å²	63.1	75%	0.749	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.3	-162.6	-64.4	168.3	0	0	0	113.4	T238	T238-I240 PolarHBondContact O-N 2.87Å
241	L	52.8	Low	59.8	Low	177 Å²	177	64.3 Å²	64.3	93%	0.927	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-20.9	-175	-62.6	177.9	0	0	0	114.9	T239	T239-L241 PolarHBondContact O-N 2.88Å
242	C	61.4	Low	60.6	Low	37 Å²	37	63.2 Å²	63.2	25%	0.25	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.4	3.6	-171.3	61.5	0	0	0	0	114.4	T239 H244 C259 C262	T239-C242 PolarHBondContact O-N 3.04Å; T239-C242 VanDerWaalsContact O-N 3.14Å; T239-C242 PolarHBondContact OG1-SG 2.82Å; C242-H244 PolarHBondContact O-N 3.26Å; C242-H244 VanDerWaalsContact O-N 3.13Å; C242-H244 PolarHBondContact SG-ND1 2.92Å; C242-C259 VanDerWaalsContact SG-CB 3.53Å; C242-C259 PolarHBondContact SG-SG 3.37Å; C242-C262 WeakPolarHBondContact CB-SG 3.46Å
243	N	62.1	Low	61.7	Low	129 Å²	129	66.6 Å²	66.6	69%	0.69	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	21.5	178.2	-67.1	-20.4	0	0	0	115.2	T239	T239-N243 PolarHBondContact O-N 3.3Å; T239-N243 VanDerWaalsContact O-N 3.1Å
244	H	68.2	Low	62.6	Low	61 Å²	61	64.5 Å²	64.5	28%	0.282	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	131.1	170.2	-63.2	116.7	0	0	0	110.4	T238 T239 C242 F246 C259 V261 C262	T238-H244 WeakPolarHBondContact CA-O 3.16Å; T239-H244 PolarHBondContact N-O 3.43Å; T239-H244 PolarHBondContact OG1-O 2.89Å; T239-H244 VanDerWaalsContact OG1-O 3.09Å; C242-H244 PolarHBondContact O-N 3.26Å; C242-H244 VanDerWaalsContact O-N 3.13Å; C242-H244 PolarHBondContact SG-ND1 2.92Å; H244-F246 HydrophobicContact CB-CE2 3.57Å; H244-F246 HydrophobicContact CB-CZ 3.79Å; H244-F246 WeakPolarHBondContact O-CD2 3Å; H244-F246 VanDerWaalsContact O-CE2 3.3Å; H244-F246 WeakPolarHBondContact O-CE2 3.45Å; H244-C259 PolarHBondContact ND1-SG 3.06Å; H244-V261 HydrophobicContact CB-CB 4.4Å; H244-V261 HydrophobicContact CB-CG2 4.18Å; H244-V261 VanDerWaalsContact NE2-CG1 3.26Å; H244-V261 WeakPolarHBondContact NE2-CG1 3.34Å; H244-C262 PolarHBondContact CE1-SG 3.13Å
245	T	68.3	Low	63.3	Low	42 Å²	42	71.9 Å²	71.9	26%	0.258	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.9	-177.4	50.7	0	0	0	0	111.7	L229 I236 T238	L229-T245 WeakPolarHBondContact CD1-O 3.33Å; L229-T245 WeakPolarHBondContact CD1-OG1 3.43Å; I236-T245 HydrophobicContact CG2-CG2 3.92Å; T238-T245 HydrophobicContact CG2-CG2 3.92Å
246	F	70.4	Confident	64	Low	0 Å²	0	73.1 Å²	73.1	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158.1	177.7	-53.8	-93.3	0	0	0	110.3	P223 V224 I236 L237 T239 H244 I251 P260 V261	P223-F246 HydrophobicContact CG-CD1 3.62Å; P223-F246 HydrophobicContact CG-CE1 3.31Å; P223-F246 HydrophobicContact CG-CZ 4.17Å; V224-F246 HydrophobicContact CG2-CD1 3.66Å; V224-F246 HydrophobicContact CG2-CE1 3.91Å; I236-F246 WeakPolarHBondContact CA-O 3.44Å; I236-F246 WeakPolarHBondContact CG2-O 3.48Å; L237-F246 PolarHBondContact N-O 3.47Å; L237-F246 PolarHBondContact O-N 3.03Å; T239-F246 HydrophobicContact CG2-CD2 3.81Å; T239-F246 HydrophobicContact CG2-CE2 3.59Å; T239-F246 WeakPolarHBondContact OG1-CE2 2.89Å; H244-F246 HydrophobicContact CB-CE2 3.57Å; H244-F246 HydrophobicContact CB-CZ 3.79Å; H244-F246 WeakPolarHBondContact O-CD2 3Å; H244-F246 VanDerWaalsContact O-CE2 3.3Å; H244-F246 WeakPolarHBondContact O-CE2 3.45Å; F246-I251 HydrophobicContact CB-CB 4.03Å; F246-I251 HydrophobicContact CD2-CD1 4.28Å; F246-I251 HydrophobicContact CG-CB 4.43Å; F246-I251 HydrophobicContact CG-CD1 4.4Å; F246-P260 HydrophobicContact CE1-CB 4.28Å; F246-P260 HydrophobicContact CE1-CG 3.99Å; F246-P260 HydrophobicContact CZ-CG 4.33Å; F246-V261 HydrophobicContact CE1-CG2 4.17Å; F246-V261 HydrophobicContact CZ-CG2 3.91Å
247	H	73	Confident	64.6	Low	12 Å²	12	78.5 Å²	78.5	6%	0.056	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	139	163.2	-56.1	113.5	0	0	0	109.3	C222 C225 R228 Q234 G249 C250 I251	C222-H247 WeakPolarHBondContact CB-CE1 3.34Å; C222-H247 VanDerWaalsContact CB-ND1 3.25Å; C222-H247 WeakPolarHBondContact CB-ND1 3.48Å; C222-H247 PolarHBondContact SG-ND1 2.81Å; C225-H247 PolarHBondContact SG-CE1 3.39Å; C225-H247 PolarHBondContact SG-ND1 2.81Å; R228-H247 PolarHBondContact O-NE2 2.82Å; Q234-H247 PolarHBondContact OE1-CD2 3.48Å; Q234-H247 PolarHBondContact OE1-NE2 3.24Å; H247-G249 PolarHBondContact O-N 3.13Å; H247-C250 HydrophobicContact CB-CB 4.02Å; H247-C250 WeakPolarHBondContact O-CB 3.28Å; H247-C250 PolarHBondContact O-N 2.71Å; H247-I251 PolarHBondContact O-N 3.03Å
248	D	68.1	Low	65.3	Low	80 Å²	80	79.1 Å²	79.1	43%	0.428	44%	0.438	S	S	.	.	H	α-helix	trans	-50.8	-45	177	177.2	34.8	0	0	0	112.7	G235 L237 C250 I251 S252	G235-D248 WeakPolarHBondContact O-CB 3.45Å; G235-D248 PolarHBondContact O-N 3.45Å; L237-D248 HydrophobicContact CD1-CB 4.2Å; L237-D248 WeakPolarHBondContact CD1-OD1 3.2Å; L237-D248 HydrophobicContact CG-CB 4.41Å; D248-C250 VanDerWaalsContact C-N 3.35Å; D248-C250 PolarHBondContact O-N 2.98Å; D248-I251 VanDerWaalsContact O-CG2 3.3Å; D248-I251 WeakPolarHBondContact O-CG2 3.45Å; D248-S252 VanDerWaalsContact O-CB 3.31Å; D248-S252 WeakPolarHBondContact O-CB 3.35Å; D248-S252 PolarHBondContact O-N 2.88Å; D248-S252 PolarHBondContact O-OG 2.84Å
249	G	73.6	Confident	66.1	Low	41 Å²	41	76.9 Å²	76.9	42%	0.423	43%	0.425	S	S	.	.	H	α-helix	trans	-65.5	-33.2	175.9	0	0	0	0	0	114.1	H247 Q253	H247-G249 PolarHBondContact O-N 3.13Å; G249-Q253 VanDerWaalsContact O-CG 3.28Å; G249-Q253 WeakPolarHBondContact O-CG 3.48Å; G249-Q253 PolarHBondContact O-N 2.77Å
250	C	74.8	Confident	66.9	Low	15 Å²	15	77 Å²	77	10%	0.101	43%	0.425	C	S	.	.	H	α-helix	trans	-72.8	-44.9	179.5	-75.1	0	0	0	0	111.6	V224 C225 H247 D248 S252 Q253 V254	V224-C250 HydrophobicContact CB-CB 3.91Å; V224-C250 HydrophobicContact CG1-CB 3.89Å; C225-C250 PolarHBondContact SG-SG 3.4Å; H247-C250 HydrophobicContact CB-CB 4.02Å; H247-C250 WeakPolarHBondContact O-CB 3.28Å; H247-C250 PolarHBondContact O-N 2.71Å; D248-C250 VanDerWaalsContact C-N 3.35Å; D248-C250 PolarHBondContact O-N 2.98Å; C250-S252 VanDerWaalsContact C-N 3.31Å; C250-Q253 PolarHBondContact O-N 2.83Å; C250-V254 WeakPolarHBondContact O-CG2 3.33Å; C250-V254 PolarHBondContact O-N 2.89Å
251	I	72.2	Confident	67.6	Low	31 Å²	31	72.3 Å²	72.3	16%	0.159	40%	0.404	C	S	.	.	H	α-helix	trans	-69.8	-33	179.6	-169.6	63.3	0	0	0	111.5	L237 T239 F246 H247 D248 Q253 V254	L237-I251 HydrophobicContact CB-CG2 3.79Å; L237-I251 HydrophobicContact CD1-CG2 3.47Å; L237-I251 VanDerWaalsContact CD1-CG2 3.47Å; L237-I251 HydrophobicContact CG-CG2 4.27Å; T239-I251 HydrophobicContact CG2-CD1 3.94Å; T239-I251 HydrophobicContact CG2-CG1 4.23Å; F246-I251 HydrophobicContact CB-CB 4.03Å; F246-I251 HydrophobicContact CD2-CD1 4.28Å; F246-I251 HydrophobicContact CG-CB 4.43Å; F246-I251 HydrophobicContact CG-CD1 4.4Å; H247-I251 PolarHBondContact O-N 3.03Å; D248-I251 VanDerWaalsContact O-CG2 3.3Å; D248-I251 WeakPolarHBondContact O-CG2 3.45Å; I251-Q253 PolarHBondContact O-N 2.83Å; I251-V254 PolarHBondContact O-N 2.87Å; I251-V254 VanDerWaalsContact O-N 3.14Å
252	S	71.8	Confident	68.1	Low	88 Å²	88	66.2 Å²	66.2	62%	0.615	38%	0.375	S	S	*	.	H	α-helix	trans	-66.4	-24.7	175.8	-64.4	0	0	0	0	113.4	D248 C250	D248-S252 VanDerWaalsContact O-CB 3.31Å; D248-S252 WeakPolarHBondContact O-CB 3.35Å; D248-S252 PolarHBondContact O-N 2.88Å; D248-S252 PolarHBondContact O-OG 2.84Å; C250-S252 VanDerWaalsContact C-N 3.31Å
253	Q	72.9	Confident	68.2	Low	155 Å²	155	71.6 Å²	71.6	72%	0.724	39%	0.39	S	S	*	.	H	α-helix	trans	-83.1	-15.9	175.2	-72.9	174.4	19.3	0	0	113.1	G249 C250 I251 E255	G249-Q253 VanDerWaalsContact O-CG 3.28Å; G249-Q253 WeakPolarHBondContact O-CG 3.48Å; G249-Q253 PolarHBondContact O-N 2.77Å; C250-Q253 PolarHBondContact O-N 2.83Å; I251-Q253 PolarHBondContact O-N 2.83Å; Q253-E255 PolarHBondContact O-N 3.22Å
254	V	68.8	Low	67.8	Low	41 Å²	41	73.7 Å²	73.7	25%	0.248	39%	0.39	C	S	.	.			trans	-79.6	114	176.2	177.9	0	0	0	0	108.2	V224 C250 I251 D256 P260	V224-V254 HydrophobicContact CG1-CG2 4.46Å; V224-V254 HydrophobicContact CG2-CG2 4.32Å; C250-V254 WeakPolarHBondContact O-CG2 3.33Å; C250-V254 PolarHBondContact O-N 2.89Å; I251-V254 PolarHBondContact O-N 2.87Å; I251-V254 VanDerWaalsContact O-N 3.14Å; V254-D256 HydrophobicContact CG1-CB 4.11Å; V254-D256 PolarHBondContact O-N 3.23Å; V254-P260 HydrophobicContact CG1-CG 4.2Å; V254-P260 HydrophobicContact CG2-CG 4.15Å
255	E	65	Low	66.9	Low	195 Å²	195	75.5 Å²	75.5	91%	0.911	41%	0.405	S	S	*	.			trans	-68.3	-23.9	179.5	-62.5	-179.1	173.7	0	0	112.8	Q253	Q253-E255 PolarHBondContact O-N 3.22Å
256	D	64.7	Low	66	Low	78 Å²	78	81.2 Å²	81.2	42%	0.417	43%	0.429	S	S	.	.			trans	-79.6	137.3	-176.9	-71	-27.6	0	0	0	112.3	V254 I258 R263	V254-D256 HydrophobicContact CG1-CB 4.11Å; V254-D256 PolarHBondContact O-N 3.23Å; D256-I258 PolarHBondContact O-N 2.73Å; D256-R263 IonicContact OD2-CZ 3.87Å; D256-R263 IonicContact OD2-NH1 3.76Å; D256-R263 PolarHBondContact OD2-NH1 2.85Å
257	T	65.5	Low	64.9	Low	150 Å²	150	83.6 Å²	83.6	92%	0.92	45%	0.445	S	S	*	.	S	Bend	trans	-73.5	-5.2	170	57.2	0	0	0	0	113.2
258	I	64.4	Low	64	Low	92 Å²	92	85.1 Å²	85.1	47%	0.472	46%	0.456	S	S	.	.	S	Bend	trans	-92.8	127.8	-179.4	-52	174.6	0	0	0	108.1	D256 P260 R263	D256-I258 PolarHBondContact O-N 2.73Å; I258-P260 WeakPolarHBondContact O-CD 3.47Å; I258-R263 HydrophobicContact CG2-CB 3.84Å; I258-R263 HydrophobicContact CG2-CG 4.49Å
259	C	67.3	Low	63.4	Low	15 Å²	15	89.4 Å²	89.4	10%	0.101	47%	0.474	C	S	.	.			trans	-52.7	124.5	173	172.1	0	0	0	0	110.4	C242 H244 V261 C262 R263	C242-C259 VanDerWaalsContact SG-CB 3.53Å; C242-C259 PolarHBondContact SG-SG 3.37Å; H244-C259 PolarHBondContact ND1-SG 3.06Å; C259-V261 PolarHBondContact O-N 2.91Å; C259-V261 VanDerWaalsContact O-N 3.11Å; C259-V261 PolarHBondContact SG-N 2.97Å; C259-C262 HydrophobicContact CB-CB 3.93Å; C259-C262 PolarHBondContact O-N 3.4Å; C259-R263 WeakPolarHBondContact O-CB 3.33Å; C259-R263 PolarHBondContact O-N 3.5Å
260	P	68.4	Low	62.6	Low	31 Å²	31	91.9 Å²	91.9	20%	0.201	48%	0.475	C	S	.	.	H	α-helix	trans	-53.2	-35.2	179.4	-28.7	33.8	0	0	0	113.3	V224 F246 V254 I258 Y264	V224-P260 HydrophobicContact CG2-CG 4.14Å; F246-P260 HydrophobicContact CE1-CB 4.28Å; F246-P260 HydrophobicContact CE1-CG 3.99Å; F246-P260 HydrophobicContact CZ-CG 4.33Å; V254-P260 HydrophobicContact CG1-CG 4.2Å; V254-P260 HydrophobicContact CG2-CG 4.15Å; I258-P260 WeakPolarHBondContact O-CD 3.47Å; P260-Y264 WeakPolarHBondContact O-CD2 3.41Å
261	V	65.7	Low	62.1	Low	48 Å²	48	96.8 Å²	96.8	29%	0.291	50%	0.5	S	S	.	.	H	α-helix	trans	-74.2	-43	179.1	-173.4	0	0	0	0	111.3	P223 H244 F246 C259 Y264	P223-V261 HydrophobicContact CB-CG2 3.96Å; P223-V261 HydrophobicContact CG-CG2 3.76Å; H244-V261 HydrophobicContact CB-CB 4.4Å; H244-V261 HydrophobicContact CB-CG2 4.18Å; H244-V261 VanDerWaalsContact NE2-CG1 3.26Å; H244-V261 WeakPolarHBondContact NE2-CG1 3.34Å; F246-V261 HydrophobicContact CE1-CG2 4.17Å; F246-V261 HydrophobicContact CZ-CG2 3.91Å; C259-V261 PolarHBondContact O-N 2.91Å; C259-V261 VanDerWaalsContact O-N 3.11Å; C259-V261 PolarHBondContact SG-N 2.97Å; V261-Y264 PolarHBondContact O-N 2.88Å
262	C	63.7	Low	61.8	Low	49 Å²	49	101 Å²	101	33%	0.331	53%	0.532	S	S	.	.	H	α-helix	trans	-70.9	-32	178.9	-66.8	0	0	0	0	112.9	C242 H244 C259 Y264 V265	C242-C262 WeakPolarHBondContact CB-SG 3.46Å; H244-C262 PolarHBondContact CE1-SG 3.13Å; C259-C262 HydrophobicContact CB-CB 3.93Å; C259-C262 PolarHBondContact O-N 3.4Å; C262-Y264 PolarHBondContact O-N 2.84Å; C262-V265 PolarHBondContact O-N 2.89Å
263	R	64.2	Low	61.7	Low	150 Å²	150	101.9 Å²	101.9	57%	0.566	53%	0.53	S	S	*	.	H	α-helix	trans	-57.3	-36.4	175.6	-176.4	175.2	173.6	-174.7	-5.9	111.2	D256 I258 C259	D256-R263 IonicContact OD2-CZ 3.87Å; D256-R263 IonicContact OD2-NH1 3.76Å; D256-R263 PolarHBondContact OD2-NH1 2.85Å; I258-R263 HydrophobicContact CG2-CB 3.84Å; I258-R263 HydrophobicContact CG2-CG 4.49Å; C259-R263 WeakPolarHBondContact O-CB 3.33Å; C259-R263 PolarHBondContact O-N 3.5Å
264	Y	52.1	Low	61.8	Low	173 Å²	173	95.6 Å²	95.6	68%	0.678	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	16.2	-177.9	-86.8	-78.8	0	0	0	114.4	P260 V261 C262 Q266	P260-Y264 WeakPolarHBondContact O-CD2 3.41Å; V261-Y264 PolarHBondContact O-N 2.88Å; C262-Y264 PolarHBondContact O-N 2.84Å; Y264-Q266 WeakPolarHBondContact O-CG 3.28Å; Y264-Q266 PolarHBondContact O-N 2.78Å
265	V	50.3	Low	62.5	Low	100 Å²	100	97.2 Å²	97.2	61%	0.606	51%	0.508	S	S	*	.			trans	-62.8	98.5	164.1	178.9	0	0	0	0	106.9	C262 S267	C262-V265 PolarHBondContact O-N 2.89Å; V265-S267 PolarHBondContact O-N 3.33Å
266	Q	48.8	Very low	63.6	Low	162 Å²	162	88 Å²	88	76%	0.757	47%	0.465	S	S	*	.			trans	-59.6	93.6	-172.7	-61.8	175.7	2	0	0	108.8	Y264 P268	Y264-Q266 WeakPolarHBondContact O-CG 3.28Å; Y264-Q266 PolarHBondContact O-N 2.78Å; Q266-P268 VanDerWaalsContact O-CD 3.28Å; Q266-P268 WeakPolarHBondContact O-CD 3.26Å
267	S	48.7	Very low	64.5	Low	49 Å²	49	87.5 Å²	87.5	34%	0.343	47%	0.472	S	S	.	.			trans	-68.3	110.2	138.4	140.4	0	0	0	0	103	V265 E269	V265-S267 PolarHBondContact O-N 3.33Å; S267-E269 PolarHBondContact O-N 3.33Å
268	P	53.1	Low	65.5	Low	45 Å²	45	84.7 Å²	84.7	29%	0.292	45%	0.451	S	S	.	.			trans	-55.1	112.4	173.1	-13.3	26.2	0	0	0	105.5	Q266 M270 L319	Q266-P268 VanDerWaalsContact O-CD 3.28Å; Q266-P268 WeakPolarHBondContact O-CD 3.26Å; P268-M270 PolarHBondContact O-N 3.38Å; P268-L319 HydrophobicContact CB-CD2 3.86Å; P268-L319 HydrophobicContact CG-CD2 3.72Å
269	E	55.4	Low	66.6	Low	170 Å²	170	81.2 Å²	81.2	79%	0.794	44%	0.435	S	S	*	.			trans	-54.6	131.7	171.4	-80.7	-171.5	155.2	0	0	106.1	S267 L271	S267-E269 PolarHBondContact O-N 3.33Å; E269-L271 VanDerWaalsContact C-N 3.29Å; E269-L271 PolarHBondContact O-N 3.15Å
270	M	56	Low	67.4	Low	92 Å²	92	87 Å²	87	45%	0.453	47%	0.465	S	S	.	.			trans	-63.4	96.8	179.6	-167.4	-177.8	-68.5	0	0	107.2	P268 L319	P268-M270 PolarHBondContact O-N 3.38Å; M270-L319 HydrophobicContact CE-CB 4.13Å; M270-L319 VanDerWaalsContact CE-O 3.27Å; M270-L319 WeakPolarHBondContact CE-O 3.38Å
271	L	64.3	Low	68.2	Low	119 Å²	119	87.8 Å²	87.8	62%	0.623	47%	0.467	S	S	*	.			trans	-60.3	144.5	175.4	-70	168.6	0	0	0	107.8	E269 D273 S274	E269-L271 VanDerWaalsContact C-N 3.29Å; E269-L271 PolarHBondContact O-N 3.15Å; L271-D273 WeakPolarHBondContact CB-OD1 3.31Å; L271-D273 PolarHBondContact O-N 2.74Å; L271-S274 PolarHBondContact N-OG 3.1Å; L271-S274 VanDerWaalsContact N-OG 3.13Å; L271-S274 VanDerWaalsContact O-CB 3.22Å; L271-S274 WeakPolarHBondContact O-CB 3.36Å; L271-S274 PolarHBondContact O-N 3.47Å; L271-S274 PolarHBondContact O-OG 2.87Å
272	S	65.9	Low	68.9	Low	118 Å²	118	91.7 Å²	91.7	83%	0.825	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-13.4	-177.8	53.1	0	0	0	0	114.6	R282	S272-R282 PolarHBondContact O-NH1 2.9Å
273	D	71.5	Confident	69.8	Low	107 Å²	107	96.4 Å²	96.4	57%	0.572	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-1.6	174.2	79.1	-17.6	0	0	0	114	L271 Q275	L271-D273 WeakPolarHBondContact CB-OD1 3.31Å; L271-D273 PolarHBondContact O-N 2.74Å; D273-Q275 PolarHBondContact O-N 2.95Å; D273-Q275 VanDerWaalsContact O-N 3.1Å
274	S	75	Confident	70.7	Confident	23 Å²	23	92.5 Å²	92.5	16%	0.161	48%	0.484	C	S	.	.			trans	-60.9	117.1	-177.3	-59.4	0	0	0	0	109.4	L271 L285	L271-S274 PolarHBondContact N-OG 3.1Å; L271-S274 VanDerWaalsContact N-OG 3.13Å; L271-S274 VanDerWaalsContact O-CB 3.22Å; L271-S274 WeakPolarHBondContact O-CB 3.36Å; L271-S274 PolarHBondContact O-N 3.47Å; L271-S274 PolarHBondContact O-OG 2.87Å; S274-L285 WeakPolarHBondContact O-CD1 3.25Å
275	Q	83.6	Confident	72.3	Confident	75 Å²	75	84.3 Å²	84.3	35%	0.35	45%	0.452	S	S	.	.			trans	-139.1	159.3	176.2	61.4	178.8	63.7	0	0	109.9	D273 I281 R282	D273-Q275 PolarHBondContact O-N 2.95Å; D273-Q275 VanDerWaalsContact O-N 3.1Å; Q275-I281 WeakPolarHBondContact CA-O 3.26Å; Q275-R282 HydrophobicContact CB-CG 4.03Å
276	C	86.7	Confident	74.2	Confident	1 Å²	1	80.6 Å²	80.6	1%	0.007	43%	0.427	C	S	.	.			trans	-62.7	140	173.7	177.3	0	0	0	0	110	D278 C279 I281 L285 V294 C296 H303	C276-D278 PolarHBondContact O-N 2.91Å; C276-C279 CarbonylContact C-O 3.54Å; C276-C279 VanDerWaalsContact CB-O 3.32Å; C276-C279 WeakPolarHBondContact CB-O 3.33Å; C276-C279 VanDerWaalsContact SG-SG 3.69Å; C276-I281 PolarHBondContact N-O 2.66Å; C276-L285 HydrophobicContact CB-CD2 3.97Å; C276-V294 WeakPolarHBondContact CA-O 3.42Å; C276-C296 HydrophobicContact CB-CB 4.13Å; C276-C296 PolarHBondContact SG-N 3.45Å; C276-H303 PolarHBondContact SG-ND1 3.07Å
277	A	84.9	Confident	75.9	Confident	69 Å²	69	74.4 Å²	74.4	57%	0.57	40%	0.399	S	S	*	.	S	Bend	trans	-63.5	-30.4	178.9	0	0	0	0	0	112.6	H293 V294	A277-H293 WeakPolarHBondContact CB-CE1 3.33Å; A277-V294 PolarHBondContact N-O 3.39Å
278	D	86.1	Confident	77.7	Confident	90 Å²	90	72.3 Å²	72.3	48%	0.481	38%	0.384	S	S	.	.	S	Bend	trans	-102.5	-10.9	-173.4	-49.5	-60.9	0	0	0	112.9	C276 H293 H303	C276-D278 PolarHBondContact O-N 2.91Å; D278-H293 IonicContact OD2-CE1 2.74Å; D278-H293 IonicContact OD2-NE2 3.78Å; D278-H293 PolarHBondContact OD2-NE2 3.09Å; D278-H303 HydrophobicContact CB-CB 4.32Å; D278-H303 WeakPolarHBondContact CB-ND1 3.43Å; D278-H303 IonicContact OD2-CG 3.38Å
279	C	87.3	Confident	79.1	Confident	19 Å²	19	74.8 Å²	74.8	13%	0.128	40%	0.395	C	S	.	.	S	Bend	trans	-155.6	165.1	174.5	64.2	0	0	0	0	114.1	C276 I281 Q301 H303	C276-C279 CarbonylContact C-O 3.54Å; C276-C279 VanDerWaalsContact CB-O 3.32Å; C276-C279 WeakPolarHBondContact CB-O 3.33Å; C276-C279 VanDerWaalsContact SG-SG 3.69Å; C279-I281 PolarHBondContact O-N 3.4Å; C279-Q301 PolarHBondContact SG-NE2 3.46Å; C279-Q301 VanDerWaalsContact SG-NE2 3.36Å; C279-H303 VanDerWaalsContact SG-CE1 3.52Å; C279-H303 PolarHBondContact SG-ND1 2.98Å
280	D	83	Confident	80.2	Confident	138 Å²	138	70.6 Å²	70.6	74%	0.738	38%	0.377	S	S	*	.	S	Bend	trans	-77.2	19.4	-177.8	-62.8	-41.5	0	0	0	115.1
281	I	85.8	Confident	81.4	Confident	47 Å²	47	69 Å²	69	24%	0.241	37%	0.374	C	S	.	.			trans	-74.4	132.1	175.1	-63.5	175.5	0	0	0	109	Q275 C276 C279 E283 L285 C296 Q301	Q275-I281 WeakPolarHBondContact CA-O 3.26Å; C276-I281 PolarHBondContact N-O 2.66Å; C279-I281 PolarHBondContact O-N 3.4Å; I281-E283 VanDerWaalsContact CG2-O 3.22Å; I281-E283 WeakPolarHBondContact CG2-O 3.32Å; I281-L285 WeakPolarHBondContact O-CD2 3.12Å; I281-C296 HydrophobicContact CB-CB 4.22Å; I281-C296 HydrophobicContact CD1-CB 4.12Å; I281-C296 HydrophobicContact CG2-CB 4.13Å; I281-Q301 HydrophobicContact CD1-CG 4.2Å
