A0A077ZMW6_TRITR Loading...

Glutamyl tRNA(Gln) amidotransferase

AlphaFold DB , UniProt , Accession A0A077ZMW6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 478 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	89.5	Confident	94.5	Very high	40 Å²	40	53.4 Å²	53.4	20%	0.197	29%	0.29	C	S	.	.				0	-12.2	0	-69	-168.7	-70.3	0	0	112.8	C3 G51 N52 I73 L76 I108 L127 L130	M1-C3 PolarHBondContact O-N 3.31Å; M1-C3 PolarHBondContact O-SG 3.31Å; M1-G51 CarbonylContact O-C 3.12Å; M1-G51 VanDerWaalsContact O-CA 3.25Å; M1-G51 WeakPolarHBondContact O-CA 3.46Å; M1-N52 CarbonylContact C-O 3.52Å; M1-N52 VanDerWaalsContact CA-O 3.31Å; M1-N52 WeakPolarHBondContact CA-O 3.34Å; M1-N52 PolarHBondContact O-N 3.1Å; M1-I73 HydrophobicContact CB-CD1 3.58Å; M1-I73 HydrophobicContact CG-CD1 3.53Å; M1-I73 HydrophobicContact SD-CD1 3.76Å; M1-L76 HydrophobicContact CE-CD1 3.3Å; M1-L76 HydrophobicContact SD-CD1 4.2Å; M1-I108 HydrophobicContact CE-CD1 4.32Å; M1-I108 HydrophobicContact SD-CD1 3.93Å; M1-I108 HydrophobicContact SD-CG2 4.37Å; M1-L127 HydrophobicContact SD-CD2 4.16Å; M1-L130 HydrophobicContact CE-CD2 4.4Å; M1-L130 HydrophobicContact CG-CD1 4.27Å; M1-L130 HydrophobicContact CG-CD2 4.41Å
2	N	92.1	Very high	94.6	Very high	109 Å²	109	48.9 Å²	48.9	58%	0.583	27%	0.266	S	S	*	.			trans	53.1	29	166.4	-52.8	-22.8	0	0	0	115	N52	N2-N52 PolarHBondContact ND2-OD1 2.88Å
3	C	95.5	Very high	94.5	Very high	24 Å²	24	48.7 Å²	48.7	16%	0.162	26%	0.258	C	S	.	.			trans	-79	153.3	-179.4	-54	0	0	0	0	110.8	M1 I5 A48 V49 G51	M1-C3 PolarHBondContact O-N 3.31Å; M1-C3 PolarHBondContact O-SG 3.31Å; C3-I5 PolarHBondContact O-N 2.96Å; C3-A48 HydrophobicContact CB-CB 3.61Å; C3-V49 CarbonylContact C-O 3.57Å; C3-V49 WeakPolarHBondContact CA-O 3.21Å; C3-V49 WeakPolarHBondContact CB-O 3.47Å; C3-G51 VanDerWaalsContact SG-CA 3.55Å
4	S	95.8	Very high	94.4	Very high	72 Å²	72	48.1 Å²	48.1	50%	0.503	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	115.6	162.2	-55.6	0	0	0	0	109.1	A48 V49	S4-A48 VanDerWaalsContact O-CA 3.29Å; S4-A48 WeakPolarHBondContact O-CA 3.33Å; S4-V49 PolarHBondContact N-O 2.87Å; S4-V49 PolarHBondContact O-N 2.92Å
5	I	95.4	Very high	94.1	Very high	71 Å²	71	47.1 Å²	47.1	36%	0.364	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.2	179.1	-60.6	172.5	0	0	0	108.9	C3 L237 I256	C3-I5 PolarHBondContact O-N 2.96Å; I5-L237 HydrophobicContact CG2-CD1 3.42Å; I5-L237 VanDerWaalsContact CG2-CD1 3.42Å; I5-I256 HydrophobicContact CB-CD1 4.32Å; I5-I256 HydrophobicContact CD1-CD1 4.47Å; I5-I256 HydrophobicContact CD1-CG2 3.93Å; I5-I256 HydrophobicContact CG2-CD1 3.78Å
6	A	94.1	Very high	93.6	Very high	27 Å²	27	47 Å²	47	22%	0.223	24%	0.242	C	C	.	.			trans	-74.4	125.6	176.6	0	0	0	0	0	110.5	V8 P46 I47	A6-V8 PolarHBondContact O-N 2.97Å; A6-P46 WeakPolarHBondContact CB-O 2.97Å; A6-I47 PolarHBondContact N-O 2.88Å
7	R	93.2	Very high	93.1	Very high	116 Å²	116	52.9 Å²	52.9	44%	0.438	27%	0.265	S	S	.	.	S	Bend	trans	-65.9	-26.9	173.7	-70.7	-179.1	172.3	168.9	-2.5	112.7	R236 L237 D239	R7-R236 WeakPolarHBondContact O-CA 3.36Å; R7-L237 PolarHBondContact O-N 2.63Å; R7-D239 IonicContact CZ-OD2 2.86Å; R7-D239 IonicContact NE-OD2 3.45Å; R7-D239 PolarHBondContact NE-OD2 2.63Å; R7-D239 IonicContact NH2-OD1 3.92Å; R7-D239 PolarHBondContact NH2-OD1 3.38Å; R7-D239 IonicContact NH2-OD2 3.86Å; R7-D239 PolarHBondContact NH2-OD2 2.7Å