282	R	81.4	Confident	82.3	Confident	129 Å²	129	65.3 Å²	65.3	49%	0.487	37%	0.365	S	S	.	.			trans	-111.1	-5.3	178	-61.5	-171.7	174.9	-149.2	-7.3	114.3	S272 Q275	S272-R282 PolarHBondContact O-NH1 2.9Å; Q275-R282 HydrophobicContact CB-CG 4.03Å
283	E	82.2	Confident	83.2	Confident	148 Å²	148	62 Å²	62	69%	0.692	34%	0.336	S	S	*	.	S	Bend	trans	-109.6	153.6	-179.1	-64.3	-173.5	177.3	0	0	111.5	I281 L285	I281-E283 VanDerWaalsContact CG2-O 3.22Å; I281-E283 WeakPolarHBondContact CG2-O 3.32Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.37Å
284	N	82.5	Confident	84	Confident	69 Å²	69	58.5 Å²	58.5	37%	0.369	32%	0.318	S	S	.	.	S	Bend	trans	50.7	50.8	-178.8	-61.9	-55.2	0	0	0	112.4	G297	N284-G297 PolarHBondContact O-N 3.28Å
285	L	86.9	Confident	84.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	139.7	178.3	-62.9	177.2	0	0	0	110.7	S274 C276 I281 E283 V294 L319	S274-L285 WeakPolarHBondContact O-CD1 3.25Å; C276-L285 HydrophobicContact CB-CD2 3.97Å; I281-L285 WeakPolarHBondContact O-CD2 3.12Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.37Å; L285-V294 HydrophobicContact CB-CG1 4.06Å; L285-V294 HydrophobicContact CD1-CG1 4.31Å; L285-V294 HydrophobicContact CD2-CG1 4.22Å; L285-V294 HydrophobicContact CG-CG1 4.44Å; L285-L319 HydrophobicContact CB-CB 4.25Å; L285-L319 HydrophobicContact CB-CD1 3.72Å; L285-L319 HydrophobicContact CB-CG 4.23Å; L285-L319 HydrophobicContact CD1-CD1 4.25Å; L285-L319 PolarHBondContact O-N 3.06Å
286	W	88.2	Confident	84.9	Confident	22 Å²	22	53.9 Å²	53.9	8%	0.083	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	125.6	-179.9	-67.7	75.4	0	0	0	108.4	V294 G295 A304 A316 L317 E318 W325 Y332	W286-V294 WeakPolarHBondContact O-CA 3.42Å; W286-G295 PolarHBondContact N-O 3.24Å; W286-G295 PolarHBondContact O-N 2.79Å; W286-A304 HydrophobicContact CB-CB 3.8Å; W286-A304 HydrophobicContact CG-CB 4.44Å; W286-A316 HydrophobicContact CB-CB 4.31Å; W286-A316 HydrophobicContact CE3-CB 4.21Å; W286-L317 CarbonylContact C-O 3.56Å; W286-L317 VanDerWaalsContact CA-O 3.32Å; W286-L317 WeakPolarHBondContact CA-O 3.23Å; W286-E318 HydrophobicContact CD2-CB 4.05Å; W286-E318 HydrophobicContact CD2-CG 4.3Å; W286-E318 HydrophobicContact CE3-CB 3.9Å; W286-E318 HydrophobicContact CH2-CB 3.7Å; W286-E318 HydrophobicContact CH2-CG 4.19Å; W286-E318 HydrophobicContact CZ2-CB 3.83Å; W286-E318 HydrophobicContact CZ2-CG 3.8Å; W286-E318 HydrophobicContact CZ3-CB 3.71Å; W286-W325 HydrophobicContact CE3-CB 4.09Å; W286-W325 HydrophobicContact CH2-CB 3.91Å; W286-W325 HydrophobicContact CZ3-CB 3.36Å; W286-W325 HydrophobicContact CZ3-CG 4.4Å; W286-Y332 AromaticContact CH2-CE1 3.99Å; W286-Y332 HydrophobicContact CH2-CE1 3.99Å
287	I	86	Confident	84.7	Confident	33 Å²	33	53.9 Å²	53.9	17%	0.169	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.1	176.4	-171.9	168.1	0	0	0	109.5	L289 H293 V294 A316 L317 L319	I287-L289 PolarHBondContact O-N 2.78Å; I287-H293 CarbonylContact C-O 3.5Å; I287-H293 WeakPolarHBondContact CA-O 3.39Å; I287-V294 HydrophobicContact CB-CG2 4.28Å; I287-V294 HydrophobicContact CD1-CG2 4.23Å; I287-V294 HydrophobicContact CG1-CG2 4.08Å; I287-A316 CarbonylContact O-C 3.52Å; I287-A316 VanDerWaalsContact O-CA 3.27Å; I287-A316 WeakPolarHBondContact O-CA 3.49Å; I287-L317 HydrophobicContact CG2-CB 3.98Å; I287-L317 HydrophobicContact CG2-CD2 4.4Å; I287-L317 PolarHBondContact N-O 3.46Å; I287-L317 PolarHBondContact O-N 2.9Å; I287-L319 HydrophobicContact CB-CD2 3.98Å; I287-L319 HydrophobicContact CB-CG 4.36Å; I287-L319 HydrophobicContact CG2-CD2 3.6Å; I287-L319 HydrophobicContact CG2-CG 4.29Å
288	C	86.5	Confident	84.3	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.034	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	125	172.4	178.4	0	0	0	0	109.8	I290 C291 G292 H293 H307 H313	C288-I290 PolarHBondContact O-N 3.43Å; C288-C291 VanDerWaalsContact SG-SG 3.68Å; C288-G292 VanDerWaalsContact O-CA 3.23Å; C288-G292 WeakPolarHBondContact O-CA 3.35Å; C288-G292 PolarHBondContact O-N 2.87Å; C288-H293 HydrophobicContact CB-CB 4.32Å; C288-H293 PolarHBondContact N-O 3Å; C288-H307 PolarHBondContact SG-NE2 2.87Å; C288-H307 VanDerWaalsContact SG-NE2 3.4Å; C288-H313 WeakPolarHBondContact SG-CB 3.38Å
289	L	81.6	Confident	83.8	Confident	97 Å²	97	61 Å²	61	51%	0.508	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-14.3	-178.3	-68.1	-179.5	0	0	0	113.5	I287 F315 L317 V324	I287-L289 PolarHBondContact O-N 2.78Å; L289-F315 HydrophobicContact CB-CB 4.3Å; L289-F315 HydrophobicContact CD1-CB 4.29Å; L289-F315 PolarHBondContact N-O 3.39Å; L289-L317 HydrophobicContact CD1-CB 4.35Å; L289-L317 HydrophobicContact CD2-CB 3.76Å; L289-L317 HydrophobicContact CD2-CD2 4.29Å; L289-L317 HydrophobicContact CG-CB 4.09Å; L289-V324 HydrophobicContact CD1-CG1 3.92Å; L289-V324 HydrophobicContact CD1-CG2 4.06Å
290	I	79	Confident	83.2	Confident	81 Å²	81	61.7 Å²	61.7	42%	0.415	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-41.1	-177.3	-57.8	166.8	0	0	0	111.1	C288 H313 F315	C288-I290 PolarHBondContact O-N 3.43Å; I290-H313 HydrophobicContact CB-CB 4.23Å; I290-H313 VanDerWaalsContact CB-CD2 3.49Å; I290-H313 WeakPolarHBondContact CB-CD2 3.31Å; I290-H313 HydrophobicContact CD1-CB 3.79Å; I290-H313 HydrophobicContact CG1-CB 4.48Å; I290-H313 WeakPolarHBondContact CG2-CD2 3.25Å; I290-H313 WeakPolarHBondContact CG2-NE2 3.39Å; I290-F315 HydrophobicContact CD1-CD2 4.39Å
291	C	82.1	Confident	83.1	Confident	60 Å²	60	60.7 Å²	60.7	41%	0.405	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	-4.3	-175.7	73.3	0	0	0	0	115.4	C288 H293 H307 H313	C288-C291 VanDerWaalsContact SG-SG 3.68Å; C291-H293 VanDerWaalsContact C-N 3.34Å; C291-H293 PolarHBondContact O-N 2.79Å; C291-H307 PolarHBondContact SG-CE1 3.37Å; C291-H307 PolarHBondContact SG-NE2 2.92Å; C291-H313 VanDerWaalsContact CB-CE1 3.46Å; C291-H313 WeakPolarHBondContact CB-CE1 3.38Å; C291-H313 PolarHBondContact SG-ND1 3.04Å; C291-H313 VanDerWaalsContact SG-ND1 3.43Å
292	G	82.5	Confident	83.2	Confident	41 Å²	41	63.3 Å²	63.3	42%	0.423	31%	0.312	S	S	.	.			trans	77.5	8.8	179.3	0	0	0	0	0	116	C288	C288-G292 VanDerWaalsContact O-CA 3.23Å; C288-G292 WeakPolarHBondContact O-CA 3.35Å; C288-G292 PolarHBondContact O-N 2.87Å
293	H	85	Confident	83.5	Confident	49 Å²	49	58.6 Å²	58.6	23%	0.227	30%	0.296	C	S	.	.			trans	-65	133.8	176	-171.5	75.8	0	0	0	111.2	A277 D278 I287 C288 C291 H307	A277-H293 WeakPolarHBondContact CB-CE1 3.33Å; D278-H293 IonicContact OD2-CE1 2.74Å; D278-H293 IonicContact OD2-NE2 3.78Å; D278-H293 PolarHBondContact OD2-NE2 3.09Å; I287-H293 CarbonylContact C-O 3.5Å; I287-H293 WeakPolarHBondContact CA-O 3.39Å; C288-H293 HydrophobicContact CB-CB 4.32Å; C288-H293 PolarHBondContact N-O 3Å; C291-H293 VanDerWaalsContact C-N 3.34Å; C291-H293 PolarHBondContact O-N 2.79Å; H293-H307 VanDerWaalsContact CB-CE1 3.46Å; H293-H307 WeakPolarHBondContact CB-CE1 3.3Å; H293-H307 AromaticContact CD2-CG 3.66Å; H293-H307 AromaticContact CD2-ND1 3.51Å; H293-H307 AromaticContact CG-CE1 3.93Å; H293-H307 AromaticContact CG-ND1 3.59Å
294	V	87.6	Confident	83.7	Confident	32 Å²	32	51.8 Å²	51.8	19%	0.194	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	108.9	179.7	-178	0	0	0	0	110.1	C276 A277 L285 W286 I287 L319	C276-V294 WeakPolarHBondContact CA-O 3.42Å; A277-V294 PolarHBondContact N-O 3.39Å; L285-V294 HydrophobicContact CB-CG1 4.06Å; L285-V294 HydrophobicContact CD1-CG1 4.31Å; L285-V294 HydrophobicContact CD2-CG1 4.22Å; L285-V294 HydrophobicContact CG-CG1 4.44Å; W286-V294 WeakPolarHBondContact O-CA 3.42Å; I287-V294 HydrophobicContact CB-CG2 4.28Å; I287-V294 HydrophobicContact CD1-CG2 4.23Å; I287-V294 HydrophobicContact CG1-CG2 4.08Å; V294-L319 HydrophobicContact CG1-CD1 4.07Å
295	G	89.2	Confident	83.9	Confident	1 Å²	1	51 Å²	51	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	152	179.2	0	0	0	0	0	112.7	W286	W286-G295 PolarHBondContact N-O 3.24Å; W286-G295 PolarHBondContact O-N 2.79Å
296	C	88.2	Confident	83.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	144.7	169.2	64.7	0	0	0	0	111.3	C276 I281 Q301 K302 H303 A304	C276-C296 HydrophobicContact CB-CB 4.13Å; C276-C296 PolarHBondContact SG-N 3.45Å; I281-C296 HydrophobicContact CB-CB 4.22Å; I281-C296 HydrophobicContact CD1-CB 4.12Å; I281-C296 HydrophobicContact CG2-CB 4.13Å; C296-Q301 PolarHBondContact SG-N 3.21Å; C296-K302 CarbonylContact O-C 3.59Å; C296-H303 PolarHBondContact O-N 3.03Å; C296-H303 PolarHBondContact SG-ND1 3.21Å; C296-A304 PolarHBondContact O-N 2.82Å; C296-A304 VanDerWaalsContact O-N 3.17Å
297	G	81.9	Confident	83.9	Confident	2 Å²	2	53.4 Å²	53.4	2%	0.021	28%	0.275	C	S	.	.			trans	-74.4	-171.4	-176.1	0	0	0	0	0	114.9	N284 Y299 G300 K302	N284-G297 PolarHBondContact O-N 3.28Å; G297-Y299 VanDerWaalsContact C-N 3.25Å; G297-Y299 PolarHBondContact O-N 3.31Å; G297-G300 PolarHBondContact O-N 3.36Å; G297-K302 PolarHBondContact O-N 2.77Å
298	R	76.7	Confident	83.9	Confident	89 Å²	89	54.2 Å²	54.2	34%	0.336	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-26.5	-175	-66.7	-178.5	-175.6	-159.9	-8.7	115.7	G300 W325 D330	R298-G300 VanDerWaalsContact C-N 3.3Å; R298-W325 VanDerWaalsContact NH2-NE1 3.15Å; R298-D330 IonicContact CZ-OD1 3.69Å; R298-D330 IonicContact NH1-OD1 3.28Å; R298-D330 PolarHBondContact NH1-OD1 3.18Å; R298-D330 IonicContact NH1-OD2 3.7Å; R298-D330 IonicContact NH2-OD1 3.73Å; R298-D330 PolarHBondContact NH2-OD1 2.65Å
299	Y	75.9	Confident	84	Confident	220 Å²	220	60.1 Å²	60.1	86%	0.863	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-7.6	176.5	-58.5	-72.9	0	0	0	112.9	G297	G297-Y299 VanDerWaalsContact C-N 3.25Å; G297-Y299 PolarHBondContact O-N 3.31Å
300	G	74.8	Confident	84.4	Confident	32 Å²	32	63 Å²	63	33%	0.33	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-137.1	170.3	0	0	0	0	0	111.7	G297 R298 K302	G297-G300 PolarHBondContact O-N 3.36Å; R298-G300 VanDerWaalsContact C-N 3.3Å; G300-K302 VanDerWaalsContact C-N 3.33Å
301	Q	81.9	Confident	84.8	Confident	118 Å²	118	62.1 Å²	62.1	55%	0.551	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	8.9	178.1	-65.3	-176.9	90.6	0	0	113.8	C279 I281 C296 H303	C279-Q301 PolarHBondContact SG-NE2 3.46Å; C279-Q301 VanDerWaalsContact SG-NE2 3.36Å; I281-Q301 HydrophobicContact CD1-CG 4.2Å; C296-Q301 PolarHBondContact SG-N 3.21Å; Q301-H303 VanDerWaalsContact C-N 3.27Å; Q301-H303 PolarHBondContact O-N 2.86Å
302	K	86.2	Confident	85.1	Confident	101 Å²	101	61.7 Å²	61.7	44%	0.439	32%	0.319	S	S	.	.			trans	60.8	26.4	176.6	-63.2	171.1	179.5	-170.8	0	115	C296 G297 G300 A304 Q305 V306	C296-K302 CarbonylContact O-C 3.59Å; G297-K302 PolarHBondContact O-N 2.77Å; G300-K302 VanDerWaalsContact C-N 3.33Å; K302-A304 PolarHBondContact O-N 3.04Å; K302-Q305 HydrophobicContact CB-CB 4.27Å; K302-Q305 WeakPolarHBondContact O-CA 3.13Å; K302-Q305 WeakPolarHBondContact O-CB 3.07Å; K302-Q305 PolarHBondContact O-N 3.32Å; K302-V306 PolarHBondContact O-N 2.83Å
303	H	88.7	Confident	85.3	Confident	31 Å²	31	61.5 Å²	61.5	14%	0.144	31%	0.307	C	S	.	.	H	α-helix	trans	-60.7	-28.5	179.3	-66.9	146	0	0	0	113.7	C276 D278 C279 C296 Q301 Q305 V306 H307	C276-H303 PolarHBondContact SG-ND1 3.07Å; D278-H303 HydrophobicContact CB-CB 4.32Å; D278-H303 WeakPolarHBondContact CB-ND1 3.43Å; D278-H303 IonicContact OD2-CG 3.38Å; C279-H303 VanDerWaalsContact SG-CE1 3.52Å; C279-H303 PolarHBondContact SG-ND1 2.98Å; C296-H303 PolarHBondContact O-N 3.03Å; C296-H303 PolarHBondContact SG-ND1 3.21Å; Q301-H303 VanDerWaalsContact C-N 3.27Å; Q301-H303 PolarHBondContact O-N 2.86Å; H303-Q305 VanDerWaalsContact C-N 3.28Å; H303-Q305 PolarHBondContact O-N 2.74Å; H303-V306 PolarHBondContact O-N 2.98Å; H303-H307 VanDerWaalsContact O-CB 3.27Å; H303-H307 WeakPolarHBondContact O-CB 3.3Å; H303-H307 PolarHBondContact O-N 3.38Å
304	A	86.4	Confident	85.3	Confident	5 Å²	5	60.7 Å²	60.7	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-67.5	-29.4	173.3	0	0	0	0	0	112.9	W286 C296 K302 F308 Y327	W286-A304 HydrophobicContact CB-CB 3.8Å; W286-A304 HydrophobicContact CG-CB 4.44Å; C296-A304 PolarHBondContact O-N 2.82Å; C296-A304 VanDerWaalsContact O-N 3.17Å; K302-A304 PolarHBondContact O-N 3.04Å; A304-F308 PolarHBondContact O-N 3.03Å; A304-Y327 HydrophobicContact CB-CE2 4.41Å; A304-Y327 WeakPolarHBondContact CB-OH 3.37Å
305	Q	85.9	Confident	85.1	Confident	53 Å²	53	63 Å²	63	25%	0.248	31%	0.313	C	S	.	.	H	α-helix	trans	-78	-42.8	173	-176.7	-178	-13	0	0	111.4	K302 H303 H307 F308 E309 Y327	K302-Q305 HydrophobicContact CB-CB 4.27Å; K302-Q305 WeakPolarHBondContact O-CA 3.13Å; K302-Q305 WeakPolarHBondContact O-CB 3.07Å; K302-Q305 PolarHBondContact O-N 3.32Å; H303-Q305 VanDerWaalsContact C-N 3.28Å; H303-Q305 PolarHBondContact O-N 2.74Å; Q305-H307 VanDerWaalsContact C-N 3.25Å; Q305-H307 PolarHBondContact O-N 3.02Å; Q305-F308 WeakPolarHBondContact O-CA 3.36Å; Q305-F308 WeakPolarHBondContact O-CB 3.49Å; Q305-F308 PolarHBondContact O-N 2.85Å; Q305-E309 PolarHBondContact NE2-OE1 2.75Å; Q305-E309 PolarHBondContact O-N 2.76Å; Q305-Y327 HydrophobicContact CB-CD1 4.35Å; Q305-Y327 HydrophobicContact CB-CE1 3.82Å; Q305-Y327 HydrophobicContact CG-CD1 4.35Å; Q305-Y327 HydrophobicContact CG-CE1 4.28Å
306	V	88.6	Confident	84.9	Confident	55 Å²	55	63.2 Å²	63.2	33%	0.333	32%	0.315	S	S	.	.	H	α-helix	trans	-57.7	-43.3	174.9	176.6	0	0	0	0	110.2	K302 H303 F308 E309 E310	K302-V306 PolarHBondContact O-N 2.83Å; H303-V306 PolarHBondContact O-N 2.98Å; V306-F308 VanDerWaalsContact C-N 3.32Å; V306-F308 PolarHBondContact O-N 2.92Å; V306-E309 PolarHBondContact O-N 3.08Å; V306-E309 VanDerWaalsContact O-N 3.1Å; V306-E310 HydrophobicContact CG1-CG 4.35Å; V306-E310 WeakPolarHBondContact O-CG 3.5Å; V306-E310 PolarHBondContact O-N 3.11Å
307	H	86.7	Confident	84.8	Confident	17 Å²	17	64 Å²	64	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-56.4	-43.2	173.4	175.1	74.3	0	0	0	112.8	C288 C291 H293 H303 Q305 E310 T311 H313	C288-H307 PolarHBondContact SG-NE2 2.87Å; C288-H307 VanDerWaalsContact SG-NE2 3.4Å; C291-H307 PolarHBondContact SG-CE1 3.37Å; C291-H307 PolarHBondContact SG-NE2 2.92Å; H293-H307 VanDerWaalsContact CB-CE1 3.46Å; H293-H307 WeakPolarHBondContact CB-CE1 3.3Å; H293-H307 AromaticContact CD2-CG 3.66Å; H293-H307 AromaticContact CD2-ND1 3.51Å; H293-H307 AromaticContact CG-CE1 3.93Å; H293-H307 AromaticContact CG-ND1 3.59Å; H303-H307 VanDerWaalsContact O-CB 3.27Å; H303-H307 WeakPolarHBondContact O-CB 3.3Å; H303-H307 PolarHBondContact O-N 3.38Å; Q305-H307 VanDerWaalsContact C-N 3.25Å; Q305-H307 PolarHBondContact O-N 3.02Å; H307-E310 PolarHBondContact O-N 2.74Å; H307-T311 PolarHBondContact CE1-OG1 2.84Å; H307-T311 PolarHBondContact NE2-OG1 2.82Å; H307-T311 WeakPolarHBondContact O-CB 3.22Å; H307-T311 PolarHBondContact O-N 3.34Å; H307-T311 PolarHBondContact O-OG1 2.85Å; H307-H313 AromaticContact CE1-ND1 3.66Å; H307-H313 AromaticContact NE2-CG 3.99Å; H307-H313 AromaticContact NE2-ND1 3.26Å; H307-H313 PolarHBondContact NE2-ND1 2.95Å
308	F	87.7	Confident	84.9	Confident	50 Å²	50	64.5 Å²	64.5	22%	0.219	32%	0.321	C	S	.	.	H	α-helix	trans	-62.2	-44.4	174.1	160.7	-112.8	0	0	0	111.9	A304 Q305 V306 E310 G312 H313 T314 Y327	A304-F308 PolarHBondContact O-N 3.03Å; Q305-F308 WeakPolarHBondContact O-CA 3.36Å; Q305-F308 WeakPolarHBondContact O-CB 3.49Å; Q305-F308 PolarHBondContact O-N 2.85Å; V306-F308 VanDerWaalsContact C-N 3.32Å; V306-F308 PolarHBondContact O-N 2.92Å; F308-E310 VanDerWaalsContact C-N 3.31Å; F308-E310 PolarHBondContact O-N 3.15Å; F308-G312 WeakPolarHBondContact O-CA 3.35Å; F308-G312 PolarHBondContact O-N 3.48Å; F308-H313 VanDerWaalsContact CD2-O 3.28Å; F308-H313 WeakPolarHBondContact CD2-O 3.14Å; F308-T314 HydrophobicContact CD2-CG2 4.42Å; F308-T314 HydrophobicContact CE2-CG2 3.81Å; F308-Y327 HydrophobicContact CB-CD2 4.02Å; F308-Y327 HydrophobicContact CB-CG 3.95Å; F308-Y327 HydrophobicContact CD1-CD1 4.44Å; F308-Y327 HydrophobicContact CD1-CG 4.12Å; F308-Y327 VanDerWaalsContact CG-CB 3.47Å; F308-Y327 HydrophobicContact CG-CD2 4.42Å; F308-Y327 AromaticContact CG-CG 3.99Å; F308-Y327 HydrophobicContact CG-CG 3.99Å
309	E	88.3	Confident	84.9	Confident	128 Å²	128	60.8 Å²	60.8	60%	0.598	31%	0.307	S	S	*	.	H	α-helix	trans	-64.3	-34.4	179.6	-69.8	172.2	-167.3	0	0	112.3	Q305 V306	Q305-E309 PolarHBondContact NE2-OE1 2.75Å; Q305-E309 PolarHBondContact O-N 2.76Å; V306-E309 PolarHBondContact O-N 3.08Å; V306-E309 VanDerWaalsContact O-N 3.1Å
310	E	89.8	Confident	84.6	Confident	157 Å²	157	52.6 Å²	52.6	73%	0.734	29%	0.29	S	S	*	.	H	α-helix	trans	-83.2	-38.5	180	-69.4	-178.5	170.7	0	0	113.7	V306 H307 F308	V306-E310 HydrophobicContact CG1-CG 4.35Å; V306-E310 WeakPolarHBondContact O-CG 3.5Å; V306-E310 PolarHBondContact O-N 3.11Å; H307-E310 PolarHBondContact O-N 2.74Å; F308-E310 VanDerWaalsContact C-N 3.31Å; F308-E310 PolarHBondContact O-N 3.15Å
311	T	87.9	Confident	84.4	Confident	64 Å²	64	55.9 Å²	55.9	39%	0.393	30%	0.295	S	S	.	.	H	α-helix	trans	-104.8	-16	-172.5	65.3	0	0	0	0	114.3	H307 H313	H307-T311 PolarHBondContact CE1-OG1 2.84Å; H307-T311 PolarHBondContact NE2-OG1 2.82Å; H307-T311 WeakPolarHBondContact O-CB 3.22Å; H307-T311 PolarHBondContact O-N 3.34Å; H307-T311 PolarHBondContact O-OG1 2.85Å; T311-H313 WeakPolarHBondContact CB-ND1 3.11Å; T311-H313 PolarHBondContact O-N 2.52Å; T311-H313 WeakPolarHBondContact OG1-CB 3.17Å; T311-H313 VanDerWaalsContact OG1-CG 3.3Å; T311-H313 PolarHBondContact OG1-N 2.88Å; T311-H313 PolarHBondContact OG1-ND1 3.46Å
312	G	86.9	Confident	83.7	Confident	50 Å²	50	56.1 Å²	56.1	52%	0.515	31%	0.305	S	S	.	.			trans	72.7	9.3	-172.9	0	0	0	0	0	114.2	F308 T314	F308-G312 WeakPolarHBondContact O-CA 3.35Å; F308-G312 PolarHBondContact O-N 3.48Å; G312-T314 PolarHBondContact O-N 3.17Å
313	H	86.8	Confident	83.3	Confident	37 Å²	37	54.6 Å²	54.6	17%	0.171	30%	0.301	C	S	.	.			trans	-76.9	108.1	179.8	-66.1	141.1	0	0	0	112.4	C288 I290 C291 H307 F308 T311	C288-H313 WeakPolarHBondContact SG-CB 3.38Å; I290-H313 HydrophobicContact CB-CB 4.23Å; I290-H313 VanDerWaalsContact CB-CD2 3.49Å; I290-H313 WeakPolarHBondContact CB-CD2 3.31Å; I290-H313 HydrophobicContact CD1-CB 3.79Å; I290-H313 HydrophobicContact CG1-CB 4.48Å; I290-H313 WeakPolarHBondContact CG2-CD2 3.25Å; I290-H313 WeakPolarHBondContact CG2-NE2 3.39Å; C291-H313 VanDerWaalsContact CB-CE1 3.46Å; C291-H313 WeakPolarHBondContact CB-CE1 3.38Å; C291-H313 PolarHBondContact SG-ND1 3.04Å; C291-H313 VanDerWaalsContact SG-ND1 3.43Å; H307-H313 AromaticContact CE1-ND1 3.66Å; H307-H313 AromaticContact NE2-CG 3.99Å; H307-H313 AromaticContact NE2-ND1 3.26Å; H307-H313 PolarHBondContact NE2-ND1 2.95Å; F308-H313 VanDerWaalsContact CD2-O 3.28Å; F308-H313 WeakPolarHBondContact CD2-O 3.14Å; T311-H313 WeakPolarHBondContact CB-ND1 3.11Å; T311-H313 PolarHBondContact O-N 2.52Å; T311-H313 WeakPolarHBondContact OG1-CB 3.17Å; T311-H313 VanDerWaalsContact OG1-CG 3.3Å; T311-H313 PolarHBondContact OG1-N 2.88Å; T311-H313 PolarHBondContact OG1-ND1 3.46Å
314	T	85.1	Confident	82.8	Confident	33 Å²	33	54.5 Å²	54.5	20%	0.202	30%	0.303	C	S	.	.			trans	-77.1	-31.7	-170	58	0	0	0	0	114.2	F308 G312 Y327 A328	F308-T314 HydrophobicContact CD2-CG2 4.42Å; F308-T314 HydrophobicContact CE2-CG2 3.81Å; G312-T314 PolarHBondContact O-N 3.17Å; T314-Y327 WeakPolarHBondContact O-CD2 3.45Å; T314-Y327 PolarHBondContact O-N 3.39Å; T314-A328 HydrophobicContact CG2-CB 3.68Å
315	F	83.7	Confident	82.6	Confident	81 Å²	81	56 Å²	56	36%	0.355	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.7	-170.5	-58	-65.4	0	0	0	113.5	L289 I290 V324 D326	L289-F315 HydrophobicContact CB-CB 4.3Å; L289-F315 HydrophobicContact CD1-CB 4.29Å; L289-F315 PolarHBondContact N-O 3.39Å; I290-F315 HydrophobicContact CD1-CD2 4.39Å; F315-V324 HydrophobicContact CB-CG1 4.47Å; F315-D326 HydrophobicContact CD1-CB 4.12Å; F315-D326 HydrophobicContact CE1-CB 4.02Å; F315-D326 VanDerWaalsContact CE1-OD2 3.24Å; F315-D326 WeakPolarHBondContact CE1-OD2 3.5Å
316	A	84.5	Confident	82.5	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.033	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	138.4	170.9	0	0	0	0	0	112.3	W286 I287 V324 W325 Y327	W286-A316 HydrophobicContact CB-CB 4.31Å; W286-A316 HydrophobicContact CE3-CB 4.21Å; I287-A316 CarbonylContact O-C 3.52Å; I287-A316 VanDerWaalsContact O-CA 3.27Å; I287-A316 WeakPolarHBondContact O-CA 3.49Å; A316-V324 CarbonylContact O-C 3.56Å; A316-V324 WeakPolarHBondContact O-CA 3.38Å; A316-W325 PolarHBondContact N-O 2.86Å; A316-W325 PolarHBondContact O-N 3.32Å; A316-Y327 HydrophobicContact CB-CD2 4.3Å; A316-Y327 HydrophobicContact CB-CE2 3.6Å
317	L	85.7	Confident	82.1	Confident	18 Å²	18	52.6 Å²	52.6	9%	0.094	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	134.7	176.8	175.9	74.5	0	0	0	109.8	W286 I287 L289 L319 V324	W286-L317 CarbonylContact C-O 3.56Å; W286-L317 VanDerWaalsContact CA-O 3.32Å; W286-L317 WeakPolarHBondContact CA-O 3.23Å; I287-L317 HydrophobicContact CG2-CB 3.98Å; I287-L317 HydrophobicContact CG2-CD2 4.4Å; I287-L317 PolarHBondContact N-O 3.46Å; I287-L317 PolarHBondContact O-N 2.9Å; L289-L317 HydrophobicContact CD1-CB 4.35Å; L289-L317 HydrophobicContact CD2-CB 3.76Å; L289-L317 HydrophobicContact CD2-CD2 4.29Å; L289-L317 HydrophobicContact CG-CB 4.09Å; L317-L319 PolarHBondContact O-N 3.28Å; L317-V324 HydrophobicContact CB-CG2 4.35Å; L317-V324 HydrophobicContact CD1-CG2 3.56Å
318	E	84	Confident	81.8	Confident	12 Å²	12	54.6 Å²	54.6	6%	0.056	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	122.4	173	-166.3	178.3	168.9	0	0	110.4	W286 G320 K321 L323	W286-E318 HydrophobicContact CD2-CB 4.05Å; W286-E318 HydrophobicContact CD2-CG 4.3Å; W286-E318 HydrophobicContact CE3-CB 3.9Å; W286-E318 HydrophobicContact CH2-CB 3.7Å; W286-E318 HydrophobicContact CH2-CG 4.19Å; W286-E318 HydrophobicContact CZ2-CB 3.83Å; W286-E318 HydrophobicContact CZ2-CG 3.8Å; W286-E318 HydrophobicContact CZ3-CB 3.71Å; E318-G320 PolarHBondContact O-N 2.98Å; E318-K321 HydrophobicContact CB-CB 4.33Å; E318-K321 CarbonylContact O-C 3.59Å; E318-K321 PolarHBondContact O-N 2.99Å; E318-K321 VanDerWaalsContact O-N 3.11Å; E318-K321 WeakPolarHBondContact OE1-CE 3.45Å; E318-K321 IonicContact OE1-NZ 3.63Å; E318-K321 PolarHBondContact OE1-NZ 2.95Å; E318-K321 WeakPolarHBondContact OE2-CD 3.32Å; E318-K321 IonicContact OE2-NZ 2.7Å; E318-K321 PolarHBondContact OE2-NZ 3.07Å; E318-L323 PolarHBondContact N-O 3.19Å
319	L	77.6	Confident	81.2	Confident	11 Å²	11	57 Å²	57	6%	0.058	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	131	179.4	-70.2	-176.8	0	0	0	111.1	P268 M270 L285 I287 V294 L317 K321	P268-L319 HydrophobicContact CB-CD2 3.86Å; P268-L319 HydrophobicContact CG-CD2 3.72Å; M270-L319 HydrophobicContact CE-CB 4.13Å; M270-L319 VanDerWaalsContact CE-O 3.27Å; M270-L319 WeakPolarHBondContact CE-O 3.38Å; L285-L319 HydrophobicContact CB-CB 4.25Å; L285-L319 HydrophobicContact CB-CD1 3.72Å; L285-L319 HydrophobicContact CB-CG 4.23Å; L285-L319 HydrophobicContact CD1-CD1 4.25Å; L285-L319 PolarHBondContact O-N 3.06Å; I287-L319 HydrophobicContact CB-CD2 3.98Å; I287-L319 HydrophobicContact CB-CG 4.36Å; I287-L319 HydrophobicContact CG2-CD2 3.6Å; I287-L319 HydrophobicContact CG2-CG 4.29Å; V294-L319 HydrophobicContact CG1-CD1 4.07Å; L317-L319 PolarHBondContact O-N 3.28Å; L319-K321 VanDerWaalsContact C-N 3.3Å
320	G	69.1	Low	80.7	Confident	48 Å²	48	55.2 Å²	55.2	50%	0.495	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	-6.9	-175.3	0	0	0	0	0	114.9	E318	E318-G320 PolarHBondContact O-N 2.98Å
321	K	72	Confident	79.9	Confident	100 Å²	100	49.9 Å²	49.9	44%	0.435	30%	0.3	S	S	.	.	S	Bend	trans	-124.1	164.3	172.4	-60.5	-174.1	-163.5	148.4	0	110.4	E318 L319 L323	E318-K321 HydrophobicContact CB-CB 4.33Å; E318-K321 CarbonylContact O-C 3.59Å; E318-K321 PolarHBondContact O-N 2.99Å; E318-K321 VanDerWaalsContact O-N 3.11Å; E318-K321 WeakPolarHBondContact OE1-CE 3.45Å; E318-K321 IonicContact OE1-NZ 3.63Å; E318-K321 PolarHBondContact OE1-NZ 2.95Å; E318-K321 WeakPolarHBondContact OE2-CD 3.32Å; E318-K321 IonicContact OE2-NZ 2.7Å; E318-K321 PolarHBondContact OE2-NZ 3.07Å; L319-K321 VanDerWaalsContact C-N 3.3Å; K321-L323 VanDerWaalsContact C-N 3.27Å; K321-L323 HydrophobicContact CB-CB 4.44Å; K321-L323 HydrophobicContact CB-CG 4.37Å; K321-L323 HydrophobicContact CD-CD1 4.08Å
322	T	66.5	Low	79.2	Confident	124 Å²	124	51.6 Å²	51.6	76%	0.761	30%	0.3	S	S	*	.			trans	-95	19.5	175.3	53.7	0	0	0	0	112.1
323	L	76.5	Confident	78	Confident	69 Å²	69	52.2 Å²	52.2	36%	0.361	29%	0.293	S	S	.	.			trans	-92.1	115.7	-176.4	-65.9	178.4	0	0	0	110.3	E318 K321 Y332	E318-L323 PolarHBondContact N-O 3.19Å; K321-L323 VanDerWaalsContact C-N 3.27Å; K321-L323 HydrophobicContact CB-CB 4.44Å; K321-L323 HydrophobicContact CB-CG 4.37Å; K321-L323 HydrophobicContact CD-CD1 4.08Å; L323-Y332 HydrophobicContact CB-CD1 3.96Å; L323-Y332 HydrophobicContact CB-CE1 3.73Å; L323-Y332 HydrophobicContact CD1-CE1 4.04Å; L323-Y332 HydrophobicContact CD2-CD1 4.41Å; L323-Y332 HydrophobicContact CG-CE1 4.34Å
324	V	79.7	Confident	76.5	Confident	29 Å²	29	57.1 Å²	57.1	18%	0.176	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	129.4	173.6	-179	0	0	0	0	108.7	L289 F315 A316 L317 Y332 V333	L289-V324 HydrophobicContact CD1-CG1 3.92Å; L289-V324 HydrophobicContact CD1-CG2 4.06Å; F315-V324 HydrophobicContact CB-CG1 4.47Å; A316-V324 CarbonylContact O-C 3.56Å; A316-V324 WeakPolarHBondContact O-CA 3.38Å; L317-V324 HydrophobicContact CB-CG2 4.35Å; L317-V324 HydrophobicContact CD1-CG2 3.56Å; V324-Y332 WeakPolarHBondContact O-CA 3.05Å; V324-V333 HydrophobicContact CB-CB 4.19Å; V324-V333 HydrophobicContact CB-CG2 4.26Å; V324-V333 HydrophobicContact CG1-CB 4.42Å; V324-V333 HydrophobicContact CG1-CG2 3.98Å; V324-V333 PolarHBondContact O-N 2.95Å
325	W	81.5	Confident	74.7	Confident	36 Å²	36	66.8 Å²	66.8	14%	0.136	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134	172.2	-170.5	-86.6	0	0	0	109.7	W286 R298 A316 Y327 D330 Y332	W286-W325 HydrophobicContact CE3-CB 4.09Å; W286-W325 HydrophobicContact CH2-CB 3.91Å; W286-W325 HydrophobicContact CZ3-CB 3.36Å; W286-W325 HydrophobicContact CZ3-CG 4.4Å; R298-W325 VanDerWaalsContact NH2-NE1 3.15Å; A316-W325 PolarHBondContact N-O 2.86Å; A316-W325 PolarHBondContact O-N 3.32Å; W325-Y327 AromaticContact CD1-CD1 3.94Å; W325-D330 WeakPolarHBondContact CH2-O 3.11Å; W325-D330 WeakPolarHBondContact CZ2-O 3.42Å; W325-D330 WeakPolarHBondContact CZ2-OD1 2.99Å; W325-Y332 AromaticContact CE3-CD1 3.76Å; W325-Y332 HydrophobicContact CE3-CD1 3.76Å; W325-Y332 AromaticContact CE3-CD2 3.79Å; W325-Y332 HydrophobicContact CE3-CD2 3.79Å; W325-Y332 AromaticContact CE3-CE1 3.64Å; W325-Y332 HydrophobicContact CE3-CE1 3.64Å; W325-Y332 AromaticContact CE3-CE2 3.68Å; W325-Y332 HydrophobicContact CE3-CE2 3.68Å; W325-Y332 AromaticContact CE3-CG 3.82Å; W325-Y332 HydrophobicContact CE3-CG 3.82Å; W325-Y332 AromaticContact CE3-CZ 3.58Å; W325-Y332 HydrophobicContact CZ3-CD1 4.35Å; W325-Y332 AromaticContact CZ3-CD2 3.5Å; W325-Y332 HydrophobicContact CZ3-CD2 3.5Å; W325-Y332 HydrophobicContact CZ3-CE1 4.22Å; W325-Y332 AromaticContact CZ3-CE2 3.36Å; W325-Y332 HydrophobicContact CZ3-CE2 3.36Å; W325-Y332 HydrophobicContact CZ3-CG 4.01Å; W325-Y332 AromaticContact CZ3-CZ 3.73Å
326	D	83.3	Confident	73	Confident	17 Å²	17	67 Å²	67	9%	0.091	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	117.7	168.5	-170.7	-16.3	0	0	0	109.2	F315 A328 D329 D330 A331 V333	F315-D326 HydrophobicContact CD1-CB 4.12Å; F315-D326 HydrophobicContact CE1-CB 4.02Å; F315-D326 VanDerWaalsContact CE1-OD2 3.24Å; F315-D326 WeakPolarHBondContact CE1-OD2 3.5Å; D326-A328 WeakPolarHBondContact OD1-CB 3.39Å; D326-A328 PolarHBondContact OD1-N 3.48Å; D326-D329 HydrophobicContact CB-CB 4.41Å; D326-D329 PolarHBondContact OD1-N 3.42Å; D326-D330 VanDerWaalsContact O-CA 3.28Å; D326-D330 WeakPolarHBondContact O-CA 2.95Å; D326-D330 PolarHBondContact O-N 3.18Å; D326-A331 PolarHBondContact N-O 3.48Å; D326-A331 PolarHBondContact O-N 3.45Å; D326-V333 HydrophobicContact CB-CG2 4.34Å
327	Y	80	Confident	70.9	Confident	20 Å²	20	69.7 Å²	69.7	8%	0.078	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-21.3	177	-76.4	-74	0	0	0	113.9	A304 Q305 F308 T314 A316 W325	A304-Y327 HydrophobicContact CB-CE2 4.41Å; A304-Y327 WeakPolarHBondContact CB-OH 3.37Å; Q305-Y327 HydrophobicContact CB-CD1 4.35Å; Q305-Y327 HydrophobicContact CB-CE1 3.82Å; Q305-Y327 HydrophobicContact CG-CD1 4.35Å; Q305-Y327 HydrophobicContact CG-CE1 4.28Å; F308-Y327 HydrophobicContact CB-CD2 4.02Å; F308-Y327 HydrophobicContact CB-CG 3.95Å; F308-Y327 HydrophobicContact CD1-CD1 4.44Å; F308-Y327 HydrophobicContact CD1-CG 4.12Å; F308-Y327 VanDerWaalsContact CG-CB 3.47Å; F308-Y327 HydrophobicContact CG-CD2 4.42Å; F308-Y327 AromaticContact CG-CG 3.99Å; F308-Y327 HydrophobicContact CG-CG 3.99Å; T314-Y327 WeakPolarHBondContact O-CD2 3.45Å; T314-Y327 PolarHBondContact O-N 3.39Å; A316-Y327 HydrophobicContact CB-CD2 4.3Å; A316-Y327 HydrophobicContact CB-CE2 3.6Å; W325-Y327 AromaticContact CD1-CD1 3.94Å
328	A	80.2	Confident	68.6	Low	59 Å²	59	73.5 Å²	73.5	49%	0.488	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-46.9	175.6	0	0	0	0	0	111.4	T314 D326	T314-A328 HydrophobicContact CG2-CB 3.68Å; D326-A328 WeakPolarHBondContact OD1-CB 3.39Å; D326-A328 PolarHBondContact OD1-N 3.48Å
329	D	75.6	Confident	66.4	Low	100 Å²	100	77.4 Å²	77.4	54%	0.535	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-8	-179.1	-74.6	-12.5	0	0	0	113.4	D326 A331	D326-D329 HydrophobicContact CB-CB 4.41Å; D326-D329 PolarHBondContact OD1-N 3.42Å; D329-A331 VanDerWaalsContact C-N 3.3Å; D329-A331 PolarHBondContact O-N 2.7Å
330	D	77.8	Confident	64.7	Low	91 Å²	91	85.6 Å²	85.6	49%	0.487	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	36.9	-178.4	-158.2	38.5	0	0	0	113.7	R298 W325 D326	R298-D330 IonicContact CZ-OD1 3.69Å; R298-D330 IonicContact NH1-OD1 3.28Å; R298-D330 PolarHBondContact NH1-OD1 3.18Å; R298-D330 IonicContact NH1-OD2 3.7Å; R298-D330 IonicContact NH2-OD1 3.73Å; R298-D330 PolarHBondContact NH2-OD1 2.65Å; W325-D330 WeakPolarHBondContact CH2-O 3.11Å; W325-D330 WeakPolarHBondContact CZ2-O 3.42Å; W325-D330 WeakPolarHBondContact CZ2-OD1 2.99Å; D326-D330 VanDerWaalsContact O-CA 3.28Å; D326-D330 WeakPolarHBondContact O-CA 2.95Å; D326-D330 PolarHBondContact O-N 3.18Å
331	A	74.4	Confident	63.8	Low	45 Å²	45	92.4 Å²	92.4	37%	0.372	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	164.6	-173.2	0	0	0	0	0	114	D326 D329	D326-A331 PolarHBondContact N-O 3.48Å; D326-A331 PolarHBondContact O-N 3.45Å; D329-A331 VanDerWaalsContact C-N 3.3Å; D329-A331 PolarHBondContact O-N 2.7Å
332	Y	71.5	Confident	62.7	Low	100 Å²	100	94.5 Å²	94.5	39%	0.392	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	140.2	172.1	-75.5	-74.6	0	0	0	111.9	W286 L323 V324 W325	W286-Y332 AromaticContact CH2-CE1 3.99Å; W286-Y332 HydrophobicContact CH2-CE1 3.99Å; L323-Y332 HydrophobicContact CB-CD1 3.96Å; L323-Y332 HydrophobicContact CB-CE1 3.73Å; L323-Y332 HydrophobicContact CD1-CE1 4.04Å; L323-Y332 HydrophobicContact CD2-CD1 4.41Å; L323-Y332 HydrophobicContact CG-CE1 4.34Å; V324-Y332 WeakPolarHBondContact O-CA 3.05Å; W325-Y332 AromaticContact CE3-CD1 3.76Å; W325-Y332 HydrophobicContact CE3-CD1 3.76Å; W325-Y332 AromaticContact CE3-CD2 3.79Å; W325-Y332 HydrophobicContact CE3-CD2 3.79Å; W325-Y332 AromaticContact CE3-CE1 3.64Å; W325-Y332 HydrophobicContact CE3-CE1 3.64Å; W325-Y332 AromaticContact CE3-CE2 3.68Å; W325-Y332 HydrophobicContact CE3-CE2 3.68Å; W325-Y332 AromaticContact CE3-CG 3.82Å; W325-Y332 HydrophobicContact CE3-CG 3.82Å; W325-Y332 AromaticContact CE3-CZ 3.58Å; W325-Y332 HydrophobicContact CZ3-CD1 4.35Å; W325-Y332 AromaticContact CZ3-CD2 3.5Å; W325-Y332 HydrophobicContact CZ3-CD2 3.5Å; W325-Y332 HydrophobicContact CZ3-CE1 4.22Å; W325-Y332 AromaticContact CZ3-CE2 3.36Å; W325-Y332 HydrophobicContact CZ3-CE2 3.36Å; W325-Y332 HydrophobicContact CZ3-CG 4.01Å; W325-Y332 AromaticContact CZ3-CZ 3.73Å
333	V	63.4	Low	61.4	Low	63 Å²	63	91.4 Å²	91.4	38%	0.382	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-84.2	118.4	176.4	-174.9	0	0	0	0	110.4	V324 D326	V324-V333 HydrophobicContact CB-CB 4.19Å; V324-V333 HydrophobicContact CB-CG2 4.26Å; V324-V333 HydrophobicContact CG1-CB 4.42Å; V324-V333 HydrophobicContact CG1-CG2 3.98Å; V324-V333 PolarHBondContact O-N 2.95Å; D326-V333 HydrophobicContact CB-CG2 4.34Å
334	H	53.4	Low	59.5	Low	140 Å²	140	95.2 Å²	95.2	65%	0.648	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-96.6	136.5	177.2	-75	-76.6	0	0	0	112.7
335	R	48.2	Very low	57.6	Low	235 Å²	235	98.8 Å²	98.8	89%	0.887	52%	0.517	S	S	*	.			trans	-79.8	115.4	174	-174	-177.1	-80.5	-170.1	-4.1	110.1
336	L	49.2	Very low	55.6	Low	87 Å²	87	100.8 Å²	100.8	46%	0.455	53%	0.533	S	S	.	.			trans	-81.3	138.5	173.8	-66.7	163	0	0	0	110.6	F366	L336-F366 HydrophobicContact CD1-CD1 4.09Å; L336-F366 HydrophobicContact CD1-CE1 4.2Å
337	A	39.9	Very low	53.5	Low	60 Å²	60	104.3 Å²	104.3	50%	0.496	55%	0.548	S	S	.	.			trans	-114.5	144.1	173.3	0	0	0	0	0	110.4
338	V	36.9	Very low	51.5	Low	97 Å²	97	110.9 Å²	110.9	59%	0.588	58%	0.584	S	S	*	*	B	Isolated β-bridge	trans	-107	131.4	-178.5	-169	0	0	0	0	109.1	L345	V338-L345 HydrophobicContact CG2-CD2 4.16Å
339	N	37.9	Very low	49.3	Very low	95 Å²	95	109.9 Å²	109.9	51%	0.508	58%	0.579	S	S	.	*			trans	-82.5	136.1	172.9	-98.4	-0.5	0	0	0	111.2	E341 G343 V346	N339-E341 PolarHBondContact O-N 3.27Å; N339-G343 PolarHBondContact O-N 3.09Å; N339-V346 HydrophobicContact CB-CG2 4.17Å
340	H	42.4	Very low	47.4	Very low	182 Å²	182	109.5 Å²	109.5	84%	0.843	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-17	-167.2	-131	-77	0	0	0	115.2
341	E	49.6	Very low	45.4	Very low	192 Å²	192	110.4 Å²	110.4	90%	0.897	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-32.3	-174.4	-63.4	-170.2	158.4	0	0	113.5	N339	N339-E341 PolarHBondContact O-N 3.27Å
342	D	49.3	Very low	43.8	Very low	143 Å²	143	110.3 Å²	110.3	77%	0.765	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	-4.9	-173	-104.3	-19.2	0	0	0	113.7	K344	D342-K344 HydrophobicContact CB-CB 4.09Å; D342-K344 PolarHBondContact O-N 3.36Å
343	G	39.3	Very low	42.2	Very low	59 Å²	59	114.8 Å²	114.8	61%	0.608	62%	0.617	S	S	*	*			trans	58.8	6.6	-172.6	0	0	0	0	0	113.8	N339	N339-G343 PolarHBondContact O-N 3.09Å
344	K	35.7	Very low	41	Very low	149 Å²	149	117.8 Å²	117.8	65%	0.648	64%	0.635	S	S	*	*			trans	-86.1	127.1	-177.3	-162.4	174.9	-176.6	-179.8	0	108.4	D342 V346	D342-K344 HydrophobicContact CB-CB 4.09Å; D342-K344 PolarHBondContact O-N 3.36Å; K344-V346 PolarHBondContact O-N 3.11Å
345	L	40.8	Very low	40.6	Very low	105 Å²	105	111.7 Å²	111.7	55%	0.55	61%	0.61	S	S	.	*	B	Isolated β-bridge	trans	-62.6	115.4	175.5	-59.4	170.6	0	0	0	108.2	V338	V338-L345 HydrophobicContact CG2-CD2 4.16Å
346	V	39.9	Very low	40.3	Very low	77 Å²	77	102.6 Å²	102.6	47%	0.467	58%	0.579	S	S	.	*			trans	-105.1	122.4	178.8	178.1	0	0	0	0	108.9	N339 K344	N339-V346 HydrophobicContact CB-CG2 4.17Å; K344-V346 PolarHBondContact O-N 3.11Å
347	Q	37.7	Very low	40.1	Very low	91 Å²	91	105.6 Å²	105.6	43%	0.425	59%	0.589	S	S	.	*			trans	-72.5	124.6	176.6	-79.1	145	-12.9	0	0	111	G349 D360 S363	Q347-G349 PolarHBondContact O-N 3.26Å; Q347-D360 PolarHBondContact NE2-O 2.98Å; Q347-D360 PolarHBondContact OE1-OD1 2.92Å; Q347-S363 PolarHBondContact NE2-OG 3.32Å
348	L	38.6	Very low	40.4	Very low	159 Å²	159	109.8 Å²	109.8	83%	0.832	60%	0.596	S	S	*	*			trans	-84.5	94.5	162.2	-80.5	150.6	0	0	0	107.8	P350	L348-P350 WeakPolarHBondContact O-CD 3.41Å
349	G	33.2	Very low	41	Very low	37 Å²	37	108 Å²	108	38%	0.381	58%	0.583	S	S	.	*			trans	-82.9	128.8	177.5	0	0	0	0	0	112.8	Q347 N356	Q347-G349 PolarHBondContact O-N 3.26Å; G349-N356 WeakPolarHBondContact CA-OD1 3.06Å
350	P	36.7	Very low	41.7	Very low	92 Å²	92	105.9 Å²	105.9	60%	0.597	57%	0.571	S	S	*	*			trans	-101.3	110.3	162.8	5.9	16.9	0	0	0	109.5	L348 L359	L348-P350 WeakPolarHBondContact O-CD 3.41Å; P350-L359 HydrophobicContact CG-CD1 4.3Å
351	S	34.5	Very low	42.4	Very low	110 Å²	110	101 Å²	101	77%	0.769	55%	0.551	S	S	*	*	S	Bend	trans	67.4	74.2	160.5	-57.3	0	0	0	0	116.6	N356	S351-N356 PolarHBondContact N-OD1 3Å
352	S	41.2	Very low	42.8	Very low	43 Å²	43	96.1 Å²	96.1	30%	0.301	53%	0.53	S	S	.	.			trans	-177.1	142.5	132.1	-116	0	0	0	0	117	T354 G355 N356	S352-T354 PolarHBondContact O-N 2.93Å; S352-T354 VanDerWaalsContact OG-CA 3.25Å; S352-T354 WeakPolarHBondContact OG-CA 3.02Å; S352-T354 PolarHBondContact OG-N 2.72Å; S352-T354 PolarHBondContact OG-OG1 2.74Å; S352-T354 VanDerWaalsContact OG-OG1 3.1Å; S352-G355 VanDerWaalsContact CB-C 3.48Å; S352-G355 WeakPolarHBondContact OG-CA 3.39Å; S352-G355 PolarHBondContact OG-N 2.87Å; S352-G355 VanDerWaalsContact OG-N 3.13Å; S352-N356 PolarHBondContact N-OD1 2.52Å; S352-N356 VanDerWaalsContact N-OD1 3.09Å; S352-N356 PolarHBondContact O-N 2.82Å
353	E	38.1	Very low	43.5	Very low	195 Å²	195	90.3 Å²	90.3	91%	0.911	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-0.3	136.3	-75.3	-169.6	142.3	0	0	113.3
354	T	39.6	Very low	44.7	Very low	125 Å²	125	93.3 Å²	93.3	77%	0.767	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138	34.7	176.7	37.3	0	0	0	0	118.3	S352	S352-T354 PolarHBondContact O-N 2.93Å; S352-T354 VanDerWaalsContact OG-CA 3.25Å; S352-T354 WeakPolarHBondContact OG-CA 3.02Å; S352-T354 PolarHBondContact OG-N 2.72Å; S352-T354 PolarHBondContact OG-OG1 2.74Å; S352-T354 VanDerWaalsContact OG-OG1 3.1Å
355	G	43.3	Very low	46	Very low	12 Å²	12	91.3 Å²	91.3	12%	0.124	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	173.1	-27.9	-155.7	0	0	0	0	0	114	S352 K357 K358 L359	S352-G355 VanDerWaalsContact CB-C 3.48Å; S352-G355 WeakPolarHBondContact OG-CA 3.39Å; S352-G355 PolarHBondContact OG-N 2.87Å; S352-G355 VanDerWaalsContact OG-N 3.13Å; G355-K357 PolarHBondContact O-N 2.75Å; G355-K358 PolarHBondContact O-N 3.13Å; G355-L359 PolarHBondContact O-N 2.93Å
356	N	43.6	Very low	47.3	Very low	44 Å²	44	89.5 Å²	89.5	24%	0.235	48%	0.481	C	S	.	.	H	α-helix	trans	-33.4	-62.1	144.4	73.9	-100.7	0	0	0	110.4	G349 S351 S352 K358 L359 D360	G349-N356 WeakPolarHBondContact CA-OD1 3.06Å; S351-N356 PolarHBondContact N-OD1 3Å; S352-N356 PolarHBondContact N-OD1 2.52Å; S352-N356 VanDerWaalsContact N-OD1 3.09Å; S352-N356 PolarHBondContact O-N 2.82Å; N356-K358 PolarHBondContact O-N 2.82Å; N356-K358 VanDerWaalsContact O-N 3.14Å; N356-L359 HydrophobicContact CB-CB 4.27Å; N356-L359 HydrophobicContact CB-CD1 4.36Å; N356-L359 PolarHBondContact O-N 3.29Å; N356-L359 VanDerWaalsContact O-N 3.08Å; N356-D360 WeakPolarHBondContact O-CB 3.22Å; N356-D360 PolarHBondContact O-N 2.82Å
357	K	44	Very low	48.9	Very low	151 Å²	151	87.5 Å²	87.5	66%	0.657	47%	0.47	S	S	*	.	H	α-helix	trans	-58.4	-34.7	-179.1	-59.7	-178.9	-177	175.9	0	113.2	G355 I361	G355-K357 PolarHBondContact O-N 2.75Å; K357-I361 VanDerWaalsContact O-CB 3.29Å; K357-I361 WeakPolarHBondContact O-CB 3.01Å; K357-I361 WeakPolarHBondContact O-CD1 3.43Å; K357-I361 WeakPolarHBondContact O-CG1 3.38Å; K357-I361 PolarHBondContact O-N 2.65Å
358	K	46.1	Very low	50.8	Low	147 Å²	147	86 Å²	86	64%	0.639	47%	0.473	S	S	*	.	H	α-helix	trans	-71.3	-43	177.3	-78.1	-172.2	177.3	-178	0	111.5	G355 N356 D360 I361 I362	G355-K358 PolarHBondContact O-N 3.13Å; N356-K358 PolarHBondContact O-N 2.82Å; N356-K358 VanDerWaalsContact O-N 3.14Å; K358-D360 VanDerWaalsContact C-N 3.3Å; K358-I361 PolarHBondContact O-N 3.45Å; K358-I362 WeakPolarHBondContact O-CB 3.46Å; K358-I362 WeakPolarHBondContact O-CD1 3.49Å; K358-I362 WeakPolarHBondContact O-CG1 3.17Å; K358-I362 PolarHBondContact O-N 2.81Å
359	L	49.2	Very low	52.9	Low	60 Å²	60	82.1 Å²	82.1	31%	0.314	45%	0.452	S	S	.	.	H	α-helix	trans	-67.9	-34	176.5	-66.7	173.7	0	0	0	112.1	P350 G355 N356 I362 S363	P350-L359 HydrophobicContact CG-CD1 4.3Å; G355-L359 PolarHBondContact O-N 2.93Å; N356-L359 HydrophobicContact CB-CB 4.27Å; N356-L359 HydrophobicContact CB-CD1 4.36Å; N356-L359 PolarHBondContact O-N 3.29Å; N356-L359 VanDerWaalsContact O-N 3.08Å; L359-I362 HydrophobicContact CD2-CD1 4.43Å; L359-I362 PolarHBondContact O-N 2.94Å; L359-S363 WeakPolarHBondContact O-CB 3.33Å; L359-S363 PolarHBondContact O-N 2.93Å; L359-S363 PolarHBondContact O-OG 3.49Å
360	D	53	Low	55	Low	50 Å²	50	84.1 Å²	84.1	27%	0.267	45%	0.454	S	S	.	.	H	α-helix	trans	-68.6	-40.6	175.1	-59.6	-12.7	0	0	0	110.8	Q347 N356 K358 S363 M364	Q347-D360 PolarHBondContact NE2-O 2.98Å; Q347-D360 PolarHBondContact OE1-OD1 2.92Å; N356-D360 WeakPolarHBondContact O-CB 3.22Å; N356-D360 PolarHBondContact O-N 2.82Å; K358-D360 VanDerWaalsContact C-N 3.3Å; D360-S363 WeakPolarHBondContact CA-OG 3.23Å; D360-S363 PolarHBondContact O-OG 2.68Å; D360-M364 VanDerWaalsContact O-CB 3.3Å; D360-M364 WeakPolarHBondContact O-CB 3.48Å; D360-M364 PolarHBondContact O-N 3.16Å
361	I	57.7	Low	57.1	Low	81 Å²	81	83.9 Å²	83.9	42%	0.415	45%	0.451	S	S	.	.	H	α-helix	trans	-62.4	-47.7	171.6	-71.1	162.2	0	0	0	110.5	K357 K358 S363 M364 E365	K357-I361 VanDerWaalsContact O-CB 3.29Å; K357-I361 WeakPolarHBondContact O-CB 3.01Å; K357-I361 WeakPolarHBondContact O-CD1 3.43Å; K357-I361 WeakPolarHBondContact O-CG1 3.38Å; K357-I361 PolarHBondContact O-N 2.65Å; K358-I361 PolarHBondContact O-N 3.45Å; I361-S363 PolarHBondContact O-N 2.72Å; I361-M364 WeakPolarHBondContact O-CB 3.44Å; I361-M364 PolarHBondContact O-N 2.7Å; I361-E365 HydrophobicContact CG2-CG 4.46Å; I361-E365 WeakPolarHBondContact O-CG 2.98Å; I361-E365 PolarHBondContact O-N 3.01Å
362	I	57.8	Low	59.6	Low	89 Å²	89	82.1 Å²	82.1	46%	0.456	44%	0.439	S	S	.	.	H	α-helix	trans	-63.6	-42	-179.7	-69.3	160.6	0	0	0	111.1	K358 L359 M364 E365 F366	K358-I362 WeakPolarHBondContact O-CB 3.46Å; K358-I362 WeakPolarHBondContact O-CD1 3.49Å; K358-I362 WeakPolarHBondContact O-CG1 3.17Å; K358-I362 PolarHBondContact O-N 2.81Å; L359-I362 HydrophobicContact CD2-CD1 4.43Å; L359-I362 PolarHBondContact O-N 2.94Å; I362-M364 VanDerWaalsContact C-N 3.33Å; I362-E365 PolarHBondContact O-N 2.84Å; I362-F366 WeakPolarHBondContact O-CB 3.48Å; I362-F366 PolarHBondContact O-N 3.48Å
363	S	63.6	Low	61.8	Low	21 Å²	21	85 Å²	85	15%	0.147	45%	0.447	C	S	.	.	H	α-helix	trans	-69.7	-31.2	177.1	63.7	0	0	0	0	112.6	Q347 L359 D360 I361 S367	Q347-S363 PolarHBondContact NE2-OG 3.32Å; L359-S363 WeakPolarHBondContact O-CB 3.33Å; L359-S363 PolarHBondContact O-N 2.93Å; L359-S363 PolarHBondContact O-OG 3.49Å; D360-S363 WeakPolarHBondContact CA-OG 3.23Å; D360-S363 PolarHBondContact O-OG 2.68Å; I361-S363 PolarHBondContact O-N 2.72Å; S363-S367 VanDerWaalsContact O-CB 3.32Å; S363-S367 WeakPolarHBondContact O-CB 3.27Å; S363-S367 PolarHBondContact O-N 2.87Å; S363-S367 PolarHBondContact O-OG 2.79Å
364	M	64.3	Low	64.3	Low	122 Å²	122	80.6 Å²	80.6	60%	0.601	43%	0.43	S	S	*	.	H	α-helix	trans	-68.7	-39.9	171.1	-172.7	177.8	67.3	0	0	111.2	D360 I361 I362 S367 A368	D360-M364 VanDerWaalsContact O-CB 3.3Å; D360-M364 WeakPolarHBondContact O-CB 3.48Å; D360-M364 PolarHBondContact O-N 3.16Å; I361-M364 WeakPolarHBondContact O-CB 3.44Å; I361-M364 PolarHBondContact O-N 2.7Å; I362-M364 VanDerWaalsContact C-N 3.33Å; M364-S367 PolarHBondContact O-N 3.49Å; M364-A368 WeakPolarHBondContact O-CB 3.32Å; M364-A368 PolarHBondContact O-N 3.2Å
365	E	62.8	Low	66.4	Low	107 Å²	107	78.9 Å²	78.9	50%	0.5	41%	0.413	S	S	.	.	H	α-helix	trans	-65.5	-43.8	173.7	-73.4	174.8	177	0	0	111.7	I361 I362 S367 A368 I369	I361-E365 HydrophobicContact CG2-CG 4.46Å; I361-E365 WeakPolarHBondContact O-CG 2.98Å; I361-E365 PolarHBondContact O-N 3.01Å; I362-E365 PolarHBondContact O-N 2.84Å; E365-S367 VanDerWaalsContact C-N 3.34Å; E365-S367 PolarHBondContact O-N 2.98Å; E365-A368 CarbonylContact O-C 3.52Å; E365-A368 WeakPolarHBondContact O-CA 3.45Å; E365-A368 WeakPolarHBondContact O-CB 3.33Å; E365-A368 PolarHBondContact O-N 3.46Å; E365-A368 VanDerWaalsContact O-N 3.13Å; E365-I369 VanDerWaalsContact O-CG1 3.27Å; E365-I369 WeakPolarHBondContact O-CG1 3.43Å; E365-I369 PolarHBondContact O-N 3.03Å
366	F	67.9	Low	68.7	Low	67 Å²	67	81.6 Å²	81.6	29%	0.294	43%	0.43	S	S	.	.	H	α-helix	trans	-62.9	-41.6	175.4	-171.7	-104.7	0	0	0	111.6	L336 I362 A368 I369 L370	L336-F366 HydrophobicContact CD1-CD1 4.09Å; L336-F366 HydrophobicContact CD1-CE1 4.2Å; I362-F366 WeakPolarHBondContact O-CB 3.48Å; I362-F366 PolarHBondContact O-N 3.48Å; F366-A368 VanDerWaalsContact C-N 3.32Å; F366-A368 PolarHBondContact O-N 3.33Å; F366-I369 PolarHBondContact O-N 2.95Å; F366-L370 HydrophobicContact CD1-CD1 3.8Å; F366-L370 HydrophobicContact CD1-CG 4.26Å; F366-L370 HydrophobicContact CE1-CD1 3.44Å; F366-L370 VanDerWaalsContact CE1-CD1 3.44Å; F366-L370 HydrophobicContact CE1-CG 4Å; F366-L370 HydrophobicContact CZ-CD1 4.1Å; F366-L370 HydrophobicContact CZ-CD2 4.4Å; F366-L370 HydrophobicContact CZ-CG 4.26Å; F366-L370 WeakPolarHBondContact O-CB 3.34Å; F366-L370 WeakPolarHBondContact O-CG 3.17Å; F366-L370 PolarHBondContact O-N 3.28Å
367	S	74.8	Confident	70.9	Confident	35 Å²	35	84.5 Å²	84.5	25%	0.245	44%	0.442	C	S	.	.	H	α-helix	trans	-62.1	-42.3	172.7	-59.6	0	0	0	0	111	S363 M364 E365 T371	S363-S367 VanDerWaalsContact O-CB 3.32Å; S363-S367 WeakPolarHBondContact O-CB 3.27Å; S363-S367 PolarHBondContact O-N 2.87Å; S363-S367 PolarHBondContact O-OG 2.79Å; M364-S367 PolarHBondContact O-N 3.49Å; E365-S367 VanDerWaalsContact C-N 3.34Å; E365-S367 PolarHBondContact O-N 2.98Å; S367-T371 WeakPolarHBondContact O-CB 3.46Å; S367-T371 PolarHBondContact O-N 2.87Å; S367-T371 PolarHBondContact O-OG1 3.1Å
368	A	78	Confident	72.8	Confident	58 Å²	58	83 Å²	83	48%	0.479	43%	0.432	S	S	.	.	H	α-helix	trans	-63.9	-40	175.9	0	0	0	0	0	112.1	M364 E365 F366 T371 S372	M364-A368 WeakPolarHBondContact O-CB 3.32Å; M364-A368 PolarHBondContact O-N 3.2Å; E365-A368 CarbonylContact O-C 3.52Å; E365-A368 WeakPolarHBondContact O-CA 3.45Å; E365-A368 WeakPolarHBondContact O-CB 3.33Å; E365-A368 PolarHBondContact O-N 3.46Å; E365-A368 VanDerWaalsContact O-N 3.13Å; F366-A368 VanDerWaalsContact C-N 3.32Å; F366-A368 PolarHBondContact O-N 3.33Å; A368-T371 PolarHBondContact O-N 2.88Å; A368-S372 VanDerWaalsContact O-CB 3.24Å; A368-S372 WeakPolarHBondContact O-CB 3.36Å; A368-S372 PolarHBondContact O-N 3.43Å
369	I	80.8	Confident	74.9	Confident	78 Å²	78	78.3 Å²	78.3	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-66.7	-48.2	176.8	-68.7	162.8	0	0	0	110.7	E365 F366 T371 S372 Q373	E365-I369 VanDerWaalsContact O-CG1 3.27Å; E365-I369 WeakPolarHBondContact O-CG1 3.43Å; E365-I369 PolarHBondContact O-N 3.03Å; F366-I369 PolarHBondContact O-N 2.95Å; I369-T371 VanDerWaalsContact C-N 3.29Å; I369-T371 PolarHBondContact O-N 3.49Å; I369-S372 CarbonylContact O-C 3.58Å; I369-S372 WeakPolarHBondContact O-CB 3.47Å; I369-S372 PolarHBondContact O-N 3.21Å; I369-S372 VanDerWaalsContact O-N 3.13Å; I369-Q373 HydrophobicContact CG2-CG 4.26Å; I369-Q373 WeakPolarHBondContact O-CB 3.48Å; I369-Q373 WeakPolarHBondContact O-CG 3.14Å; I369-Q373 PolarHBondContact O-N 2.89Å
370	L	78.3	Confident	77	Confident	79 Å²	79	81.9 Å²	81.9	41%	0.414	43%	0.431	S	S	.	.	H	α-helix	trans	-58.5	-44.3	176.3	-75.1	178.3	0	0	0	111.4	F366 S372 Q373 L374	F366-L370 HydrophobicContact CD1-CD1 3.8Å; F366-L370 HydrophobicContact CD1-CG 4.26Å; F366-L370 HydrophobicContact CE1-CD1 3.44Å; F366-L370 VanDerWaalsContact CE1-CD1 3.44Å; F366-L370 HydrophobicContact CE1-CG 4Å; F366-L370 HydrophobicContact CZ-CD1 4.1Å; F366-L370 HydrophobicContact CZ-CD2 4.4Å; F366-L370 HydrophobicContact CZ-CG 4.26Å; F366-L370 WeakPolarHBondContact O-CB 3.34Å; F366-L370 WeakPolarHBondContact O-CG 3.17Å; F366-L370 PolarHBondContact O-N 3.28Å; L370-S372 VanDerWaalsContact C-N 3.33Å; L370-S372 PolarHBondContact O-N 3.04Å; L370-Q373 PolarHBondContact O-N 2.78Å; L370-L374 WeakPolarHBondContact O-CB 3.41Å; L370-L374 VanDerWaalsContact O-CG 3.31Å; L370-L374 WeakPolarHBondContact O-CG 3.5Å; L370-L374 PolarHBondContact O-N 3.44Å
371	T	80.2	Confident	78.9	Confident	88 Å²	88	85.4 Å²	85.4	54%	0.54	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-42.4	176.7	-45.8	0	0	0	0	110.5	S367 A368 I369 L374 E375	S367-T371 WeakPolarHBondContact O-CB 3.46Å; S367-T371 PolarHBondContact O-N 2.87Å; S367-T371 PolarHBondContact O-OG1 3.1Å; A368-T371 PolarHBondContact O-N 2.88Å; I369-T371 VanDerWaalsContact C-N 3.29Å; I369-T371 PolarHBondContact O-N 3.49Å; T371-L374 PolarHBondContact O-N 2.77Å; T371-E375 VanDerWaalsContact O-CB 3.26Å; T371-E375 WeakPolarHBondContact O-CB 3.32Å; T371-E375 PolarHBondContact O-N 3.01Å
372	S	87.3	Confident	80.6	Confident	73 Å²	73	87.1 Å²	87.1	51%	0.51	45%	0.45	S	S	.	.	H	α-helix	trans	-63.1	-40	175.9	-175.5	0	0	0	0	112.7	A368 I369 L370 S376	A368-S372 VanDerWaalsContact O-CB 3.24Å; A368-S372 WeakPolarHBondContact O-CB 3.36Å; A368-S372 PolarHBondContact O-N 3.43Å; I369-S372 CarbonylContact O-C 3.58Å; I369-S372 WeakPolarHBondContact O-CB 3.47Å; I369-S372 PolarHBondContact O-N 3.21Å; I369-S372 VanDerWaalsContact O-N 3.13Å; L370-S372 VanDerWaalsContact C-N 3.33Å; L370-S372 PolarHBondContact O-N 3.04Å; S372-S376 WeakPolarHBondContact O-CB 3.47Å; S372-S376 PolarHBondContact O-N 2.81Å
373	Q	88.5	Confident	82.3	Confident	102 Å²	102	86.3 Å²	86.3	48%	0.477	45%	0.453	S	S	.	.	H	α-helix	trans	-71.9	-42	178.8	-72.1	-63.7	-22.3	0	0	111.3	I369 L370 E375 S376 Q377	I369-Q373 HydrophobicContact CG2-CG 4.26Å; I369-Q373 WeakPolarHBondContact O-CB 3.48Å; I369-Q373 WeakPolarHBondContact O-CG 3.14Å; I369-Q373 PolarHBondContact O-N 2.89Å; L370-Q373 PolarHBondContact O-N 2.78Å; Q373-E375 VanDerWaalsContact C-N 3.33Å; Q373-S376 PolarHBondContact O-N 2.87Å; Q373-Q377 WeakPolarHBondContact O-CB 3.48Å; Q373-Q377 WeakPolarHBondContact O-CG 3.21Å; Q373-Q377 PolarHBondContact O-N 3.29Å
374	L	89	Confident	83.7	Confident	103 Å²	103	88.8 Å²	88.8	54%	0.539	46%	0.462	S	S	.	.	H	α-helix	trans	-65	-37.6	174.2	-71.2	175.1	0	0	0	111.9	L370 T371 R378	L370-L374 WeakPolarHBondContact O-CB 3.41Å; L370-L374 VanDerWaalsContact O-CG 3.31Å; L370-L374 WeakPolarHBondContact O-CG 3.5Å; L370-L374 PolarHBondContact O-N 3.44Å; T371-L374 PolarHBondContact O-N 2.77Å; L374-R378 VanDerWaalsContact O-CB 3.26Å; L374-R378 WeakPolarHBondContact O-CB 3.09Å; L374-R378 WeakPolarHBondContact O-CG 3.29Å; L374-R378 PolarHBondContact O-N 3.47Å
375	E	85.2	Confident	85	Confident	90 Å²	90	88.1 Å²	88.1	42%	0.421	46%	0.461	S	S	.	.	H	α-helix	trans	-63.7	-45.4	172.1	-169.4	65.4	-137.9	0	0	111	T371 Q373 R378 A379	T371-E375 VanDerWaalsContact O-CB 3.26Å; T371-E375 WeakPolarHBondContact O-CB 3.32Å; T371-E375 PolarHBondContact O-N 3.01Å; Q373-E375 VanDerWaalsContact C-N 3.33Å; E375-R378 PolarHBondContact O-N 3.2Å; E375-R378 IonicContact OE1-CZ 2.76Å; E375-R378 IonicContact OE1-NH1 2.6Å; E375-R378 IonicContact OE1-NH2 3.1Å; E375-R378 PolarHBondContact OE1-NH2 2.73Å; E375-R378 IonicContact OE2-CZ 2.9Å; E375-R378 IonicContact OE2-NH1 3.65Å; E375-R378 PolarHBondContact OE2-NH1 2.94Å; E375-R378 IonicContact OE2-NH2 2.74Å; E375-R378 PolarHBondContact OE2-NH2 3.5Å; E375-A379 WeakPolarHBondContact O-CB 3.39Å; E375-A379 PolarHBondContact O-N 3.4Å
376	S	90.9	Very high	86.4	Confident	69 Å²	69	88 Å²	88	48%	0.483	46%	0.463	S	S	.	.	H	α-helix	trans	-62.5	-43.6	177.2	-175.7	0	0	0	0	112.3	S372 Q373 A379 Y380	S372-S376 WeakPolarHBondContact O-CB 3.47Å; S372-S376 PolarHBondContact O-N 2.81Å; Q373-S376 PolarHBondContact O-N 2.87Å; S376-A379 PolarHBondContact O-N 3.12Å; S376-Y380 WeakPolarHBondContact O-CB 3.2Å; S376-Y380 PolarHBondContact O-N 3Å
377	Q	88.7	Confident	87.6	Confident	104 Å²	104	88.7 Å²	88.7	49%	0.486	47%	0.47	S	S	.	.	H	α-helix	trans	-67.3	-42.3	177.4	-73.5	-178	17.4	0	0	111.5	Q373 Y380 F381	Q373-Q377 WeakPolarHBondContact O-CB 3.48Å; Q373-Q377 WeakPolarHBondContact O-CG 3.21Å; Q373-Q377 PolarHBondContact O-N 3.29Å; Q377-Y380 PolarHBondContact O-N 2.8Å; Q377-F381 VanDerWaalsContact O-CD2 3.22Å; Q377-F381 WeakPolarHBondContact O-CD2 3.5Å; Q377-F381 PolarHBondContact O-N 3.16Å
378	R	85.5	Confident	88.5	Confident	120 Å²	120	91.6 Å²	91.6	45%	0.453	48%	0.481	S	S	.	.	H	α-helix	trans	-57.9	-50.9	172.9	-86.6	170.4	38.7	-127	-19.6	111.1	L374 E375 Y380 F381 E382	L374-R378 VanDerWaalsContact O-CB 3.26Å; L374-R378 WeakPolarHBondContact O-CB 3.09Å; L374-R378 WeakPolarHBondContact O-CG 3.29Å; L374-R378 PolarHBondContact O-N 3.47Å; E375-R378 PolarHBondContact O-N 3.2Å; E375-R378 IonicContact OE1-CZ 2.76Å; E375-R378 IonicContact OE1-NH1 2.6Å; E375-R378 IonicContact OE1-NH2 3.1Å; E375-R378 PolarHBondContact OE1-NH2 2.73Å; E375-R378 IonicContact OE2-CZ 2.9Å; E375-R378 IonicContact OE2-NH1 3.65Å; E375-R378 PolarHBondContact OE2-NH1 2.94Å; E375-R378 IonicContact OE2-NH2 2.74Å; E375-R378 PolarHBondContact OE2-NH2 3.5Å; R378-Y380 VanDerWaalsContact C-N 3.3Å; R378-Y380 PolarHBondContact O-N 3.31Å; R378-F381 PolarHBondContact O-N 3.05Å; R378-E382 WeakPolarHBondContact O-CB 3.01Å; R378-E382 WeakPolarHBondContact O-CG 3.35Å; R378-E382 PolarHBondContact O-N 2.91Å
379	A	90	Very high	89.3	Confident	48 Å²	48	92 Å²	92	40%	0.397	48%	0.478	S	S	.	.	H	α-helix	trans	-59.7	-39.7	178.3	0	0	0	0	0	112.2	E375 S376 S383	E375-A379 WeakPolarHBondContact O-CB 3.39Å; E375-A379 PolarHBondContact O-N 3.4Å; S376-A379 PolarHBondContact O-N 3.12Å; A379-S383 WeakPolarHBondContact O-CB 3.24Å; A379-S383 PolarHBondContact O-N 3.37Å
380	Y	93.3	Very high	89.9	Confident	136 Å²	136	91 Å²	91	53%	0.533	48%	0.476	S	S	.	.	H	α-helix	trans	-61.7	-50.2	175	175.3	-97.9	0	0	0	111.9	S376 Q377 R378 S383 Q384	S376-Y380 WeakPolarHBondContact O-CB 3.2Å; S376-Y380 PolarHBondContact O-N 3Å; Q377-Y380 PolarHBondContact O-N 2.8Å; R378-Y380 VanDerWaalsContact C-N 3.3Å; R378-Y380 PolarHBondContact O-N 3.31Å; Y380-S383 PolarHBondContact O-N 3.36Å; Y380-Q384 HydrophobicContact CD1-CG 4.36Å; Y380-Q384 HydrophobicContact CE1-CG 3.93Å; Y380-Q384 HydrophobicContact CE2-CG 4.3Å; Y380-Q384 WeakPolarHBondContact O-CG 3.4Å; Y380-Q384 PolarHBondContact O-N 3.24Å
381	F	93.2	Very high	90.7	Very high	123 Å²	123	91.3 Å²	91.3	54%	0.539	48%	0.475	S	S	.	.	H	α-helix	trans	-69.9	-34.6	179.9	-76	-60.9	0	0	0	112.7	Q377 R378 S383 Q384 L385	Q377-F381 VanDerWaalsContact O-CD2 3.22Å; Q377-F381 WeakPolarHBondContact O-CD2 3.5Å; Q377-F381 PolarHBondContact O-N 3.16Å; R378-F381 PolarHBondContact O-N 3.05Å; F381-S383 VanDerWaalsContact C-N 3.34Å; F381-Q384 PolarHBondContact O-N 3.31Å; F381-L385 WeakPolarHBondContact O-CB 3.35Å; F381-L385 VanDerWaalsContact O-CG 3.25Å; F381-L385 WeakPolarHBondContact O-CG 3.47Å; F381-L385 PolarHBondContact O-N 3.2Å
382	E	93	Very high	91.3	Very high	117 Å²	117	89.4 Å²	89.4	55%	0.547	47%	0.465	S	S	.	.	H	α-helix	trans	-61.4	-43.1	171.2	-77.2	178.3	177.3	0	0	111.1	R378 L385 D386	R378-E382 WeakPolarHBondContact O-CB 3.01Å; R378-E382 WeakPolarHBondContact O-CG 3.35Å; R378-E382 PolarHBondContact O-N 2.91Å; E382-L385 PolarHBondContact O-N 2.91Å; E382-D386 WeakPolarHBondContact O-CB 3.49Å; E382-D386 PolarHBondContact O-N 3.25Å
383	S	93.2	Very high	91.6	Very high	72 Å²	72	89.5 Å²	89.5	50%	0.503	46%	0.46	S	S	.	.	H	α-helix	trans	-64.4	-41	174.7	179.3	0	0	0	0	112.6	A379 Y380 F381 D386 L387	A379-S383 WeakPolarHBondContact O-CB 3.24Å; A379-S383 PolarHBondContact O-N 3.37Å; Y380-S383 PolarHBondContact O-N 3.36Å; F381-S383 VanDerWaalsContact C-N 3.34Å; S383-D386 PolarHBondContact O-N 3.34Å; S383-L387 WeakPolarHBondContact O-CB 3.33Å; S383-L387 PolarHBondContact O-N 3.39Å
384	Q	93.9	Very high	91.9	Very high	73 Å²	73	89.7 Å²	89.7	34%	0.341	46%	0.462	S	S	.	.	H	α-helix	trans	-65.1	-41.3	174.9	-71	-62.7	-47.6	0	0	111.9	Y380 F381 L387 I388	Y380-Q384 HydrophobicContact CD1-CG 4.36Å; Y380-Q384 HydrophobicContact CE1-CG 3.93Å; Y380-Q384 HydrophobicContact CE2-CG 4.3Å; Y380-Q384 WeakPolarHBondContact O-CG 3.4Å; Y380-Q384 PolarHBondContact O-N 3.24Å; F381-Q384 PolarHBondContact O-N 3.31Å; Q384-L387 PolarHBondContact O-N 3.14Å; Q384-I388 VanDerWaalsContact O-CG1 3.28Å; Q384-I388 WeakPolarHBondContact O-CG1 3.42Å; Q384-I388 PolarHBondContact O-N 3.42Å
385	L	89.8	Confident	92.2	Very high	109 Å²	109	93.3 Å²	93.3	57%	0.571	47%	0.469	S	S	*	.	H	α-helix	trans	-63.7	-45.9	175.5	-75.8	172.2	0	0	0	110.9	F381 E382 L387 I388 T389	F381-L385 WeakPolarHBondContact O-CB 3.35Å; F381-L385 VanDerWaalsContact O-CG 3.25Å; F381-L385 WeakPolarHBondContact O-CG 3.47Å; F381-L385 PolarHBondContact O-N 3.2Å; E382-L385 PolarHBondContact O-N 2.91Å; L385-L387 VanDerWaalsContact C-N 3.34Å; L385-L387 PolarHBondContact O-N 3.49Å; L385-I388 PolarHBondContact O-N 3.23Å; L385-T389 VanDerWaalsContact O-CB 3.31Å; L385-T389 WeakPolarHBondContact O-CB 3.41Å; L385-T389 PolarHBondContact O-N 2.79Å; L385-T389 PolarHBondContact O-OG1 2.69Å
386	D	92.2	Very high	92.6	Very high	105 Å²	105	93.7 Å²	93.7	56%	0.561	47%	0.473	S	S	*	.	H	α-helix	trans	-62.4	-40.1	177.6	-172	62.1	0	0	0	112.1	E382 S383 T389 T390	E382-D386 WeakPolarHBondContact O-CB 3.49Å; E382-D386 PolarHBondContact O-N 3.25Å; S383-D386 PolarHBondContact O-N 3.34Å; D386-T389 PolarHBondContact O-N 2.93Å; D386-T390 VanDerWaalsContact O-CB 3.26Å; D386-T390 WeakPolarHBondContact O-CB 3.38Å; D386-T390 PolarHBondContact O-N 3.42Å; D386-T390 PolarHBondContact O-OG1 3.21Å
387	L	94.7	Very high	92.8	Very high	81 Å²	81	96.4 Å²	96.4	42%	0.424	48%	0.478	S	S	.	.	H	α-helix	trans	-60.7	-48.8	173.2	178.3	64.1	0	0	0	111.6	S383 Q384 L385 T389 T390 Q391	S383-L387 WeakPolarHBondContact O-CB 3.33Å; S383-L387 PolarHBondContact O-N 3.39Å; Q384-L387 PolarHBondContact O-N 3.14Å; L385-L387 VanDerWaalsContact C-N 3.34Å; L385-L387 PolarHBondContact O-N 3.49Å; L387-T389 VanDerWaalsContact C-N 3.34Å; L387-T390 PolarHBondContact O-N 3.41Å; L387-Q391 HydrophobicContact CD1-CG 4.36Å; L387-Q391 WeakPolarHBondContact O-CB 3.37Å; L387-Q391 VanDerWaalsContact O-CG 3.28Å; L387-Q391 WeakPolarHBondContact O-CG 3.4Å; L387-Q391 PolarHBondContact O-N 2.83Å
388	I	93	Very high	93.1	Very high	96 Å²	96	98.3 Å²	98.3	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-63.7	-43.2	178.7	-69.4	167.6	0	0	0	110.3	Q384 L385 Q391 S392	Q384-I388 VanDerWaalsContact O-CG1 3.28Å; Q384-I388 WeakPolarHBondContact O-CG1 3.42Å; Q384-I388 PolarHBondContact O-N 3.42Å; L385-I388 PolarHBondContact O-N 3.23Å; I388-Q391 PolarHBondContact O-N 3.09Å; I388-S392 WeakPolarHBondContact O-CB 3.32Å; I388-S392 PolarHBondContact O-N 3.2Å; I388-S392 PolarHBondContact O-OG 2.95Å
389	T	93.9	Very high	93.5	Very high	65 Å²	65	98.3 Å²	98.3	40%	0.399	49%	0.494	S	S	.	.	H	α-helix	trans	-61.3	-48.3	177.5	-67.5	0	0	0	0	110.6	L385 D386 L387 Q391 S392 N393	L385-T389 VanDerWaalsContact O-CB 3.31Å; L385-T389 WeakPolarHBondContact O-CB 3.41Å; L385-T389 PolarHBondContact O-N 2.79Å; L385-T389 PolarHBondContact O-OG1 2.69Å; D386-T389 PolarHBondContact O-N 2.93Å; L387-T389 VanDerWaalsContact C-N 3.34Å; T389-Q391 PolarHBondContact O-N 3.22Å; T389-S392 WeakPolarHBondContact CA-OG 3.46Å; T389-S392 PolarHBondContact O-N 3.05Å; T389-S392 PolarHBondContact O-OG 3.49Å; T389-N393 WeakPolarHBondContact O-CB 3.44Å; T389-N393 VanDerWaalsContact O-CG 3.27Å; T389-N393 PolarHBondContact O-N 3.32Å
390	T	94.3	Very high	93.8	Very high	59 Å²	59	102.3 Å²	102.3	36%	0.362	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-45	177	-57.9	0	0	0	0	111.5	D386 L387 S392 N393 M394	D386-T390 VanDerWaalsContact O-CB 3.26Å; D386-T390 WeakPolarHBondContact O-CB 3.38Å; D386-T390 PolarHBondContact O-N 3.42Å; D386-T390 PolarHBondContact O-OG1 3.21Å; L387-T390 PolarHBondContact O-N 3.41Å; T390-S392 VanDerWaalsContact C-N 3.31Å; T390-S392 PolarHBondContact O-N 2.92Å; T390-N393 PolarHBondContact O-N 3.37Å; T390-M394 HydrophobicContact CG2-CE 4.26Å; T390-M394 WeakPolarHBondContact O-CG 3.3Å; T390-M394 PolarHBondContact O-N 2.97Å
391	Q	95	Very high	93.9	Very high	84 Å²	84	99.8 Å²	99.8	39%	0.393	51%	0.507	S	S	.	.	H	α-helix	trans	-61.2	-39.5	174.5	-75.8	-179.1	2	0	0	112.7	L387 I388 T389 M394 R395	L387-Q391 HydrophobicContact CD1-CG 4.36Å; L387-Q391 WeakPolarHBondContact O-CB 3.37Å; L387-Q391 VanDerWaalsContact O-CG 3.28Å; L387-Q391 WeakPolarHBondContact O-CG 3.4Å; L387-Q391 PolarHBondContact O-N 2.83Å; I388-Q391 PolarHBondContact O-N 3.09Å; T389-Q391 PolarHBondContact O-N 3.22Å; Q391-M394 HydrophobicContact CB-CE 4.49Å; Q391-M394 HydrophobicContact CG-CE 4.15Å; Q391-R395 WeakPolarHBondContact O-CG 2.9Å; Q391-R395 PolarHBondContact O-N 2.85Å
392	S	92.6	Very high	94	Very high	49 Å²	49	97.5 Å²	97.5	34%	0.343	51%	0.506	S	S	.	.	H	α-helix	trans	-68.2	-41.3	177.5	70.6	0	0	0	0	111.9	I388 T389 T390 R395 L396	I388-S392 WeakPolarHBondContact O-CB 3.32Å; I388-S392 PolarHBondContact O-N 3.2Å; I388-S392 PolarHBondContact O-OG 2.95Å; T389-S392 WeakPolarHBondContact CA-OG 3.46Å; T389-S392 PolarHBondContact O-N 3.05Å; T389-S392 PolarHBondContact O-OG 3.49Å; T390-S392 VanDerWaalsContact C-N 3.31Å; T390-S392 PolarHBondContact O-N 2.92Å; S392-R395 PolarHBondContact O-N 2.74Å; S392-L396 WeakPolarHBondContact O-CG 3.29Å; S392-L396 PolarHBondContact O-N 3.14Å
393	N	94.5	Very high	94.1	Very high	75 Å²	75	96 Å²	96	40%	0.401	50%	0.504	S	S	.	.	H	α-helix	trans	-64.3	-44.4	176.7	-70	-15.2	0	0	0	111.3	T389 T390 R395 L396 E397	T389-N393 WeakPolarHBondContact O-CB 3.44Å; T389-N393 VanDerWaalsContact O-CG 3.27Å; T389-N393 PolarHBondContact O-N 3.32Å; T390-N393 PolarHBondContact O-N 3.37Å; N393-R395 VanDerWaalsContact C-N 3.3Å; N393-R395 PolarHBondContact O-N 3.24Å; N393-L396 WeakPolarHBondContact O-CB 3.27Å; N393-L396 PolarHBondContact O-N 3.36Å; N393-L396 VanDerWaalsContact O-N 3.1Å; N393-E397 WeakPolarHBondContact O-CG 3.49Å; N393-E397 PolarHBondContact O-N 3.47Å
394	M	94.8	Very high	94.2	Very high	105 Å²	105	98.3 Å²	98.3	52%	0.517	51%	0.507	S	S	.	.	H	α-helix	trans	-58.4	-40.9	175	-72.6	-172.9	-65.6	0	0	112.4	T390 Q391 E397 E398	T390-M394 HydrophobicContact CG2-CE 4.26Å; T390-M394 WeakPolarHBondContact O-CG 3.3Å; T390-M394 PolarHBondContact O-N 2.97Å; Q391-M394 HydrophobicContact CB-CE 4.49Å; Q391-M394 HydrophobicContact CG-CE 4.15Å; M394-E397 PolarHBondContact O-N 2.9Å; M394-E398 WeakPolarHBondContact O-CB 3.47Å; M394-E398 PolarHBondContact O-N 3.49Å
395	R	95.4	Very high	94.3	Very high	179 Å²	179	98.5 Å²	98.5	68%	0.675	52%	0.516	S	S	*	.	H	α-helix	trans	-67.9	-35.9	176.2	-73.5	177.8	-179.1	172.9	4.5	112.6	Q391 S392 N393 M399	Q391-R395 WeakPolarHBondContact O-CG 2.9Å; Q391-R395 PolarHBondContact O-N 2.85Å; S392-R395 PolarHBondContact O-N 2.74Å; N393-R395 VanDerWaalsContact C-N 3.3Å; N393-R395 PolarHBondContact O-N 3.24Å; R395-M399 WeakPolarHBondContact O-CB 3.44Å; R395-M399 PolarHBondContact O-N 3.12Å
396	L	93.5	Very high	94.6	Very high	99 Å²	99	96.1 Å²	96.1	52%	0.518	51%	0.512	S	S	.	.	H	α-helix	trans	-66.5	-46.3	175.5	-73.2	172.7	0	0	0	110.4	S392 N393 E398 M399 E400	S392-L396 WeakPolarHBondContact O-CG 3.29Å; S392-L396 PolarHBondContact O-N 3.14Å; N393-L396 WeakPolarHBondContact O-CB 3.27Å; N393-L396 PolarHBondContact O-N 3.36Å; N393-L396 VanDerWaalsContact O-N 3.1Å; L396-E398 PolarHBondContact O-N 2.76Å; L396-M399 PolarHBondContact O-N 2.83Å; L396-E400 WeakPolarHBondContact O-CB 3.31Å; L396-E400 VanDerWaalsContact O-CG 3.3Å; L396-E400 WeakPolarHBondContact O-CG 3.26Å; L396-E400 PolarHBondContact O-N 3.49Å
397	E	95.4	Very high	94.8	Very high	126 Å²	126	95.1 Å²	95.1	59%	0.589	51%	0.507	S	S	*	.	H	α-helix	trans	-61.3	-42.5	176.6	-71.4	174.1	-173.6	0	0	112.4	N393 M394 E400 S401	N393-E397 WeakPolarHBondContact O-CG 3.49Å; N393-E397 PolarHBondContact O-N 3.47Å; M394-E397 PolarHBondContact O-N 2.9Å; E397-E400 PolarHBondContact O-N 2.65Å; E397-S401 WeakPolarHBondContact O-CB 3.46Å; E397-S401 PolarHBondContact O-N 3.49Å
398	E	95	Very high	94.8	Very high	143 Å²	143	93.8 Å²	93.8	67%	0.668	50%	0.504	S	S	*	.	H	α-helix	trans	-61.3	-44.2	174.6	-176	-179.8	-170.2	0	0	111.4	M394 L396 S401 S402	M394-E398 WeakPolarHBondContact O-CB 3.47Å; M394-E398 PolarHBondContact O-N 3.49Å; L396-E398 PolarHBondContact O-N 2.76Å; E398-S401 PolarHBondContact O-N 2.89Å; E398-S402 WeakPolarHBondContact O-CB 3.34Å; E398-S402 PolarHBondContact O-N 3.3Å
399	M	92.8	Very high	94.9	Very high	120 Å²	120	91.7 Å²	91.7	59%	0.591	50%	0.501	S	S	*	.	H	α-helix	trans	-66.1	-43.8	177.5	-170.5	63.7	60.9	0	0	111.6	R395 L396 S402 V403	R395-M399 WeakPolarHBondContact O-CB 3.44Å; R395-M399 PolarHBondContact O-N 3.12Å; L396-M399 PolarHBondContact O-N 2.83Å; M399-S402 PolarHBondContact O-N 2.96Å; M399-V403 HydrophobicContact CG-CG2 4.48Å; M399-V403 WeakPolarHBondContact O-CB 3.28Å; M399-V403 VanDerWaalsContact O-CG2 3.27Å; M399-V403 WeakPolarHBondContact O-CG2 3.43Å; M399-V403 PolarHBondContact O-N 3.43Å
400	E	95.9	Very high	94.9	Very high	132 Å²	132	90.9 Å²	90.9	62%	0.617	50%	0.501	S	S	*	.	H	α-helix	trans	-60.4	-45.2	176.8	-76.8	178.9	174.9	0	0	111.1	L396 E397 S402 V403 E404	L396-E400 WeakPolarHBondContact O-CB 3.31Å; L396-E400 VanDerWaalsContact O-CG 3.3Å; L396-E400 WeakPolarHBondContact O-CG 3.26Å; L396-E400 PolarHBondContact O-N 3.49Å; E397-E400 PolarHBondContact O-N 2.65Å; E400-S402 PolarHBondContact O-N 3.33Å; E400-V403 PolarHBondContact O-N 2.57Å; E400-E404 WeakPolarHBondContact O-CB 3.09Å; E400-E404 PolarHBondContact O-N 2.9Å
401	S	95	Very high	95	Very high	84 Å²	84	92.7 Å²	92.7	59%	0.587	51%	0.506	S	S	*	.	H	α-helix	trans	-61.4	-42.8	174.6	-173.3	0	0	0	0	112.1	E397 E398 V403 E404 S405	E397-S401 WeakPolarHBondContact O-CB 3.46Å; E397-S401 PolarHBondContact O-N 3.49Å; E398-S401 PolarHBondContact O-N 2.89Å; S401-V403 VanDerWaalsContact C-N 3.35Å; S401-V403 PolarHBondContact O-N 3.24Å; S401-E404 PolarHBondContact O-N 2.96Å; S401-S405 WeakPolarHBondContact O-CB 3.46Å; S401-S405 PolarHBondContact O-N 3.47Å
402	S	95.4	Very high	95.1	Very high	74 Å²	74	92.2 Å²	92.2	52%	0.517	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-38.8	175.9	-175.1	0	0	0	0	112.2	E398 M399 E400 A406	E398-S402 WeakPolarHBondContact O-CB 3.34Å; E398-S402 PolarHBondContact O-N 3.3Å; M399-S402 PolarHBondContact O-N 2.96Å; E400-S402 PolarHBondContact O-N 3.33Å; S402-A406 WeakPolarHBondContact O-CB 3.45Å; S402-A406 PolarHBondContact O-N 3.05Å
403	V	95.8	Very high	95.2	Very high	85 Å²	85	92.5 Å²	92.5	52%	0.515	51%	0.514	S	S	.	.	H	α-helix	trans	-68.3	-43.3	177.7	168.9	0	0	0	0	110.6	M399 E400 S401 S405 A406 L407	M399-V403 HydrophobicContact CG-CG2 4.48Å; M399-V403 WeakPolarHBondContact O-CB 3.28Å; M399-V403 VanDerWaalsContact O-CG2 3.27Å; M399-V403 WeakPolarHBondContact O-CG2 3.43Å; M399-V403 PolarHBondContact O-N 3.43Å; E400-V403 PolarHBondContact O-N 2.57Å; S401-V403 VanDerWaalsContact C-N 3.35Å; S401-V403 PolarHBondContact O-N 3.24Å; V403-S405 PolarHBondContact O-N 2.74Å; V403-A406 PolarHBondContact O-N 3Å; V403-L407 WeakPolarHBondContact O-CB 3.33Å; V403-L407 PolarHBondContact O-N 3.19Å
404	E	95.8	Very high	95.2	Very high	121 Å²	121	95.3 Å²	95.3	57%	0.565	52%	0.524	S	S	*	.	H	α-helix	trans	-63.9	-41.3	177	-171.5	59.8	-149.4	0	0	111.6	E400 S401 A406 L407 S408	E400-E404 WeakPolarHBondContact O-CB 3.09Å; E400-E404 PolarHBondContact O-N 2.9Å; S401-E404 PolarHBondContact O-N 2.96Å; E404-A406 VanDerWaalsContact C-N 3.35Å; E404-A406 PolarHBondContact O-N 2.86Å; E404-L407 PolarHBondContact O-N 3.08Å; E404-S408 WeakPolarHBondContact O-CB 3.36Å; E404-S408 PolarHBondContact O-N 2.95Å; E404-S408 PolarHBondContact O-OG 2.8Å
405	S	95.6	Very high	95.3	Very high	77 Å²	77	97 Å²	97	54%	0.538	53%	0.529	S	S	.	.	H	α-helix	trans	-63.7	-39.3	173.1	-174.9	0	0	0	0	112.1	S401 V403 S408 A409	S401-S405 WeakPolarHBondContact O-CB 3.46Å; S401-S405 PolarHBondContact O-N 3.47Å; V403-S405 PolarHBondContact O-N 2.74Å; S405-S408 PolarHBondContact O-OG 2.76Å; S405-A409 WeakPolarHBondContact O-CB 3.33Å; S405-A409 PolarHBondContact O-N 2.98Å; S405-A409 VanDerWaalsContact O-N 3.08Å
406	A	95	Very high	95.3	Very high	59 Å²	59	95 Å²	95	49%	0.488	53%	0.525	S	S	.	.	H	α-helix	trans	-70.1	-38.9	177.4	0	0	0	0	0	111.9	S402 V403 E404 A409 A410	S402-A406 WeakPolarHBondContact O-CB 3.45Å; S402-A406 PolarHBondContact O-N 3.05Å; V403-A406 PolarHBondContact O-N 3Å; E404-A406 VanDerWaalsContact C-N 3.35Å; E404-A406 PolarHBondContact O-N 2.86Å; A406-A409 PolarHBondContact O-N 3.42Å; A406-A410 WeakPolarHBondContact O-CB 3.48Å; A406-A410 PolarHBondContact O-N 3.48Å
407	L	96.5	Very high	95.4	Very high	85 Å²	85	95.2 Å²	95.2	45%	0.445	53%	0.526	S	S	.	.	H	α-helix	trans	-63.8	-48.5	177.3	-170.4	95.7	0	0	0	111	V403 E404 A409 A410 Q411	V403-L407 WeakPolarHBondContact O-CB 3.33Å; V403-L407 PolarHBondContact O-N 3.19Å; E404-L407 PolarHBondContact O-N 3.08Å; L407-A409 VanDerWaalsContact C-N 3.35Å; L407-A409 PolarHBondContact O-N 3.27Å; L407-A410 PolarHBondContact O-N 3.38Å; L407-Q411 WeakPolarHBondContact O-CG 3.36Å; L407-Q411 PolarHBondContact O-N 2.98Å
408	S	95.1	Very high	95.4	Very high	52 Å²	52	91.7 Å²	91.7	36%	0.364	52%	0.516	S	S	.	.	H	α-helix	trans	-62.4	-41.6	176.5	58.3	0	0	0	0	111.7	E404 S405 A410 Q411 T412	E404-S408 WeakPolarHBondContact O-CB 3.36Å; E404-S408 PolarHBondContact O-N 2.95Å; E404-S408 PolarHBondContact O-OG 2.8Å; S405-S408 PolarHBondContact O-OG 2.76Å; S408-A410 PolarHBondContact O-N 3.49Å; S408-Q411 PolarHBondContact O-N 3.39Å; S408-T412 WeakPolarHBondContact O-CG2 3.46Å; S408-T412 PolarHBondContact O-N 3.37Å
409	A	95.8	Very high	95.5	Very high	53 Å²	53	90.4 Å²	90.4	44%	0.438	51%	0.51	S	S	.	.	H	α-helix	trans	-60.1	-45.5	173	0	0	0	0	0	111.9	S405 A406 L407 T412 A413	S405-A409 WeakPolarHBondContact O-CB 3.33Å; S405-A409 PolarHBondContact O-N 2.98Å; S405-A409 VanDerWaalsContact O-N 3.08Å; A406-A409 PolarHBondContact O-N 3.42Å; L407-A409 VanDerWaalsContact C-N 3.35Å; L407-A409 PolarHBondContact O-N 3.27Å; A409-T412 PolarHBondContact O-N 2.89Å; A409-T412 PolarHBondContact O-OG1 3.07Å; A409-A413 PolarHBondContact O-N 2.99Å
410	A	94.8	Very high	95.6	Very high	48 Å²	48	88.7 Å²	88.7	40%	0.397	51%	0.506	S	S	.	.	H	α-helix	trans	-60.8	-45.8	176.7	0	0	0	0	0	112	A406 L407 S408 T412 A413 E414	A406-A410 WeakPolarHBondContact O-CB 3.48Å; A406-A410 PolarHBondContact O-N 3.48Å; L407-A410 PolarHBondContact O-N 3.38Å; S408-A410 PolarHBondContact O-N 3.49Å; A410-T412 VanDerWaalsContact C-N 3.33Å; A410-T412 PolarHBondContact O-N 2.87Å; A410-A413 WeakPolarHBondContact O-CB 3.45Å; A410-A413 PolarHBondContact O-N 3.5Å; A410-A413 VanDerWaalsContact O-N 3.13Å; A410-E414 WeakPolarHBondContact O-CG 3.35Å; A410-E414 PolarHBondContact O-N 3.23Å
411	Q	96	Very high	95.6	Very high	96 Å²	96	86.6 Å²	86.6	45%	0.449	50%	0.498	S	S	.	.	H	α-helix	trans	-60.9	-39.7	176.2	-72	177.1	6.1	0	0	112.5	L407 S408 A413 E414 K415	L407-Q411 WeakPolarHBondContact O-CG 3.36Å; L407-Q411 PolarHBondContact O-N 2.98Å; S408-Q411 PolarHBondContact O-N 3.39Å; Q411-A413 VanDerWaalsContact C-N 3.35Å; Q411-E414 PolarHBondContact O-N 3.47Å; Q411-K415 WeakPolarHBondContact O-CG 3.36Å; Q411-K415 PolarHBondContact O-N 3.1Å
412	T	95.9	Very high	95.7	Very high	74 Å²	74	89.2 Å²	89.2	45%	0.454	50%	0.499	S	S	.	.	H	α-helix	trans	-67.1	-37	175.3	64.8	0	0	0	0	112.1	S408 A409 A410 K415 K416	S408-T412 WeakPolarHBondContact O-CG2 3.46Å; S408-T412 PolarHBondContact O-N 3.37Å; A409-T412 PolarHBondContact O-N 2.89Å; A409-T412 PolarHBondContact O-OG1 3.07Å; A410-T412 VanDerWaalsContact C-N 3.33Å; A410-T412 PolarHBondContact O-N 2.87Å; T412-K415 PolarHBondContact O-N 3.48Å; T412-K416 WeakPolarHBondContact O-CG 3.5Å; T412-K416 PolarHBondContact O-N 3.48Å; T412-K416 VanDerWaalsContact O-N 3.1Å
413	A	94.9	Very high	95.7	Very high	55 Å²	55	91.3 Å²	91.3	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-66.5	-41.8	175.8	0	0	0	0	0	111.5	A409 A410 Q411 K415 K416 L417	A409-A413 PolarHBondContact O-N 2.99Å; A410-A413 WeakPolarHBondContact O-CB 3.45Å; A410-A413 PolarHBondContact O-N 3.5Å; A410-A413 VanDerWaalsContact O-N 3.13Å; Q411-A413 VanDerWaalsContact C-N 3.35Å; A413-K415 PolarHBondContact O-N 2.85Å; A413-K416 PolarHBondContact O-N 3.16Å; A413-L417 WeakPolarHBondContact O-CB 3.39Å; A413-L417 PolarHBondContact O-N 3.13Å
414	E	95.9	Very high	95.7	Very high	134 Å²	134	91.8 Å²	91.8	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-61.6	-42.7	175.2	-74.9	-179.4	173.1	0	0	112.2	A410 Q411 L417 S418	A410-E414 WeakPolarHBondContact O-CG 3.35Å; A410-E414 PolarHBondContact O-N 3.23Å; Q411-E414 PolarHBondContact O-N 3.47Å; E414-L417 PolarHBondContact O-N 3.43Å; E414-S418 WeakPolarHBondContact O-CB 3.22Å; E414-S418 PolarHBondContact O-N 2.92Å
415	K	95.7	Very high	95.7	Very high	140 Å²	140	90.3 Å²	90.3	61%	0.609	50%	0.496	S	S	*	.	H	α-helix	trans	-59.5	-50.1	174.9	-74.9	177.2	-177.1	175.5	0	111.3	Q411 T412 A413 L417 S418 E419	Q411-K415 WeakPolarHBondContact O-CG 3.36Å; Q411-K415 PolarHBondContact O-N 3.1Å; T412-K415 PolarHBondContact O-N 3.48Å; A413-K415 PolarHBondContact O-N 2.85Å; K415-L417 VanDerWaalsContact C-N 3.34Å; K415-L417 PolarHBondContact O-N 2.7Å; K415-S418 WeakPolarHBondContact O-CB 3.41Å; K415-S418 PolarHBondContact O-N 3.34Å; K415-S418 VanDerWaalsContact O-N 3.16Å; K415-S418 PolarHBondContact O-OG 3.37Å; K415-E419 PolarHBondContact O-N 3.05Å
416	K	96.4	Very high	95.7	Very high	137 Å²	137	89.7 Å²	89.7	60%	0.596	49%	0.488	S	S	*	.	H	α-helix	trans	-59.9	-42.9	177	-72.2	175.1	-179.3	176.8	0	111.9	T412 A413 S418 E419 V420	T412-K416 WeakPolarHBondContact O-CG 3.5Å; T412-K416 PolarHBondContact O-N 3.48Å; T412-K416 VanDerWaalsContact O-N 3.1Å; A413-K416 PolarHBondContact O-N 3.16Å; K416-S418 VanDerWaalsContact C-N 3.31Å; K416-S418 PolarHBondContact O-N 3.43Å; K416-E419 PolarHBondContact O-N 2.94Å; K416-V420 WeakPolarHBondContact O-CG2 3.43Å; K416-V420 PolarHBondContact O-N 3.23Å
417	L	95.5	Very high	95.8	Very high	104 Å²	104	92 Å²	92	55%	0.545	49%	0.492	S	S	.	.	H	α-helix	trans	-60.9	-42.2	176.7	-178.5	61.8	0	0	0	111.1	A413 E414 K415 E419 V420 I421	A413-L417 WeakPolarHBondContact O-CB 3.39Å; A413-L417 PolarHBondContact O-N 3.13Å; E414-L417 PolarHBondContact O-N 3.43Å; K415-L417 VanDerWaalsContact C-N 3.34Å; K415-L417 PolarHBondContact O-N 2.7Å; L417-E419 VanDerWaalsContact C-N 3.32Å; L417-E419 PolarHBondContact O-N 3.34Å; L417-V420 PolarHBondContact O-N 3.44Å; L417-I421 HydrophobicContact CD1-CD1 4.22Å; L417-I421 HydrophobicContact CD1-CG1 4.42Å; L417-I421 HydrophobicContact CG-CD1 3.95Å; L417-I421 WeakPolarHBondContact O-CB 3.35Å; L417-I421 VanDerWaalsContact O-CG1 3.22Å; L417-I421 WeakPolarHBondContact O-CG1 3.48Å; L417-I421 PolarHBondContact O-N 2.91Å
418	S	95.4	Very high	95.8	Very high	52 Å²	52	90.1 Å²	90.1	36%	0.364	49%	0.485	S	S	.	.	H	α-helix	trans	-64.4	-35.1	177.2	83.4	0	0	0	0	113	E414 K415 K416 K422	E414-S418 WeakPolarHBondContact O-CB 3.22Å; E414-S418 PolarHBondContact O-N 2.92Å; K415-S418 WeakPolarHBondContact O-CB 3.41Å; K415-S418 PolarHBondContact O-N 3.34Å; K415-S418 VanDerWaalsContact O-N 3.16Å; K415-S418 PolarHBondContact O-OG 3.37Å; K416-S418 VanDerWaalsContact C-N 3.31Å; K416-S418 PolarHBondContact O-N 3.43Å; S418-K422 WeakPolarHBondContact O-CG 3.33Å; S418-K422 PolarHBondContact O-N 3.05Å
419	E	95.8	Very high	95.8	Very high	116 Å²	116	94.9 Å²	94.9	54%	0.542	50%	0.495	S	S	.	.	H	α-helix	trans	-67.9	-49.5	174.2	-72.7	179.4	166.6	0	0	111	K415 K416 L417 I421 K422 E423	K415-E419 PolarHBondContact O-N 3.05Å; K416-E419 PolarHBondContact O-N 2.94Å; L417-E419 VanDerWaalsContact C-N 3.32Å; L417-E419 PolarHBondContact O-N 3.34Å; E419-I421 VanDerWaalsContact C-N 3.28Å; E419-I421 PolarHBondContact O-N 3.31Å; E419-K422 WeakPolarHBondContact O-CB 3.48Å; E419-K422 PolarHBondContact O-N 3.43Å; E419-E423 PolarHBondContact O-N 3.4Å
420	V	96.1	Very high	95.8	Very high	84 Å²	84	98.8 Å²	98.8	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-59.1	-39.1	177.6	171.3	0	0	0	0	111.5	K416 L417 E423 N424	K416-V420 WeakPolarHBondContact O-CG2 3.43Å; K416-V420 PolarHBondContact O-N 3.23Å; L417-V420 PolarHBondContact O-N 3.44Å; V420-E423 PolarHBondContact O-N 2.98Å; V420-N424 VanDerWaalsContact O-CB 3.24Å; V420-N424 WeakPolarHBondContact O-CB 3.24Å; V420-N424 PolarHBondContact O-N 2.91Å
421	I	96.5	Very high	95.8	Very high	89 Å²	89	101.7 Å²	101.7	46%	0.456	51%	0.511	S	S	.	.	H	α-helix	trans	-63	-44.2	175.2	-71.2	166.2	0	0	0	110.9	L417 E419 N424 L425	L417-I421 HydrophobicContact CD1-CD1 4.22Å; L417-I421 HydrophobicContact CD1-CG1 4.42Å; L417-I421 HydrophobicContact CG-CD1 3.95Å; L417-I421 WeakPolarHBondContact O-CB 3.35Å; L417-I421 VanDerWaalsContact O-CG1 3.22Å; L417-I421 WeakPolarHBondContact O-CG1 3.48Å; L417-I421 PolarHBondContact O-N 2.91Å; E419-I421 VanDerWaalsContact C-N 3.28Å; E419-I421 PolarHBondContact O-N 3.31Å; I421-N424 PolarHBondContact O-N 3.08Å; I421-L425 HydrophobicContact CG2-CD1 4.29Å; I421-L425 WeakPolarHBondContact O-CG 3.33Å; I421-L425 PolarHBondContact O-N 2.85Å
422	K	95.7	Very high	95.7	Very high	139 Å²	139	106.5 Å²	106.5	60%	0.604	52%	0.524	S	S	*	.	H	α-helix	trans	-62.6	-45	177.3	-72.9	169.9	-175.1	171.6	0	111.4	S418 E419 L425 V426	S418-K422 WeakPolarHBondContact O-CG 3.33Å; S418-K422 PolarHBondContact O-N 3.05Å; E419-K422 WeakPolarHBondContact O-CB 3.48Å; E419-K422 PolarHBondContact O-N 3.43Å; K422-L425 PolarHBondContact O-N 3.18Å; K422-V426 WeakPolarHBondContact O-CG2 3.15Å; K422-V426 PolarHBondContact O-N 3.13Å; K422-V426 VanDerWaalsContact O-N 3.08Å
423	E	96.3	Very high	95.7	Very high	118 Å²	118	109.1 Å²	109.1	55%	0.551	53%	0.532	S	S	*	.	H	α-helix	trans	-62.8	-44.2	176.9	-70.7	-175.9	171	0	0	111.8	E419 V420 L425 V426 I427	E419-E423 PolarHBondContact O-N 3.4Å; V420-E423 PolarHBondContact O-N 2.98Å; E423-L425 VanDerWaalsContact C-N 3.33Å; E423-L425 PolarHBondContact O-N 3.12Å; E423-V426 PolarHBondContact O-N 3.41Å; E423-V426 VanDerWaalsContact O-N 3.12Å; E423-I427 WeakPolarHBondContact O-CG1 3.39Å; E423-I427 PolarHBondContact O-N 2.84Å
424	N	95.8	Very high	95.7	Very high	94 Å²	94	109.2 Å²	109.2	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-60.8	-41.8	177.1	-169.3	-45.7	0	0	0	111.4	V420 I421 V426 I427 S428	V420-N424 VanDerWaalsContact O-CB 3.24Å; V420-N424 WeakPolarHBondContact O-CB 3.24Å; V420-N424 PolarHBondContact O-N 2.91Å; I421-N424 PolarHBondContact O-N 3.08Å; N424-V426 VanDerWaalsContact C-N 3.33Å; N424-V426 PolarHBondContact O-N 3.4Å; N424-I427 PolarHBondContact O-N 3.43Å; N424-S428 WeakPolarHBondContact O-CB 3.33Å; N424-S428 PolarHBondContact O-N 2.81Å; N424-S428 PolarHBondContact O-OG 3.35Å; N424-S428 PolarHBondContact OD1-OG 2.8Å; N424-S428 VanDerWaalsContact OD1-OG 3.13Å
425	L	95.5	Very high	95.7	Very high	91 Å²	91	105.9 Å²	105.9	48%	0.476	52%	0.521	S	S	.	.	H	α-helix	trans	-62.6	-38.5	174.7	-73	174	0	0	0	112.5	I421 K422 E423 R429	I421-L425 HydrophobicContact CG2-CD1 4.29Å; I421-L425 WeakPolarHBondContact O-CG 3.33Å; I421-L425 PolarHBondContact O-N 2.85Å; K422-L425 PolarHBondContact O-N 3.18Å; E423-L425 VanDerWaalsContact C-N 3.33Å; E423-L425 PolarHBondContact O-N 3.12Å; L425-R429 WeakPolarHBondContact O-CG 3.32Å; L425-R429 PolarHBondContact O-N 3.44Å
426	V	96	Very high	95.7	Very high	64 Å²	64	102.4 Å²	102.4	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-47.7	176.4	171.4	0	0	0	0	111	K422 E423 N424 S428 R429 K430	K422-V426 WeakPolarHBondContact O-CG2 3.15Å; K422-V426 PolarHBondContact O-N 3.13Å; K422-V426 VanDerWaalsContact O-N 3.08Å; E423-V426 PolarHBondContact O-N 3.41Å; E423-V426 VanDerWaalsContact O-N 3.12Å; N424-V426 VanDerWaalsContact C-N 3.33Å; N424-V426 PolarHBondContact O-N 3.4Å; V426-S428 VanDerWaalsContact C-N 3.35Å; V426-R429 PolarHBondContact O-N 3.22Å; V426-K430 HydrophobicContact CG1-CD 4.31Å; V426-K430 WeakPolarHBondContact O-CG 3.39Å; V426-K430 PolarHBondContact O-N 3.27Å
427	I	96	Very high	95.7	Very high	108 Å²	108	100.6 Å²	100.6	55%	0.554	51%	0.511	S	S	*	.	H	α-helix	trans	-62	-45	178.4	-68.2	167.8	0	0	0	110.1	E423 N424 R429 K430 L431	E423-I427 WeakPolarHBondContact O-CG1 3.39Å; E423-I427 PolarHBondContact O-N 2.84Å; N424-I427 PolarHBondContact O-N 3.43Å; I427-R429 VanDerWaalsContact C-N 3.32Å; I427-R429 PolarHBondContact O-N 2.94Å; I427-K430 PolarHBondContact O-N 3.07Å; I427-L431 WeakPolarHBondContact O-CB 3.46Å; I427-L431 PolarHBondContact O-N 3.37Å
428	S	96	Very high	95.7	Very high	44 Å²	44	98.3 Å²	98.3	31%	0.308	51%	0.507	S	S	.	.	H	α-helix	trans	-60.7	-38.6	177.1	-70.9	0	0	0	0	112.5	N424 V426 R432	N424-S428 WeakPolarHBondContact O-CB 3.33Å; N424-S428 PolarHBondContact O-N 2.81Å; N424-S428 PolarHBondContact O-OG 3.35Å; N424-S428 PolarHBondContact OD1-OG 2.8Å; N424-S428 VanDerWaalsContact OD1-OG 3.13Å; V426-S428 VanDerWaalsContact C-N 3.35Å; S428-R432 WeakPolarHBondContact O-CG 3.38Å; S428-R432 PolarHBondContact O-N 3.27Å
429	R	95.5	Very high	95.7	Very high	152 Å²	152	101.3 Å²	101.3	57%	0.574	52%	0.515	S	S	*	.	H	α-helix	trans	-66.2	-47.2	173.4	-78.9	-176.7	-127.5	154.1	0.3	112.2	L425 V426 I427 L431 R432 Q433	L425-R429 WeakPolarHBondContact O-CG 3.32Å; L425-R429 PolarHBondContact O-N 3.44Å; V426-R429 PolarHBondContact O-N 3.22Å; I427-R429 VanDerWaalsContact C-N 3.32Å; I427-R429 PolarHBondContact O-N 2.94Å; R429-L431 VanDerWaalsContact C-N 3.29Å; R429-L431 PolarHBondContact O-N 2.94Å; R429-R432 PolarHBondContact O-N 2.98Å; R429-Q433 WeakPolarHBondContact O-CG 3.33Å; R429-Q433 PolarHBondContact O-N 3.38Å
430	K	95.8	Very high	95.7	Very high	136 Å²	136	103 Å²	103	59%	0.591	52%	0.517	S	S	*	.	H	α-helix	trans	-60.4	-41.3	177.4	-73.2	-179.6	178.7	-179.4	0	111.4	V426 I427 Q433 A434	V426-K430 HydrophobicContact CG1-CD 4.31Å; V426-K430 WeakPolarHBondContact O-CG 3.39Å; V426-K430 PolarHBondContact O-N 3.27Å; I427-K430 PolarHBondContact O-N 3.07Å; K430-Q433 PolarHBondContact O-N 3.04Å; K430-A434 WeakPolarHBondContact O-CB 3.36Å; K430-A434 PolarHBondContact O-N 3.26Å
431	L	95.2	Very high	95.7	Very high	109 Å²	109	103.8 Å²	103.8	57%	0.571	52%	0.518	S	S	*	.	H	α-helix	trans	-62.3	-47.4	176.5	-175.2	63.8	0	0	0	110.9	I427 R429 Q433 A434 T435	I427-L431 WeakPolarHBondContact O-CB 3.46Å; I427-L431 PolarHBondContact O-N 3.37Å; R429-L431 VanDerWaalsContact C-N 3.29Å; R429-L431 PolarHBondContact O-N 2.94Å; L431-Q433 VanDerWaalsContact C-N 3.32Å; L431-Q433 PolarHBondContact O-N 2.85Å; L431-A434 PolarHBondContact O-N 2.87Å; L431-T435 WeakPolarHBondContact O-CB 3.41Å; L431-T435 PolarHBondContact O-N 3.32Å; L431-T435 PolarHBondContact O-OG1 3.01Å
432	R	94.7	Very high	95.7	Very high	196 Å²	196	104.9 Å²	104.9	74%	0.74	52%	0.521	S	S	*	.	H	α-helix	trans	-59.2	-40.8	175.9	-74	177.7	-173.9	-174.1	2.4	112.7	S428 R429 S436	S428-R432 WeakPolarHBondContact O-CG 3.38Å; S428-R432 PolarHBondContact O-N 3.27Å; R429-R432 PolarHBondContact O-N 2.98Å; R432-S436 WeakPolarHBondContact O-CB 3.34Å; R432-S436 PolarHBondContact O-N 2.93Å; R432-S436 PolarHBondContact O-OG 2.87Å
433	Q	95	Very high	95.7	Very high	130 Å²	130	105.5 Å²	105.5	61%	0.607	52%	0.519	S	S	*	.	H	α-helix	trans	-67.1	-43	176.6	-71.9	173.8	-11.3	0	0	112.3	R429 K430 L431 S436 L437	R429-Q433 WeakPolarHBondContact O-CG 3.33Å; R429-Q433 PolarHBondContact O-N 3.38Å; K430-Q433 PolarHBondContact O-N 3.04Å; L431-Q433 VanDerWaalsContact C-N 3.32Å; L431-Q433 PolarHBondContact O-N 2.85Å; Q433-S436 PolarHBondContact O-OG 3.42Å; Q433-L437 WeakPolarHBondContact O-CB 3.41Å; Q433-L437 PolarHBondContact O-N 3.01Å
434	A	95.6	Very high	95.7	Very high	57 Å²	57	103 Å²	103	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-65	-42.2	176.6	0	0	0	0	0	111.4	K430 L431 L437 A438	K430-A434 WeakPolarHBondContact O-CB 3.36Å; K430-A434 PolarHBondContact O-N 3.26Å; L431-A434 PolarHBondContact O-N 2.87Å; A434-L437 PolarHBondContact O-N 3.03Å; A434-A438 WeakPolarHBondContact O-CB 3.49Å; A434-A438 PolarHBondContact O-N 3.02Å
435	T	96.2	Very high	95.7	Very high	63 Å²	63	102.6 Å²	102.6	39%	0.387	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-42.5	177.5	-57.8	0	0	0	0	111.9	L431 A438 Q439	L431-T435 WeakPolarHBondContact O-CB 3.41Å; L431-T435 PolarHBondContact O-N 3.32Å; L431-T435 PolarHBondContact O-OG1 3.01Å; T435-A438 PolarHBondContact O-N 2.99Å; T435-Q439 WeakPolarHBondContact O-CB 3.5Å; T435-Q439 WeakPolarHBondContact O-CG 3.32Å; T435-Q439 PolarHBondContact O-N 3.29Å
436	S	95	Very high	95.7	Very high	67 Å²	67	103.1 Å²	103.1	47%	0.469	51%	0.507	S	S	.	.	H	α-helix	trans	-67.9	-36.7	177.5	66.1	0	0	0	0	112.4	R432 Q433 R440	R432-S436 WeakPolarHBondContact O-CB 3.34Å; R432-S436 PolarHBondContact O-N 2.93Å; R432-S436 PolarHBondContact O-OG 2.87Å; Q433-S436 PolarHBondContact O-OG 3.42Å; S436-R440 WeakPolarHBondContact O-CB 3.48Å; S436-R440 PolarHBondContact O-N 3.37Å
437	L	96.2	Very high	95.7	Very high	100 Å²	100	106.2 Å²	106.2	52%	0.524	52%	0.517	S	S	.	.	H	α-helix	trans	-64.5	-45.3	172.9	-178.6	63.4	0	0	0	111.3	Q433 A434 Q439 R440 L441	Q433-L437 WeakPolarHBondContact O-CB 3.41Å; Q433-L437 PolarHBondContact O-N 3.01Å; A434-L437 PolarHBondContact O-N 3.03Å; L437-Q439 PolarHBondContact O-N 2.89Å; L437-R440 PolarHBondContact O-N 3.22Å; L437-L441 HydrophobicContact CD1-CD1 4.42Å; L437-L441 HydrophobicContact CD1-CG 4.4Å; L437-L441 HydrophobicContact CG-CD1 4.14Å; L437-L441 WeakPolarHBondContact O-CG 3.39Å; L437-L441 PolarHBondContact O-N 3.48Å
438	A	96	Very high	95.6	Very high	56 Å²	56	106.9 Å²	106.9	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-61.2	-43.2	177	0	0	0	0	0	111.8	A434 T435 R440 L441 Q442	A434-A438 WeakPolarHBondContact O-CB 3.49Å; A434-A438 PolarHBondContact O-N 3.02Å; T435-A438 PolarHBondContact O-N 2.99Å; A438-R440 VanDerWaalsContact C-N 3.34Å; A438-R440 PolarHBondContact O-N 3.47Å; A438-L441 PolarHBondContact O-N 3.27Å; A438-Q442 VanDerWaalsContact O-CB 3.31Å; A438-Q442 WeakPolarHBondContact O-CB 3.49Å; A438-Q442 PolarHBondContact O-N 3.09Å
439	Q	95.7	Very high	95.6	Very high	114 Å²	114	112 Å²	112	53%	0.533	53%	0.531	S	S	.	.	H	α-helix	trans	-63.1	-38.4	175	-75.2	175.8	-15.3	0	0	112.5	T435 L437 R443	T435-Q439 WeakPolarHBondContact O-CB 3.5Å; T435-Q439 WeakPolarHBondContact O-CG 3.32Å; T435-Q439 PolarHBondContact O-N 3.29Å; L437-Q439 PolarHBondContact O-N 2.89Å; Q439-R443 WeakPolarHBondContact O-CG 3.31Å; Q439-R443 PolarHBondContact O-N 2.86Å; Q439-R443 VanDerWaalsContact O-N 3.09Å
440	R	95.4	Very high	95.5	Very high	151 Å²	151	107.3 Å²	107.3	57%	0.57	53%	0.525	S	S	*	.	H	α-helix	trans	-64.3	-52	174.3	-178.4	179.9	178.6	173	2.2	111.2	S436 L437 A438 Q442 R443 D444	S436-R440 WeakPolarHBondContact O-CB 3.48Å; S436-R440 PolarHBondContact O-N 3.37Å; L437-R440 PolarHBondContact O-N 3.22Å; A438-R440 VanDerWaalsContact C-N 3.34Å; A438-R440 PolarHBondContact O-N 3.47Å; R440-Q442 PolarHBondContact O-N 3.4Å; R440-R443 PolarHBondContact O-N 2.98Å; R440-R443 VanDerWaalsContact O-N 3.08Å; R440-D444 IonicContact NE-OD2 2.64Å; R440-D444 VanDerWaalsContact O-CG 3.25Å; R440-D444 PolarHBondContact O-N 2.93Å
441	L	95.8	Very high	95.5	Very high	102 Å²	102	104.9 Å²	104.9	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-59.7	-34.1	178.2	-71.1	173.4	0	0	0	112.1	L437 A438 L445	L437-L441 HydrophobicContact CD1-CD1 4.42Å; L437-L441 HydrophobicContact CD1-CG 4.4Å; L437-L441 HydrophobicContact CG-CD1 4.14Å; L437-L441 WeakPolarHBondContact O-CG 3.39Å; L437-L441 PolarHBondContact O-N 3.48Å; A438-L441 PolarHBondContact O-N 3.27Å; L441-L445 VanDerWaalsContact O-CB 3.23Å; L441-L445 WeakPolarHBondContact O-CB 3.33Å; L441-L445 PolarHBondContact O-N 2.97Å
442	Q	96.2	Very high	95.5	Very high	112 Å²	112	104.1 Å²	104.1	52%	0.523	51%	0.514	S	S	.	.	H	α-helix	trans	-65.5	-44.8	174.5	-176.2	176.2	-11.7	0	0	111.8	A438 R440 L445 E446	A438-Q442 VanDerWaalsContact O-CB 3.31Å; A438-Q442 WeakPolarHBondContact O-CB 3.49Å; A438-Q442 PolarHBondContact O-N 3.09Å; R440-Q442 PolarHBondContact O-N 3.4Å; Q442-L445 PolarHBondContact O-N 2.91Å; Q442-E446 WeakPolarHBondContact CG-OE1 3.42Å; Q442-E446 PolarHBondContact NE2-OE1 2.91Å; Q442-E446 VanDerWaalsContact NE2-OE1 3.11Å; Q442-E446 WeakPolarHBondContact O-CG 3.46Å; Q442-E446 PolarHBondContact O-N 3.11Å
443	R	95.9	Very high	95.5	Very high	152 Å²	152	100.8 Å²	100.8	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-62.7	-47.2	174.7	-72.4	-171.6	-61.5	-156.4	0.3	111.9	Q439 R440 L445 E446 E447	Q439-R443 WeakPolarHBondContact O-CG 3.31Å; Q439-R443 PolarHBondContact O-N 2.86Å; Q439-R443 VanDerWaalsContact O-N 3.09Å; R440-R443 PolarHBondContact O-N 2.98Å; R440-R443 VanDerWaalsContact O-N 3.08Å; R443-L445 VanDerWaalsContact C-N 3.26Å; R443-L445 PolarHBondContact O-N 3.08Å; R443-E446 PolarHBondContact O-N 2.88Å; R443-E446 VanDerWaalsContact O-N 3.09Å; R443-E447 WeakPolarHBondContact O-CG 3.19Å; R443-E447 PolarHBondContact O-N 3.37Å
444	D	96.2	Very high	95.4	Very high	65 Å²	65	96.8 Å²	96.8	35%	0.348	49%	0.494	S	S	.	.	H	α-helix	trans	-59.4	-40.2	178.5	-60.6	-8.3	0	0	0	110.4	R440 E447 E448	R440-D444 IonicContact NE-OD2 2.64Å; R440-D444 VanDerWaalsContact O-CG 3.25Å; R440-D444 PolarHBondContact O-N 2.93Å; D444-E447 PolarHBondContact O-N 3.32Å; D444-E448 WeakPolarHBondContact O-CB 3.45Å; D444-E448 WeakPolarHBondContact O-CG 3.23Å; D444-E448 PolarHBondContact O-N 3.25Å
445	L	95.5	Very high	95.4	Very high	85 Å²	85	98.8 Å²	98.8	45%	0.445	50%	0.496	S	S	.	.	H	α-helix	trans	-66.1	-39	175.4	179.5	65.2	0	0	0	112.8	L441 Q442 R443 R449	L441-L445 VanDerWaalsContact O-CB 3.23Å; L441-L445 WeakPolarHBondContact O-CB 3.33Å; L441-L445 PolarHBondContact O-N 2.97Å; Q442-L445 PolarHBondContact O-N 2.91Å; R443-L445 VanDerWaalsContact C-N 3.26Å; R443-L445 PolarHBondContact O-N 3.08Å; L445-R449 HydrophobicContact CD1-CG 4.49Å; L445-R449 WeakPolarHBondContact O-CB 3.23Å; L445-R449 WeakPolarHBondContact O-CG 3.35Å; L445-R449 PolarHBondContact O-N 3.09Å
446	E	95.8	Very high	95.3	Very high	102 Å²	102	100.5 Å²	100.5	48%	0.477	50%	0.502	S	S	.	.	H	α-helix	trans	-67.1	-41.3	176.2	-74.8	168.8	-167.9	0	0	111.3	Q442 R443 R449 A450	Q442-E446 WeakPolarHBondContact CG-OE1 3.42Å; Q442-E446 PolarHBondContact NE2-OE1 2.91Å; Q442-E446 VanDerWaalsContact NE2-OE1 3.11Å; Q442-E446 WeakPolarHBondContact O-CG 3.46Å; Q442-E446 PolarHBondContact O-N 3.11Å; R443-E446 PolarHBondContact O-N 2.88Å; R443-E446 VanDerWaalsContact O-N 3.09Å; E446-R449 PolarHBondContact O-N 3.41Å; E446-A450 WeakPolarHBondContact O-CB 3.41Å; E446-A450 PolarHBondContact O-N 3.46Å
447	E	95.5	Very high	95.3	Very high	130 Å²	130	102.4 Å²	102.4	61%	0.607	51%	0.506	S	S	*	.	H	α-helix	trans	-63.4	-47.4	174.6	-72.2	175.7	-168.3	0	0	111.8	R443 D444 R449 A450 L451	R443-E447 WeakPolarHBondContact O-CG 3.19Å; R443-E447 PolarHBondContact O-N 3.37Å; D444-E447 PolarHBondContact O-N 3.32Å; E447-R449 VanDerWaalsContact C-N 3.33Å; E447-R449 PolarHBondContact O-N 3.43Å; E447-A450 PolarHBondContact O-N 2.81Å; E447-L451 WeakPolarHBondContact O-CB 3.35Å; E447-L451 PolarHBondContact O-N 3.44Å
448	E	94	Very high	95.3	Very high	121 Å²	121	101.3 Å²	101.3	57%	0.565	50%	0.501	S	S	*	.	H	α-helix	trans	-62.7	-39.2	176.1	-76.9	-61.1	146.8	0	0	112	D444 L451 N452	D444-E448 WeakPolarHBondContact O-CB 3.45Å; D444-E448 WeakPolarHBondContact O-CG 3.23Å; D444-E448 PolarHBondContact O-N 3.25Å; E448-L451 PolarHBondContact O-N 2.9Å; E448-N452 VanDerWaalsContact O-CB 3.23Å; E448-N452 WeakPolarHBondContact O-CB 3.26Å; E448-N452 PolarHBondContact O-N 2.92Å
449	R	95.6	Very high	95.2	Very high	151 Å²	151	103.5 Å²	103.5	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-64.3	-44.5	174.4	-78.5	172.5	174.5	179.6	-0.3	111.7	L445 E446 E447 N452 Q453	L445-R449 HydrophobicContact CD1-CG 4.49Å; L445-R449 WeakPolarHBondContact O-CB 3.23Å; L445-R449 WeakPolarHBondContact O-CG 3.35Å; L445-R449 PolarHBondContact O-N 3.09Å; E446-R449 PolarHBondContact O-N 3.41Å; E447-R449 VanDerWaalsContact C-N 3.33Å; E447-R449 PolarHBondContact O-N 3.43Å; R449-N452 PolarHBondContact O-N 3.41Å; R449-Q453 WeakPolarHBondContact O-CB 3.34Å; R449-Q453 VanDerWaalsContact O-CG 3.26Å; R449-Q453 WeakPolarHBondContact O-CG 3.38Å; R449-Q453 PolarHBondContact O-N 2.85Å
450	A	94.9	Very high	95.1	Very high	55 Å²	55	103.9 Å²	103.9	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-42.2	177.3	0	0	0	0	0	111.4	E446 E447 Q453 S454	E446-A450 WeakPolarHBondContact O-CB 3.41Å; E446-A450 PolarHBondContact O-N 3.46Å; E447-A450 PolarHBondContact O-N 2.81Å; A450-Q453 PolarHBondContact O-N 2.66Å; A450-S454 WeakPolarHBondContact O-CB 3.49Å; A450-S454 PolarHBondContact O-N 2.91Å
451	L	95.4	Very high	95.1	Very high	85 Å²	85	99.1 Å²	99.1	45%	0.445	49%	0.489	S	S	.	.	H	α-helix	trans	-60.3	-49.8	174.3	-179.3	65.7	0	0	0	110.9	E447 E448 Q453 S454 L455	E447-L451 WeakPolarHBondContact O-CB 3.35Å; E447-L451 PolarHBondContact O-N 3.44Å; E448-L451 PolarHBondContact O-N 2.9Å; L451-Q453 VanDerWaalsContact C-N 3.34Å; L451-Q453 PolarHBondContact O-N 3.11Å; L451-S454 WeakPolarHBondContact O-CB 3.36Å; L451-S454 PolarHBondContact O-N 2.96Å; L451-S454 VanDerWaalsContact O-N 3.11Å; L451-S454 PolarHBondContact O-OG 3.26Å; L451-L455 HydrophobicContact CG-CD1 4.21Å; L451-L455 WeakPolarHBondContact O-CG 3.42Å; L451-L455 PolarHBondContact O-N 3.44Å
452	N	93.9	Very high	94.9	Very high	93 Å²	93	101.6 Å²	101.6	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-61.2	-42.5	179.5	-165.7	-14	0	0	0	111.6	E448 R449 S454 L455 L456	E448-N452 VanDerWaalsContact O-CB 3.23Å; E448-N452 WeakPolarHBondContact O-CB 3.26Å; E448-N452 PolarHBondContact O-N 2.92Å; R449-N452 PolarHBondContact O-N 3.41Å; N452-S454 VanDerWaalsContact C-N 3.35Å; N452-S454 PolarHBondContact O-N 3.41Å; N452-L455 PolarHBondContact O-N 3.41Å; N452-L456 WeakPolarHBondContact O-CG 3.31Å; N452-L456 PolarHBondContact O-N 2.88Å
453	Q	95.3	Very high	94.8	Very high	125 Å²	125	102 Å²	102	58%	0.584	49%	0.488	S	S	*	.	H	α-helix	trans	-59.4	-44.6	172.7	-74.3	174.2	5.5	0	0	112.1	R449 A450 L451 L455 L456 I457	R449-Q453 WeakPolarHBondContact O-CB 3.34Å; R449-Q453 VanDerWaalsContact O-CG 3.26Å; R449-Q453 WeakPolarHBondContact O-CG 3.38Å; R449-Q453 PolarHBondContact O-N 2.85Å; A450-Q453 PolarHBondContact O-N 2.66Å; L451-Q453 VanDerWaalsContact C-N 3.34Å; L451-Q453 PolarHBondContact O-N 3.11Å; Q453-L455 VanDerWaalsContact C-N 3.33Å; Q453-L455 PolarHBondContact O-N 2.64Å; Q453-L456 PolarHBondContact O-N 3.31Å; Q453-I457 VanDerWaalsContact O-CG1 3.31Å; Q453-I457 WeakPolarHBondContact O-CG1 3.35Å; Q453-I457 PolarHBondContact O-N 3.04Å
454	S	94.3	Very high	94.8	Very high	47 Å²	47	99.5 Å²	99.5	33%	0.329	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-38.9	177.3	79.5	0	0	0	0	112.4	A450 L451 N452 I457 N458	A450-S454 WeakPolarHBondContact O-CB 3.49Å; A450-S454 PolarHBondContact O-N 2.91Å; L451-S454 WeakPolarHBondContact O-CB 3.36Å; L451-S454 PolarHBondContact O-N 2.96Å; L451-S454 VanDerWaalsContact O-N 3.11Å; L451-S454 PolarHBondContact O-OG 3.26Å; N452-S454 VanDerWaalsContact C-N 3.35Å; N452-S454 PolarHBondContact O-N 3.41Å; S454-I457 PolarHBondContact O-N 3.46Å; S454-N458 WeakPolarHBondContact O-CB 3.34Å; S454-N458 PolarHBondContact O-N 3.03Å; S454-N458 PolarHBondContact O-ND2 2.88Å
455	L	94.5	Very high	94.7	Very high	99 Å²	99	103.7 Å²	103.7	52%	0.518	49%	0.494	S	S	.	.	H	α-helix	trans	-67.4	-41	177.4	-72.7	173.9	0	0	0	111.6	L451 N452 Q453 N458 E459	L451-L455 HydrophobicContact CG-CD1 4.21Å; L451-L455 WeakPolarHBondContact O-CG 3.42Å; L451-L455 PolarHBondContact O-N 3.44Å; N452-L455 PolarHBondContact O-N 3.41Å; Q453-L455 VanDerWaalsContact C-N 3.33Å; Q453-L455 PolarHBondContact O-N 2.64Å; L455-N458 PolarHBondContact O-N 3.36Å; L455-E459 WeakPolarHBondContact O-CB 3.36Å; L455-E459 PolarHBondContact O-N 2.78Å
456	L	94.7	Very high	94.6	Very high	98 Å²	98	103.1 Å²	103.1	51%	0.513	49%	0.494	S	S	.	.	H	α-helix	trans	-63.9	-40.7	175.6	-72	169.2	0	0	0	112.1	N452 Q453 K460	N452-L456 WeakPolarHBondContact O-CG 3.31Å; N452-L456 PolarHBondContact O-N 2.88Å; Q453-L456 PolarHBondContact O-N 3.31Å; L456-K460 WeakPolarHBondContact O-CB 3.37Å; L456-K460 PolarHBondContact O-N 3.43Å
457	I	95.1	Very high	94.6	Very high	107 Å²	107	104 Å²	104	55%	0.549	50%	0.498	S	S	.	.	H	α-helix	trans	-65.4	-44.9	174.6	-66.2	164.9	0	0	0	110.2	Q453 S454 E459 K460 T461	Q453-I457 VanDerWaalsContact O-CG1 3.31Å; Q453-I457 WeakPolarHBondContact O-CG1 3.35Å; Q453-I457 PolarHBondContact O-N 3.04Å; S454-I457 PolarHBondContact O-N 3.46Å; I457-E459 PolarHBondContact O-N 3.11Å; I457-K460 PolarHBondContact O-N 3.39Å; I457-T461 HydrophobicContact CG2-CG2 4.4Å; I457-T461 WeakPolarHBondContact O-CG2 3.47Å; I457-T461 PolarHBondContact O-N 3.42Å; I457-T461 PolarHBondContact O-OG1 3.28Å; I457-T461 VanDerWaalsContact O-OG1 3.11Å
458	N	94.7	Very high	94.5	Very high	78 Å²	78	103.2 Å²	103.2	42%	0.417	49%	0.494	S	S	.	.	H	α-helix	trans	-61.9	-44.2	177.1	-74.5	-16.3	0	0	0	111.3	S454 L455 K460 T461 W462	S454-N458 WeakPolarHBondContact O-CB 3.34Å; S454-N458 PolarHBondContact O-N 3.03Å; S454-N458 PolarHBondContact O-ND2 2.88Å; L455-N458 PolarHBondContact O-N 3.36Å; N458-K460 VanDerWaalsContact C-N 3.32Å; N458-K460 PolarHBondContact O-N 3.26Å; N458-T461 WeakPolarHBondContact CA-OG1 3.48Å; N458-T461 PolarHBondContact O-N 2.94Å; N458-T461 PolarHBondContact O-OG1 3.5Å; N458-W462 WeakPolarHBondContact O-CB 3.41Å; N458-W462 PolarHBondContact O-N 3.44Å
459	E	94	Very high	94.5	Very high	102 Å²	102	100 Å²	100	48%	0.477	49%	0.488	S	S	.	.	H	α-helix	trans	-58.5	-45.7	176	-168.2	-161.2	162.4	0	0	111	L455 I457 W462 R463	L455-E459 WeakPolarHBondContact O-CB 3.36Å; L455-E459 PolarHBondContact O-N 2.78Å; I457-E459 PolarHBondContact O-N 3.11Å; E459-W462 PolarHBondContact O-N 2.91Å; E459-R463 VanDerWaalsContact O-CB 3.32Å; E459-R463 WeakPolarHBondContact O-CB 3.36Å; E459-R463 PolarHBondContact O-N 2.88Å; E459-R463 IonicContact OE1-CZ 3.81Å; E459-R463 IonicContact OE1-NH2 2.72Å; E459-R463 PolarHBondContact OE1-NH2 2.88Å; E459-R463 IonicContact OE2-NH2 3.58Å
460	K	94.2	Very high	94.4	Very high	122 Å²	122	97.9 Å²	97.9	53%	0.53	49%	0.485	S	S	.	.	H	α-helix	trans	-61.9	-48.1	177.7	-171.6	-178.4	177.6	-171.2	0	111.9	L456 I457 N458 W462 R463 E464	L456-K460 WeakPolarHBondContact O-CB 3.37Å; L456-K460 PolarHBondContact O-N 3.43Å; I457-K460 PolarHBondContact O-N 3.39Å; N458-K460 VanDerWaalsContact C-N 3.32Å; N458-K460 PolarHBondContact O-N 3.26Å; K460-W462 PolarHBondContact O-N 2.88Å; K460-R463 WeakPolarHBondContact O-CB 3.44Å; K460-R463 PolarHBondContact O-N 2.96Å; K460-E464 WeakPolarHBondContact CE-OE1 3.3Å; K460-E464 WeakPolarHBondContact O-CG 3.2Å; K460-E464 PolarHBondContact O-N 3.33Å
461	T	94.9	Very high	94.3	Very high	50 Å²	50	98.5 Å²	98.5	31%	0.307	49%	0.485	S	S	.	.	H	α-helix	trans	-65	-38.3	179.4	54.3	0	0	0	0	112.4	I457 N458 R465	I457-T461 HydrophobicContact CG2-CG2 4.4Å; I457-T461 WeakPolarHBondContact O-CG2 3.47Å; I457-T461 PolarHBondContact O-N 3.42Å; I457-T461 PolarHBondContact O-OG1 3.28Å; I457-T461 VanDerWaalsContact O-OG1 3.11Å; N458-T461 WeakPolarHBondContact CA-OG1 3.48Å; N458-T461 PolarHBondContact O-N 2.94Å; N458-T461 PolarHBondContact O-OG1 3.5Å; T461-R465 WeakPolarHBondContact O-CB 3.48Å; T461-R465 VanDerWaalsContact O-CG 3.3Å; T461-R465 WeakPolarHBondContact O-CG 3.32Å; T461-R465 PolarHBondContact O-N 3.48Å
462	W	92.4	Very high	94.3	Very high	154 Å²	154	99.5 Å²	99.5	58%	0.583	49%	0.488	S	S	*	.	H	α-helix	trans	-67.4	-38.3	173.9	-81.3	115.2	0	0	0	112.3	N458 E459 K460 R465 T466	N458-W462 WeakPolarHBondContact O-CB 3.41Å; N458-W462 PolarHBondContact O-N 3.44Å; E459-W462 PolarHBondContact O-N 2.91Å; K460-W462 PolarHBondContact O-N 2.88Å; W462-R465 PolarHBondContact O-N 2.86Å; W462-T466 WeakPolarHBondContact O-CB 3.35Å; W462-T466 PolarHBondContact O-N 3.16Å; W462-T466 PolarHBondContact O-OG1 2.91Å
463	R	95.1	Very high	94.2	Very high	121 Å²	121	97 Å²	97	46%	0.457	48%	0.48	S	S	.	.	H	α-helix	trans	-61.6	-48.7	173.7	-162.3	-176	-56.4	139	-0.1	111.4	E459 K460 R465 T466 E467	E459-R463 VanDerWaalsContact O-CB 3.32Å; E459-R463 WeakPolarHBondContact O-CB 3.36Å; E459-R463 PolarHBondContact O-N 2.88Å; E459-R463 IonicContact OE1-CZ 3.81Å; E459-R463 IonicContact OE1-NH2 2.72Å; E459-R463 PolarHBondContact OE1-NH2 2.88Å; E459-R463 IonicContact OE2-NH2 3.58Å; K460-R463 WeakPolarHBondContact O-CB 3.44Å; K460-R463 PolarHBondContact O-N 2.96Å; R463-R465 PolarHBondContact O-N 3.44Å; R463-T466 PolarHBondContact O-N 2.87Å; R463-T466 VanDerWaalsContact O-N 3.16Å; R463-E467 WeakPolarHBondContact O-CG 3.38Å; R463-E467 PolarHBondContact O-N 2.96Å
464	E	94.7	Very high	94.1	Very high	100 Å²	100	97.4 Å²	97.4	47%	0.467	48%	0.48	S	S	.	.	H	α-helix	trans	-58.7	-44.9	175.7	-72.6	169.6	-176.4	0	0	111.6	K460 T466 E467 Q468	K460-E464 WeakPolarHBondContact CE-OE1 3.3Å; K460-E464 WeakPolarHBondContact O-CG 3.2Å; K460-E464 PolarHBondContact O-N 3.33Å; E464-T466 VanDerWaalsContact C-N 3.33Å; E464-T466 PolarHBondContact O-N 3.45Å; E464-E467 PolarHBondContact O-N 2.83Å; E464-Q468 WeakPolarHBondContact O-CB 3.28Å; E464-Q468 PolarHBondContact O-N 3.48Å
465	R	94.6	Very high	94.1	Very high	153 Å²	153	98.6 Å²	98.6	58%	0.577	49%	0.485	S	S	*	.	H	α-helix	trans	-63.6	-37.1	175.9	-76.2	177.5	177.9	-179.9	0.5	112.9	T461 W462 R463 A469	T461-R465 WeakPolarHBondContact O-CB 3.48Å; T461-R465 VanDerWaalsContact O-CG 3.3Å; T461-R465 WeakPolarHBondContact O-CG 3.32Å; T461-R465 PolarHBondContact O-N 3.48Å; W462-R465 PolarHBondContact O-N 2.86Å; R463-R465 PolarHBondContact O-N 3.44Å; R465-A469 VanDerWaalsContact O-CB 3.28Å; R465-A469 WeakPolarHBondContact O-CB 3.47Å; R465-A469 PolarHBondContact O-N 2.66Å
466	T	94.2	Very high	93.9	Very high	72 Å²	72	95.9 Å²	95.9	44%	0.442	48%	0.477	S	S	.	.	H	α-helix	trans	-70.9	-44	179.2	-53.2	0	0	0	0	110.3	W462 R463 E464 Q468 A469 E470	W462-T466 WeakPolarHBondContact O-CB 3.35Å; W462-T466 PolarHBondContact O-N 3.16Å; W462-T466 PolarHBondContact O-OG1 2.91Å; R463-T466 PolarHBondContact O-N 2.87Å; R463-T466 VanDerWaalsContact O-N 3.16Å; E464-T466 VanDerWaalsContact C-N 3.33Å; E464-T466 PolarHBondContact O-N 3.45Å; T466-Q468 VanDerWaalsContact C-N 3.34Å; T466-Q468 PolarHBondContact O-N 3.44Å; T466-A469 PolarHBondContact O-N 3.42Å; T466-E470 WeakPolarHBondContact O-CB 3.45Å; T466-E470 WeakPolarHBondContact O-CG 3.48Å; T466-E470 PolarHBondContact O-N 2.92Å
467	E	94.7	Very high	93.8	Very high	120 Å²	120	100.2 Å²	100.2	56%	0.561	49%	0.487	S	S	*	.	H	α-helix	trans	-61.1	-42.3	173.8	-74.5	175.5	-168.8	0	0	111.7	R463 E464 E470 S471	R463-E467 WeakPolarHBondContact O-CG 3.38Å; R463-E467 PolarHBondContact O-N 2.96Å; E464-E467 PolarHBondContact O-N 2.83Å; E467-E470 PolarHBondContact O-N 3.14Å; E467-S471 WeakPolarHBondContact O-CB 3.22Å; E467-S471 PolarHBondContact O-N 3.39Å
468	Q	94.5	Very high	93.7	Very high	115 Å²	115	97.8 Å²	97.8	54%	0.537	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-49.1	175.4	-175.9	177.8	-6.3	0	0	111.6	E464 T466 E470 S471 E472	E464-Q468 WeakPolarHBondContact O-CB 3.28Å; E464-Q468 PolarHBondContact O-N 3.48Å; T466-Q468 VanDerWaalsContact C-N 3.34Å; T466-Q468 PolarHBondContact O-N 3.44Å; Q468-E470 VanDerWaalsContact C-N 3.3Å; Q468-E470 PolarHBondContact O-N 2.92Å; Q468-S471 WeakPolarHBondContact O-CB 3.43Å; Q468-S471 PolarHBondContact O-N 3.41Å; Q468-S471 VanDerWaalsContact O-N 3.14Å; Q468-E472 WeakPolarHBondContact CG-OE1 3.36Å; Q468-E472 PolarHBondContact NE2-OE1 3.35Å; Q468-E472 WeakPolarHBondContact O-CG 3.43Å; Q468-E472 PolarHBondContact O-N 3.39Å
469	A	93.2	Very high	93.5	Very high	52 Å²	52	99.8 Å²	99.8	43%	0.43	49%	0.49	S	S	.	.	H	α-helix	trans	-62.6	-36.4	177.8	0	0	0	0	0	112.1	R465 T466 A473	R465-A469 VanDerWaalsContact O-CB 3.28Å; R465-A469 WeakPolarHBondContact O-CB 3.47Å; R465-A469 PolarHBondContact O-N 2.66Å; T466-A469 PolarHBondContact O-N 3.42Å; A469-A473 WeakPolarHBondContact O-CB 3.37Å; A469-A473 PolarHBondContact O-N 2.9Å
470	E	94	Very high	93.3	Very high	108 Å²	108	98.8 Å²	98.8	51%	0.505	49%	0.493	S	S	.	.	H	α-helix	trans	-66.2	-39.2	173.2	-80.3	-170.3	-174.9	0	0	112.4	T466 E467 Q468 A473 K474	T466-E470 WeakPolarHBondContact O-CB 3.45Å; T466-E470 WeakPolarHBondContact O-CG 3.48Å; T466-E470 PolarHBondContact O-N 2.92Å; E467-E470 PolarHBondContact O-N 3.14Å; Q468-E470 VanDerWaalsContact C-N 3.3Å; Q468-E470 PolarHBondContact O-N 2.92Å; E470-A473 PolarHBondContact O-N 2.94Å; E470-K474 WeakPolarHBondContact O-CB 3.47Å; E470-K474 WeakPolarHBondContact O-CG 3.33Å; E470-K474 PolarHBondContact O-N 3.48Å
471	S	93.2	Very high	93.2	Very high	67 Å²	67	102.6 Å²	102.6	47%	0.469	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-48.8	175	-175.8	0	0	0	0	111.2	E467 Q468 A473 K474 T475	E467-S471 WeakPolarHBondContact O-CB 3.22Å; E467-S471 PolarHBondContact O-N 3.39Å; Q468-S471 WeakPolarHBondContact O-CB 3.43Å; Q468-S471 PolarHBondContact O-N 3.41Å; Q468-S471 VanDerWaalsContact O-N 3.14Å; S471-A473 VanDerWaalsContact C-N 3.31Å; S471-A473 PolarHBondContact O-N 3.12Å; S471-K474 WeakPolarHBondContact O-CB 3.3Å; S471-K474 PolarHBondContact O-N 3.42Å; S471-K474 VanDerWaalsContact O-N 3.12Å; S471-T475 PolarHBondContact O-N 2.87Å; S471-T475 PolarHBondContact O-OG1 2.95Å
472	E	93.6	Very high	93	Very high	107 Å²	107	106 Å²	106	50%	0.5	52%	0.516	S	S	.	.	H	α-helix	trans	-60.8	-38.8	175.8	-71.1	173	-168.6	0	0	111.7	Q468 T475 A476	Q468-E472 WeakPolarHBondContact CG-OE1 3.36Å; Q468-E472 PolarHBondContact NE2-OE1 3.35Å; Q468-E472 WeakPolarHBondContact O-CG 3.43Å; Q468-E472 PolarHBondContact O-N 3.39Å; E472-T475 WeakPolarHBondContact CA-OG1 3.23Å; E472-T475 PolarHBondContact O-N 3.47Å; E472-T475 PolarHBondContact O-OG1 2.89Å; E472-A476 VanDerWaalsContact O-CB 3.23Å; E472-A476 WeakPolarHBondContact O-CB 3.49Å; E472-A476 PolarHBondContact O-N 2.89Å
473	A	93.2	Very high	92.8	Very high	39 Å²	39	103.9 Å²	103.9	32%	0.322	52%	0.516	S	S	.	.	H	α-helix	trans	-67.2	-35.6	174.5	0	0	0	0	0	112.4	A469 E470 S471 R477	A469-A473 WeakPolarHBondContact O-CB 3.37Å; A469-A473 PolarHBondContact O-N 2.9Å; E470-A473 PolarHBondContact O-N 2.94Å; S471-A473 VanDerWaalsContact C-N 3.31Å; S471-A473 PolarHBondContact O-N 3.12Å; A473-R477 VanDerWaalsContact O-CB 3.3Å; A473-R477 WeakPolarHBondContact O-CB 3.48Å; A473-R477 WeakPolarHBondContact O-CG 3.18Å; A473-R477 PolarHBondContact O-N 2.96Å
474	K	93.4	Very high	92.6	Very high	134 Å²	134	103.1 Å²	103.1	58%	0.583	52%	0.52	S	S	*	.	H	α-helix	trans	-68.6	-43.7	174.8	-78.6	171.4	-174.1	163.8	0	111.6	E470 S471 R477 A478	E470-K474 WeakPolarHBondContact O-CB 3.47Å; E470-K474 WeakPolarHBondContact O-CG 3.33Å; E470-K474 PolarHBondContact O-N 3.48Å; S471-K474 WeakPolarHBondContact O-CB 3.3Å; S471-K474 PolarHBondContact O-N 3.42Å; S471-K474 VanDerWaalsContact O-N 3.12Å; K474-R477 PolarHBondContact O-N 3.35Å; K474-A478 WeakPolarHBondContact O-CB 3.39Å; K474-A478 PolarHBondContact O-N 2.92Å
475	T	92.8	Very high	92.4	Very high	72 Å²	72	103 Å²	103	44%	0.442	52%	0.522	S	S	.	.	H	α-helix	trans	-64.5	-47.2	176.4	54.7	0	0	0	0	110.8	S471 E472 R477 A478 E479	S471-T475 PolarHBondContact O-N 2.87Å; S471-T475 PolarHBondContact O-OG1 2.95Å; E472-T475 WeakPolarHBondContact CA-OG1 3.23Å; E472-T475 PolarHBondContact O-N 3.47Å; E472-T475 PolarHBondContact O-OG1 2.89Å; T475-R477 VanDerWaalsContact C-N 3.31Å; T475-R477 PolarHBondContact O-N 3.34Å; T475-A478 WeakPolarHBondContact O-CB 3.42Å; T475-A478 PolarHBondContact O-N 3.46Å; T475-E479 WeakPolarHBondContact O-CG 3.45Å; T475-E479 PolarHBondContact O-N 3.29Å
476	A	90.9	Very high	92.1	Very high	43 Å²	43	99.5 Å²	99.5	36%	0.355	52%	0.515	S	S	.	.	H	α-helix	trans	-59.5	-40.2	175.9	0	0	0	0	0	112.1	E472 E479 C480	E472-A476 VanDerWaalsContact O-CB 3.23Å; E472-A476 WeakPolarHBondContact O-CB 3.49Å; E472-A476 PolarHBondContact O-N 2.89Å; A476-E479 PolarHBondContact O-N 2.87Å; A476-C480 WeakPolarHBondContact O-CB 3.4Å; A476-C480 PolarHBondContact O-N 3.04Å; A476-C480 PolarHBondContact O-SG 2.98Å
477	R	93.1	Very high	91.8	Very high	188 Å²	188	100.7 Å²	100.7	71%	0.709	52%	0.518	S	S	*	.	H	α-helix	trans	-64.1	-38.9	173.5	-79.2	173.4	-175.3	169.2	4.3	112.5	A473 K474 T475 R481	A473-R477 VanDerWaalsContact O-CB 3.3Å; A473-R477 WeakPolarHBondContact O-CB 3.48Å; A473-R477 WeakPolarHBondContact O-CG 3.18Å; A473-R477 PolarHBondContact O-N 2.96Å; K474-R477 PolarHBondContact O-N 3.35Å; T475-R477 VanDerWaalsContact C-N 3.31Å; T475-R477 PolarHBondContact O-N 3.34Å; R477-R481 WeakPolarHBondContact O-CB 3.38Å; R477-R481 PolarHBondContact O-N 2.86Å
478	A	91.8	Very high	91.4	Very high	57 Å²	57	99.6 Å²	99.6	47%	0.471	51%	0.513	S	S	.	.	H	α-helix	trans	-66.7	-45	176.8	0	0	0	0	0	111.2	K474 T475 R481 E482	K474-A478 WeakPolarHBondContact O-CB 3.39Å; K474-A478 PolarHBondContact O-N 2.92Å; T475-A478 WeakPolarHBondContact O-CB 3.42Å; T475-A478 PolarHBondContact O-N 3.46Å; A478-R481 WeakPolarHBondContact O-CB 3.4Å; A478-R481 PolarHBondContact O-N 3.16Å; A478-R481 VanDerWaalsContact O-N 3.16Å; A478-E482 PolarHBondContact O-N 2.88Å
479	E	91	Very high	91	Very high	119 Å²	119	98.3 Å²	98.3	56%	0.556	51%	0.51	S	S	*	.	H	α-helix	trans	-59.9	-46.5	174	-71.2	173.7	-174.7	0	0	111.5	T475 A476 R481 E482 L483	T475-E479 WeakPolarHBondContact O-CG 3.45Å; T475-E479 PolarHBondContact O-N 3.29Å; A476-E479 PolarHBondContact O-N 2.87Å; E479-R481 VanDerWaalsContact C-N 3.28Å; E479-R481 PolarHBondContact O-N 3.25Å; E479-E482 PolarHBondContact O-N 3.24Å; E479-L483 WeakPolarHBondContact O-CB 3.31Å; E479-L483 VanDerWaalsContact O-CG 3.31Å; E479-L483 WeakPolarHBondContact O-CG 3.43Å; E479-L483 PolarHBondContact O-N 2.93Å
480	C	90	Very high	90.6	Very high	82 Å²	82	103.8 Å²	103.8	55%	0.554	52%	0.519	S	S	*	.	H	α-helix	trans	-59.2	-39.7	174.4	-74.2	0	0	0	0	112	A476 L484	A476-C480 WeakPolarHBondContact O-CB 3.4Å; A476-C480 PolarHBondContact O-N 3.04Å; A476-C480 PolarHBondContact O-SG 2.98Å; C480-L484 WeakPolarHBondContact O-CB 3.42Å; C480-L484 PolarHBondContact O-N 2.87Å
481	R	91.8	Very high	90.1	Very high	201 Å²	201	103.2 Å²	103.2	76%	0.758	52%	0.52	S	S	*	.	H	α-helix	trans	-67.5	-40.4	177.6	-174.5	178.8	-177.8	178.3	0.7	111.9	R477 A478 E479 L484 L485	R477-R481 WeakPolarHBondContact O-CB 3.38Å; R477-R481 PolarHBondContact O-N 2.86Å; A478-R481 WeakPolarHBondContact O-CB 3.4Å; A478-R481 PolarHBondContact O-N 3.16Å; A478-R481 VanDerWaalsContact O-N 3.16Å; E479-R481 VanDerWaalsContact C-N 3.28Å; E479-R481 PolarHBondContact O-N 3.25Å; R481-L484 PolarHBondContact O-N 3.35Å; R481-L485 PolarHBondContact O-N 3.43Å
482	E	90.4	Very high	89.7	Confident	121 Å²	121	105.9 Å²	105.9	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-66.3	-44.1	175.8	-167.9	-174.4	163.7	0	0	111.3	A478 E479 L484 L485 N486	A478-E482 PolarHBondContact O-N 2.88Å; E479-E482 PolarHBondContact O-N 3.24Å; E482-L484 VanDerWaalsContact C-N 3.32Å; E482-L484 PolarHBondContact O-N 2.98Å; E482-L485 PolarHBondContact O-N 3.41Å; E482-N486 WeakPolarHBondContact O-CB 3.41Å; E482-N486 PolarHBondContact O-N 2.85Å; E482-N486 PolarHBondContact O-ND2 3.36Å
483	L	89	Confident	89.1	Confident	111 Å²	111	106.1 Å²	106.1	58%	0.581	53%	0.527	S	S	*	.	H	α-helix	trans	-58.9	-42.9	173.3	-73.6	172.2	0	0	0	111.6	E479 N486 L487	E479-L483 WeakPolarHBondContact O-CB 3.31Å; E479-L483 VanDerWaalsContact O-CG 3.31Å; E479-L483 WeakPolarHBondContact O-CG 3.43Å; E479-L483 PolarHBondContact O-N 2.93Å; L483-N486 PolarHBondContact O-N 3.44Å; L483-L487 VanDerWaalsContact O-CG 3.31Å; L483-L487 WeakPolarHBondContact O-CG 3.37Å; L483-L487 PolarHBondContact O-N 2.87Å
484	L	91.2	Very high	88.4	Confident	104 Å²	104	108.2 Å²	108.2	55%	0.545	53%	0.533	S	S	.	.	H	α-helix	trans	-61.8	-46.2	176.1	-160.9	86.1	0	0	0	111.5	C480 R481 E482 N486 L487 E488	C480-L484 WeakPolarHBondContact O-CB 3.42Å; C480-L484 PolarHBondContact O-N 2.87Å; R481-L484 PolarHBondContact O-N 3.35Å; E482-L484 VanDerWaalsContact C-N 3.32Å; E482-L484 PolarHBondContact O-N 2.98Å; L484-N486 VanDerWaalsContact C-N 3.33Å; L484-N486 PolarHBondContact O-N 3.35Å; L484-L487 PolarHBondContact O-N 3.32Å; L484-E488 PolarHBondContact O-N 3.49Å
485	L	89.6	Confident	87.7	Confident	97 Å²	97	107.6 Å²	107.6	51%	0.508	53%	0.532	S	S	.	.	H	α-helix	trans	-61.8	-41.3	177.1	-166.8	84.3	0	0	0	111.6	R481 E482 L487 E488 L489	R481-L485 PolarHBondContact O-N 3.43Å; E482-L485 PolarHBondContact O-N 3.41Å; L485-L487 VanDerWaalsContact C-N 3.33Å; L485-L487 PolarHBondContact O-N 2.95Å; L485-E488 PolarHBondContact O-N 3.21Å; L485-L489 HydrophobicContact CD2-CD1 4.44Å; L485-L489 HydrophobicContact CG-CD1 4.35Å; L485-L489 WeakPolarHBondContact O-CB 3.32Å; L485-L489 WeakPolarHBondContact O-CG 3.31Å; L485-L489 PolarHBondContact O-N 2.96Å
486	N	88.7	Confident	86.9	Confident	80 Å²	80	109.5 Å²	109.5	43%	0.428	54%	0.539	S	S	.	.	H	α-helix	trans	-64.7	-36.6	176.7	-78.6	-29.9	0	0	0	112.1	E482 L483 L484 R490	E482-N486 WeakPolarHBondContact O-CB 3.41Å; E482-N486 PolarHBondContact O-N 2.85Å; E482-N486 PolarHBondContact O-ND2 3.36Å; L483-N486 PolarHBondContact O-N 3.44Å; L484-N486 VanDerWaalsContact C-N 3.33Å; L484-N486 PolarHBondContact O-N 3.35Å; N486-R490 WeakPolarHBondContact O-CB 3.37Å; N486-R490 PolarHBondContact O-N 2.97Å
487	L	86.8	Confident	86.1	Confident	97 Å²	97	112.2 Å²	112.2	51%	0.508	55%	0.547	S	S	.	.	H	α-helix	trans	-66.4	-46.1	172.6	-70.4	171.3	0	0	0	111.4	L483 L484 L485 L489 R490 D491	L483-L487 VanDerWaalsContact O-CG 3.31Å; L483-L487 WeakPolarHBondContact O-CG 3.37Å; L483-L487 PolarHBondContact O-N 2.87Å; L484-L487 PolarHBondContact O-N 3.32Å; L485-L487 VanDerWaalsContact C-N 3.33Å; L485-L487 PolarHBondContact O-N 2.95Å; L487-L489 VanDerWaalsContact C-N 3.34Å; L487-L489 PolarHBondContact O-N 3.15Å; L487-R490 WeakPolarHBondContact O-CB 3.46Å; L487-R490 PolarHBondContact O-N 3.42Å; L487-R490 VanDerWaalsContact O-N 3.15Å; L487-D491 PolarHBondContact O-N 2.9Å
488	E	87.9	Confident	85.2	Confident	97 Å²	97	107.2 Å²	107.2	45%	0.453	54%	0.538	S	S	.	.	H	α-helix	trans	-61.1	-40.4	175.8	-73.5	-178	-176.9	0	0	112.7	L484 L485 D491 K492	L484-E488 PolarHBondContact O-N 3.49Å; L485-E488 PolarHBondContact O-N 3.21Å; E488-D491 PolarHBondContact O-N 3.36Å; E488-K492 WeakPolarHBondContact O-CB 3.5Å; E488-K492 WeakPolarHBondContact O-CG 3.44Å; E488-K492 PolarHBondContact O-N 2.87Å
489	L	85	Confident	84.3	Confident	89 Å²	89	109.4 Å²	109.4	47%	0.466	54%	0.54	S	S	.	.	H	α-helix	trans	-64.4	-40.9	174.7	-76.5	169.6	0	0	0	111.3	L485 L487 K492 L493	L485-L489 HydrophobicContact CD2-CD1 4.44Å; L485-L489 HydrophobicContact CG-CD1 4.35Å; L485-L489 WeakPolarHBondContact O-CB 3.32Å; L485-L489 WeakPolarHBondContact O-CG 3.31Å; L485-L489 PolarHBondContact O-N 2.96Å; L487-L489 VanDerWaalsContact C-N 3.34Å; L487-L489 PolarHBondContact O-N 3.15Å; L489-K492 PolarHBondContact O-N 3.41Å; L489-L493 WeakPolarHBondContact O-CB 3.36Å; L489-L493 WeakPolarHBondContact O-CG 3.41Å; L489-L493 PolarHBondContact O-N 2.9Å
490	R	85.9	Confident	83.2	Confident	166 Å²	166	107.4 Å²	107.4	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-63.2	-41.4	174.7	-178.6	-179.2	-92.2	176.1	-5.6	111.2	N486 L487 L493 N494	N486-R490 WeakPolarHBondContact O-CB 3.37Å; N486-R490 PolarHBondContact O-N 2.97Å; L487-R490 WeakPolarHBondContact O-CB 3.46Å; L487-R490 PolarHBondContact O-N 3.42Å; L487-R490 VanDerWaalsContact O-N 3.15Å; R490-L493 PolarHBondContact O-N 2.86Å; R490-N494 WeakPolarHBondContact O-CB 3.46Å; R490-N494 VanDerWaalsContact O-CG 3.22Å; R490-N494 PolarHBondContact O-N 3.3Å; R490-N494 PolarHBondContact O-ND2 2.93Å
491	D	83.6	Confident	82.2	Confident	96 Å²	96	107.1 Å²	107.1	51%	0.513	53%	0.529	S	S	.	.	H	α-helix	trans	-66.8	-44	176.7	-75.2	-18.4	0	0	0	112	L487 E488 L493 N494 E495	L487-D491 PolarHBondContact O-N 2.9Å; E488-D491 PolarHBondContact O-N 3.36Å; D491-L493 VanDerWaalsContact C-N 3.33Å; D491-L493 PolarHBondContact O-N 3.47Å; D491-N494 CarbonylContact O-C 3.59Å; D491-N494 WeakPolarHBondContact O-CA 3.33Å; D491-N494 WeakPolarHBondContact O-CB 3.4Å; D491-N494 PolarHBondContact O-N 3.11Å; D491-N494 VanDerWaalsContact O-N 3.11Å; D491-E495 WeakPolarHBondContact O-CG 3.49Å; D491-E495 PolarHBondContact O-N 2.8Å
492	K	83.8	Confident	80.9	Confident	124 Å²	124	103.5 Å²	103.5	54%	0.539	52%	0.521	S	S	.	.	H	α-helix	trans	-62.1	-38.2	173.3	-76.7	178.1	-179.4	169.9	0	112.8	E488 L489 N494 E495 L496	E488-K492 WeakPolarHBondContact O-CB 3.5Å; E488-K492 WeakPolarHBondContact O-CG 3.44Å; E488-K492 PolarHBondContact O-N 2.87Å; L489-K492 PolarHBondContact O-N 3.41Å; K492-N494 VanDerWaalsContact C-N 3.33Å; K492-E495 PolarHBondContact O-N 2.89Å; K492-L496 WeakPolarHBondContact O-CB 3.31Å; K492-L496 WeakPolarHBondContact O-CG 3.2Å; K492-L496 PolarHBondContact O-N 3.39Å
493	L	80.8	Confident	79.6	Confident	111 Å²	111	100.2 Å²	100.2	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-64.8	-39	173.2	-81.5	166	0	0	0	111.4	L489 R490 D491 N497	L489-L493 WeakPolarHBondContact O-CB 3.36Å; L489-L493 WeakPolarHBondContact O-CG 3.41Å; L489-L493 PolarHBondContact O-N 2.9Å; R490-L493 PolarHBondContact O-N 2.86Å; D491-L493 VanDerWaalsContact C-N 3.33Å; D491-L493 PolarHBondContact O-N 3.47Å; L493-N497 WeakPolarHBondContact O-CB 3.5Å; L493-N497 PolarHBondContact O-N 3.39Å
494	N	78.7	Confident	78.3	Confident	84 Å²	84	103.5 Å²	103.5	45%	0.449	52%	0.516	S	S	.	.	H	α-helix	trans	-66	-41.3	173.8	-71.9	-25.1	0	0	0	111.7	R490 D491 K492 N497 T498	R490-N494 WeakPolarHBondContact O-CB 3.46Å; R490-N494 VanDerWaalsContact O-CG 3.22Å; R490-N494 PolarHBondContact O-N 3.3Å; R490-N494 PolarHBondContact O-ND2 2.93Å; D491-N494 CarbonylContact O-C 3.59Å; D491-N494 WeakPolarHBondContact O-CA 3.33Å; D491-N494 WeakPolarHBondContact O-CB 3.4Å; D491-N494 PolarHBondContact O-N 3.11Å; D491-N494 VanDerWaalsContact O-N 3.11Å; K492-N494 VanDerWaalsContact C-N 3.33Å; N494-N497 PolarHBondContact O-N 2.86Å; N494-T498 WeakPolarHBondContact O-CG2 3.35Å; N494-T498 PolarHBondContact O-N 3.44Å; N494-T498 PolarHBondContact O-OG1 2.87Å
495	E	79.5	Confident	77	Confident	121 Å²	121	104.7 Å²	104.7	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-61.9	-48.2	173	-75.7	-175.8	171.8	0	0	111.8	D491 K492 N497 T498 I499	D491-E495 WeakPolarHBondContact O-CG 3.49Å; D491-E495 PolarHBondContact O-N 2.8Å; K492-E495 PolarHBondContact O-N 2.89Å; E495-N497 VanDerWaalsContact C-N 3.29Å; E495-N497 PolarHBondContact O-N 3.37Å; E495-T498 WeakPolarHBondContact CA-OG1 3.48Å; E495-T498 PolarHBondContact O-N 2.82Å; E495-T498 VanDerWaalsContact O-N 3.12Å; E495-T498 PolarHBondContact O-OG1 3.19Å; E495-I499 VanDerWaalsContact O-CG1 3.31Å; E495-I499 WeakPolarHBondContact O-CG1 3.47Å; E495-I499 PolarHBondContact O-N 2.79Å
496	L	76.3	Confident	75.6	Confident	111 Å²	111	109.2 Å²	109.2	58%	0.581	53%	0.527	S	S	*	.	H	α-helix	trans	-61.5	-38.9	175.5	-75.3	172.4	0	0	0	111.7	K492 I499 N500	K492-L496 WeakPolarHBondContact O-CB 3.31Å; K492-L496 WeakPolarHBondContact O-CG 3.2Å; K492-L496 PolarHBondContact O-N 3.39Å; L496-I499 PolarHBondContact O-N 3.31Å; L496-N500 WeakPolarHBondContact O-CB 3.41Å; L496-N500 PolarHBondContact O-N 3.12Å
497	N	73.3	Confident	74.3	Confident	100 Å²	100	112.9 Å²	112.9	54%	0.535	54%	0.539	S	S	.	.	H	α-helix	trans	-62.8	-42.3	172.9	-97.3	-25.6	0	0	0	111.9	L493 N494 E495 N500 V501	L493-N497 WeakPolarHBondContact O-CB 3.5Å; L493-N497 PolarHBondContact O-N 3.39Å; N494-N497 PolarHBondContact O-N 2.86Å; E495-N497 VanDerWaalsContact C-N 3.29Å; E495-N497 PolarHBondContact O-N 3.37Å; N497-N500 PolarHBondContact O-N 3.34Å; N497-V501 WeakPolarHBondContact O-CB 3.38Å; N497-V501 VanDerWaalsContact O-CG2 3.24Å; N497-V501 WeakPolarHBondContact O-CG2 3.24Å; N497-V501 PolarHBondContact O-N 3.33Å
498	T	73.6	Confident	72.8	Confident	83 Å²	83	117.4 Å²	117.4	51%	0.509	55%	0.55	S	S	.	.	H	α-helix	trans	-68.9	-37.5	177.1	56.9	0	0	0	0	112.7	N494 E495 V501 H502	N494-T498 WeakPolarHBondContact O-CG2 3.35Å; N494-T498 PolarHBondContact O-N 3.44Å; N494-T498 PolarHBondContact O-OG1 2.87Å; E495-T498 WeakPolarHBondContact CA-OG1 3.48Å; E495-T498 PolarHBondContact O-N 2.82Å; E495-T498 VanDerWaalsContact O-N 3.12Å; E495-T498 PolarHBondContact O-OG1 3.19Å; T498-V501 PolarHBondContact O-N 2.82Å; T498-H502 WeakPolarHBondContact O-CB 3.49Å; T498-H502 PolarHBondContact O-N 3.11Å
499	I	73.1	Confident	71.5	Confident	103 Å²	103	120.2 Å²	120.2	53%	0.528	56%	0.56	S	S	.	*	H	α-helix	trans	-63.6	-42.9	171.8	-66.5	166.4	0	0	0	110	E495 L496 V501 H502 S503	E495-I499 VanDerWaalsContact O-CG1 3.31Å; E495-I499 WeakPolarHBondContact O-CG1 3.47Å; E495-I499 PolarHBondContact O-N 2.79Å; L496-I499 PolarHBondContact O-N 3.31Å; I499-V501 VanDerWaalsContact C-N 3.33Å; I499-V501 PolarHBondContact O-N 2.99Å; I499-H502 CarbonylContact O-C 3.52Å; I499-H502 WeakPolarHBondContact O-CA 3.33Å; I499-H502 WeakPolarHBondContact O-CB 3.45Å; I499-H502 PolarHBondContact O-N 2.73Å; I499-H502 VanDerWaalsContact O-N 3.11Å; I499-S503 WeakPolarHBondContact O-CB 3.45Å; I499-S503 PolarHBondContact O-N 3.35Å; I499-S503 PolarHBondContact O-OG 2.78Å
500	N	68.6	Low	70.1	Confident	78 Å²	78	124.3 Å²	124.3	42%	0.417	57%	0.571	S	S	.	*	H	α-helix	trans	-65.8	-36.3	177.5	-159.9	-8.4	0	0	0	111.5	L496 N497 S503 R504	L496-N500 WeakPolarHBondContact O-CB 3.41Å; L496-N500 PolarHBondContact O-N 3.12Å; N497-N500 PolarHBondContact O-N 3.34Å; N500-S503 WeakPolarHBondContact CA-OG 3.27Å; N500-S503 PolarHBondContact O-OG 3.41Å; N500-R504 VanDerWaalsContact O-CB 3.27Å; N500-R504 WeakPolarHBondContact O-CB 3.49Å; N500-R504 VanDerWaalsContact O-CG 3.26Å; N500-R504 WeakPolarHBondContact O-CG 3.43Å; N500-R504 PolarHBondContact O-N 3.48Å
501	V	67.5	Low	68.7	Low	75 Å²	75	122.4 Å²	122.4	46%	0.455	57%	0.569	S	S	.	*	H	α-helix	trans	-66.1	-39.8	170	171.1	0	0	0	0	111.1	N497 T498 I499 K505	N497-V501 WeakPolarHBondContact O-CB 3.38Å; N497-V501 VanDerWaalsContact O-CG2 3.24Å; N497-V501 WeakPolarHBondContact O-CG2 3.24Å; N497-V501 PolarHBondContact O-N 3.33Å; T498-V501 PolarHBondContact O-N 2.82Å; I499-V501 VanDerWaalsContact C-N 3.33Å; I499-V501 PolarHBondContact O-N 2.99Å; V501-K505 WeakPolarHBondContact O-CB 3.48Å; V501-K505 WeakPolarHBondContact O-CG 3.37Å; V501-K505 PolarHBondContact O-N 3.22Å
502	H	65.9	Low	67.4	Low	125 Å²	125	121.9 Å²	121.9	58%	0.579	57%	0.57	S	S	*	*	H	α-helix	trans	-68.5	-41.9	176.7	-105.6	77.7	0	0	0	113.1	T498 I499 K505 R506	T498-H502 WeakPolarHBondContact O-CB 3.49Å; T498-H502 PolarHBondContact O-N 3.11Å; I499-H502 CarbonylContact O-C 3.52Å; I499-H502 WeakPolarHBondContact O-CA 3.33Å; I499-H502 WeakPolarHBondContact O-CB 3.45Å; I499-H502 PolarHBondContact O-N 2.73Å; I499-H502 VanDerWaalsContact O-N 3.11Å; H502-K505 CarbonylContact O-C 3.57Å; H502-K505 PolarHBondContact O-N 2.84Å; H502-R506 PolarHBondContact O-N 2.94Å
503	S	63	Low	66.1	Low	52 Å²	52	119.5 Å²	119.5	36%	0.364	57%	0.569	S	S	.	*	H	α-helix	trans	-66.7	-41.6	176.3	62.8	0	0	0	0	110.2	I499 N500 K505 R506 F507	I499-S503 WeakPolarHBondContact O-CB 3.45Å; I499-S503 PolarHBondContact O-N 3.35Å; I499-S503 PolarHBondContact O-OG 2.78Å; N500-S503 WeakPolarHBondContact CA-OG 3.27Å; N500-S503 PolarHBondContact O-OG 3.41Å; S503-K505 VanDerWaalsContact C-N 3.32Å; S503-K505 PolarHBondContact O-N 2.95Å; S503-R506 PolarHBondContact O-N 3.05Å; S503-F507 WeakPolarHBondContact O-CB 3.26Å; S503-F507 PolarHBondContact O-N 3.23Å
504	R	60.7	Low	64.7	Low	180 Å²	180	119.6 Å²	119.6	68%	0.679	57%	0.569	S	S	*	*	H	α-helix	trans	-58.9	-39.7	169.5	-78.1	178.7	172	-169.9	-2.7	112.5	N500 R508	N500-R504 VanDerWaalsContact O-CB 3.27Å; N500-R504 WeakPolarHBondContact O-CB 3.49Å; N500-R504 VanDerWaalsContact O-CG 3.26Å; N500-R504 WeakPolarHBondContact O-CG 3.43Å; N500-R504 PolarHBondContact O-N 3.48Å; R504-R508 PolarHBondContact O-N 2.8Å
505	K	64.1	Low	63.6	Low	130 Å²	130	121.8 Å²	121.8	57%	0.565	58%	0.576	S	S	*	*	H	α-helix	trans	-68.6	-40.6	173.8	-77.9	179.9	-179.3	179.5	0	112.9	V501 H502 S503 R508 K509	V501-K505 WeakPolarHBondContact O-CB 3.48Å; V501-K505 WeakPolarHBondContact O-CG 3.37Å; V501-K505 PolarHBondContact O-N 3.22Å; H502-K505 CarbonylContact O-C 3.57Å; H502-K505 PolarHBondContact O-N 2.84Å; S503-K505 VanDerWaalsContact C-N 3.32Å; S503-K505 PolarHBondContact O-N 2.95Å; K505-R508 WeakPolarHBondContact O-CB 3.22Å; K505-R508 PolarHBondContact O-N 3.46Å; K505-K509 PolarHBondContact O-N 2.92Å
506	R	61.5	Low	62.4	Low	192 Å²	192	124 Å²	124	73%	0.725	58%	0.584	S	S	*	*	H	α-helix	trans	-65	-42.6	175.1	-100.8	-173.7	174.1	178	-0.7	111.4	H502 S503 R508 K509 Y510	H502-R506 PolarHBondContact O-N 2.94Å; S503-R506 PolarHBondContact O-N 3.05Å; R506-R508 VanDerWaalsContact C-N 3.32Å; R506-R508 PolarHBondContact O-N 2.83Å; R506-K509 CarbonylContact O-C 3.59Å; R506-K509 WeakPolarHBondContact O-CA 3.5Å; R506-K509 WeakPolarHBondContact O-CB 3.49Å; R506-K509 PolarHBondContact O-N 3.29Å; R506-K509 VanDerWaalsContact O-N 3.09Å; R506-Y510 PolarHBondContact O-N 2.88Å
507	F	60.1	Low	61.2	Low	157 Å²	157	124.7 Å²	124.7	69%	0.689	59%	0.588	S	S	*	*	H	α-helix	trans	-59.3	-43.5	173	-115.6	-89.4	0	0	0	111.1	S503 K509 Y510 Q511	S503-F507 WeakPolarHBondContact O-CB 3.26Å; S503-F507 PolarHBondContact O-N 3.23Å; F507-K509 VanDerWaalsContact C-N 3.35Å; F507-K509 PolarHBondContact O-N 3.09Å; F507-Y510 PolarHBondContact O-N 3.28Å; F507-Q511 PolarHBondContact O-N 3Å
508	R	56.6	Low	60.1	Low	192 Å²	192	125.6 Å²	125.6	73%	0.725	59%	0.592	S	S	*	*	H	α-helix	trans	-60.7	-38.1	171.8	-103.9	-179.9	169.5	179.7	-3.2	113.4	R504 K505 R506 T512	R504-R508 PolarHBondContact O-N 2.8Å; K505-R508 WeakPolarHBondContact O-CB 3.22Å; K505-R508 PolarHBondContact O-N 3.46Å; R506-R508 VanDerWaalsContact C-N 3.32Å; R506-R508 PolarHBondContact O-N 2.83Å; R508-T512 PolarHBondContact O-N 2.9Å; R508-T512 VanDerWaalsContact O-N 3.07Å; R508-T512 PolarHBondContact O-OG1 3.43Å
509	K	59.7	Low	58.8	Low	155 Å²	155	131 Å²	131	67%	0.674	60%	0.604	S	S	*	*	H	α-helix	trans	-68.6	-39.5	174.5	-93	-171.8	176.9	-178.1	0	113	K505 R506 F507 T512 S513	K505-K509 PolarHBondContact O-N 2.92Å; R506-K509 CarbonylContact O-C 3.59Å; R506-K509 WeakPolarHBondContact O-CA 3.5Å; R506-K509 WeakPolarHBondContact O-CB 3.49Å; R506-K509 PolarHBondContact O-N 3.29Å; R506-K509 VanDerWaalsContact O-N 3.09Å; F507-K509 VanDerWaalsContact C-N 3.35Å; F507-K509 PolarHBondContact O-N 3.09Å; K509-T512 WeakPolarHBondContact CA-OG1 3.46Å; K509-T512 PolarHBondContact O-N 2.77Å; K509-T512 PolarHBondContact O-OG1 3.07Å; K509-S513 PolarHBondContact O-N 3.33Å
510	Y	56.1	Low	57.4	Low	175 Å²	175	136 Å²	136	69%	0.686	63%	0.631	S	S	*	*	H	α-helix	trans	-66	-42.7	175.1	-115	-87.7	0	0	0	111.1	R506 F507 T512 S513 L514	R506-Y510 PolarHBondContact O-N 2.88Å; F507-Y510 PolarHBondContact O-N 3.28Å; Y510-T512 VanDerWaalsContact C-N 3.27Å; Y510-T512 PolarHBondContact O-N 3.09Å; Y510-S513 PolarHBondContact O-N 3.38Å; Y510-L514 HydrophobicContact CD1-CD1 4.41Å; Y510-L514 WeakPolarHBondContact O-CB 3.46Å; Y510-L514 PolarHBondContact O-N 3.39Å
511	Q	55.8	Low	56.8	Low	126 Å²	126	139 Å²	139	59%	0.589	64%	0.642	S	S	*	*	H	α-helix	trans	-58.5	-38.4	171.9	-102	173.5	-27.1	0	0	112.3	F507 H515	F507-Q511 PolarHBondContact O-N 3Å; Q511-H515 PolarHBondContact O-N 3.23Å; Q511-H515 VanDerWaalsContact O-N 3.09Å
512	T	56.9	Low	56.3	Low	86 Å²	86	142.3 Å²	142.3	53%	0.528	65%	0.652	S	S	.	*	H	α-helix	trans	-75.8	-31.1	176.7	33.3	0	0	0	0	113.6	R508 K509 Y510 H515 K516	R508-T512 PolarHBondContact O-N 2.9Å; R508-T512 VanDerWaalsContact O-N 3.07Å; R508-T512 PolarHBondContact O-OG1 3.43Å; K509-T512 WeakPolarHBondContact CA-OG1 3.46Å; K509-T512 PolarHBondContact O-N 2.77Å; K509-T512 PolarHBondContact O-OG1 3.07Å; Y510-T512 VanDerWaalsContact C-N 3.27Å; Y510-T512 PolarHBondContact O-N 3.09Å; T512-H515 PolarHBondContact O-N 3.36Å; T512-K516 PolarHBondContact O-N 3.01Å; T512-K516 VanDerWaalsContact O-N 3.07Å
513	S	55.7	Low	55.7	Low	74 Å²	74	143.3 Å²	143.3	52%	0.517	66%	0.656	S	S	.	*	H	α-helix	trans	-73	-38.7	172.2	-76.4	0	0	0	0	113	K509 Y510 H515 K516 N517	K509-S513 PolarHBondContact O-N 3.33Å; Y510-S513 PolarHBondContact O-N 3.38Å; S513-H515 PolarHBondContact O-N 3.32Å; S513-K516 PolarHBondContact O-N 3.47Å; S513-K516 VanDerWaalsContact O-N 3.07Å; S513-N517 PolarHBondContact O-N 3.07Å
514	L	51.6	Low	55.3	Low	112 Å²	112	148.6 Å²	148.6	59%	0.586	67%	0.673	S	S	*	*	H	α-helix	trans	-58.1	-38.6	168.5	-99.9	137.1	0	0	0	110.7	Y510 K516 I518	Y510-L514 HydrophobicContact CD1-CD1 4.41Å; Y510-L514 WeakPolarHBondContact O-CB 3.46Å; Y510-L514 PolarHBondContact O-N 3.39Å; L514-K516 VanDerWaalsContact C-N 3.35Å; L514-K516 PolarHBondContact O-N 2.87Å; L514-I518 WeakPolarHBondContact O-CD1 3.35Å; L514-I518 WeakPolarHBondContact O-CG1 3.41Å
515	H	55.2	Low	54.9	Low	130 Å²	130	146.7 Å²	146.7	60%	0.602	67%	0.673	S	S	*	*	H	α-helix	trans	-68.3	-28.5	174.2	-114.1	-59.2	0	0	0	114.4	Q511 T512 S513	Q511-H515 PolarHBondContact O-N 3.23Å; Q511-H515 VanDerWaalsContact O-N 3.09Å; T512-H515 PolarHBondContact O-N 3.36Å; S513-H515 PolarHBondContact O-N 3.32Å
516	K	55.5	Low	54.3	Low	168 Å²	168	147.8 Å²	147.8	73%	0.73	68%	0.68	S	S	*	*	H	α-helix	trans	-79.8	-33.3	176.5	-87.8	-172	172.7	-173.6	0	113.5	T512 S513 L514 I518 Y519	T512-K516 PolarHBondContact O-N 3.01Å; T512-K516 VanDerWaalsContact O-N 3.07Å; S513-K516 PolarHBondContact O-N 3.47Å; S513-K516 VanDerWaalsContact O-N 3.07Å; L514-K516 VanDerWaalsContact C-N 3.35Å; L514-K516 PolarHBondContact O-N 2.87Å; K516-I518 PolarHBondContact O-N 3.07Å; K516-Y519 PolarHBondContact O-N 3.25Å
517	N	50.5	Low	53.8	Low	126 Å²	126	144.6 Å²	144.6	67%	0.674	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-6.6	175.5	-93.6	-8.6	0	0	0	113.9	S513 Y519	S513-N517 PolarHBondContact O-N 3.07Å; N517-Y519 VanDerWaalsContact C-N 3.3Å
518	I	50.4	Low	53.3	Low	118 Å²	118	143.7 Å²	143.7	61%	0.605	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-4.5	172.3	-68.1	166.9	0	0	0	111.6	L514 K516	L514-I518 WeakPolarHBondContact O-CD1 3.35Å; L514-I518 WeakPolarHBondContact O-CG1 3.41Å; K516-I518 PolarHBondContact O-N 3.07Å
519	Y	46	Very low	53.1	Low	198 Å²	198	139.7 Å²	139.7	78%	0.776	67%	0.671	S	S	*	*			trans	-121.4	20.5	-178.7	-81.8	-79.2	0	0	0	115.1	K516 N517	K516-Y519 PolarHBondContact O-N 3.25Å; N517-Y519 VanDerWaalsContact C-N 3.3Å
520	L	43.6	Very low	52.5	Low	208 Å²	208	138.3 Å²	138.3	100%	1.089	67%	0.671	S	S	*	*			trans	-108.5	0	157.3	-81.2	161.1	0	0	0	107.3

Retrieved 520 of 520 residues in 240.1 ms (Link to these results)

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