8	V	94.5	Very high	92.6	Very high	60 Å²	60	57.4 Å²	57.4	36%	0.364	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	124.6	173.9	-175	0	0	0	0	107.7	A6 P234 L235 R236	A6-V8 PolarHBondContact O-N 2.97Å; V8-P234 HydrophobicContact CG1-CB 3.79Å; V8-L235 CarbonylContact C-O 3.59Å; V8-L235 WeakPolarHBondContact CA-O 3.22Å; V8-R236 HydrophobicContact CG2-CG 4.46Å
9	S	96.2	Very high	92.1	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.2	176.3	178	0	0	0	0	109.3	Q42 H45 P234 L235	S9-Q42 PolarHBondContact OG-NE2 3.29Å; S9-H45 WeakPolarHBondContact CA-O 3.23Å; S9-H45 WeakPolarHBondContact CB-O 2.99Å; S9-H45 PolarHBondContact OG-O 3.22Å; S9-P234 CarbonylContact O-C 3.56Å; S9-P234 WeakPolarHBondContact O-CA 3.43Å; S9-L235 PolarHBondContact N-O 3.21Å; S9-L235 PolarHBondContact O-N 3.44Å
10	T	96.7	Very high	91.7	Very high	31 Å²	31	55.8 Å²	55.8	19%	0.19	28%	0.283	C	S	.	.			trans	-121.7	151.8	-178.4	62.6	0	0	0	0	110.3	Q42 H45 P234	T10-Q42 WeakPolarHBondContact O-CG 3.36Å; T10-H45 PolarHBondContact N-O 3.35Å; T10-H45 WeakPolarHBondContact OG1-CB 3.36Å; T10-H45 PolarHBondContact OG1-ND1 3.16Å; T10-P234 HydrophobicContact CG2-CB 4.18Å; T10-P234 HydrophobicContact CG2-CG 4.33Å
11	F	96.5	Very high	91.3	Very high	37 Å²	37	53.2 Å²	53.2	16%	0.162	27%	0.27	C	S	.	.			trans	-96.5	151.1	174	-65.3	-85.1	0	0	0	110.6	I40 T41 Q42 I78 E229 L232 L235	F11-I40 HydrophobicContact CB-CG2 3.93Å; F11-I40 HydrophobicContact CD1-CG2 3.94Å; F11-I40 HydrophobicContact CG-CG2 4.24Å; F11-T41 CarbonylContact C-O 3.54Å; F11-T41 WeakPolarHBondContact CA-O 3.12Å; F11-Q42 HydrophobicContact CD1-CG 3.88Å; F11-Q42 HydrophobicContact CE1-CG 4.1Å; F11-I78 HydrophobicContact CE1-CB 4.4Å; F11-I78 HydrophobicContact CE1-CG2 4.38Å; F11-E229 HydrophobicContact CB-CB 3.95Å; F11-E229 HydrophobicContact CB-CG 4.45Å; F11-E229 WeakPolarHBondContact O-CB 3.3Å; F11-E229 PolarHBondContact O-N 3.47Å; F11-L232 HydrophobicContact CB-CB 4.39Å; F11-L232 HydrophobicContact CB-CD1 3.94Å; F11-L232 HydrophobicContact CD1-CD1 4.29Å; F11-L232 HydrophobicContact CD2-CB 4Å; F11-L232 HydrophobicContact CD2-CD1 3.82Å; F11-L232 HydrophobicContact CE2-CD1 4.4Å; F11-L232 HydrophobicContact CG-CB 4.47Å; F11-L232 HydrophobicContact CG-CD1 3.75Å; F11-L235 HydrophobicContact CE2-CB 4.4Å
12	D	96	Very high	90.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152	-175.7	-57.3	-58	0	0	0	110.1	I40 T41 Y43 Y44 L227 P228	D12-I40 WeakPolarHBondContact O-CA 3.26Å; D12-T41 PolarHBondContact N-O 3.3Å; D12-T41 PolarHBondContact O-N 2.92Å; D12-Y43 WeakPolarHBondContact OD2-CA 3.33Å; D12-Y43 PolarHBondContact OD2-N 3.45Å; D12-Y44 VanDerWaalsContact OD1-CD2 3.22Å; D12-Y44 WeakPolarHBondContact OD1-CD2 3.49Å; D12-Y44 PolarHBondContact OD2-N 2.86Å; D12-L227 CarbonylContact C-O 3.54Å; D12-L227 WeakPolarHBondContact CA-O 3.4Å; D12-P228 WeakPolarHBondContact OD1-CA 3.45Å
13	R	93.4	Very high	88.9	Confident	46 Å²	46	47.9 Å²	47.9	17%	0.174	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	119.6	174.7	-64	-176	178.7	172.7	4.1	110.2	H15 Y38 Y226 L227 E229 N231	R13-H15 WeakPolarHBondContact CB-CE1 3.42Å; R13-H15 PolarHBondContact O-ND1 2.88Å; R13-Y38 HydrophobicContact CB-CD2 3.99Å; R13-Y38 HydrophobicContact CB-CG 4.08Å; R13-Y38 HydrophobicContact CG-CD2 3.61Å; R13-Y38 HydrophobicContact CG-CE2 3.8Å; R13-Y38 HydrophobicContact CG-CG 4.05Å; R13-Y38 PolarHBondContact NH2-OH 3.44Å; R13-Y226 WeakPolarHBondContact O-CA 3.5Å; R13-L227 PolarHBondContact N-O 2.6Å; R13-L227 PolarHBondContact O-N 2.98Å; R13-E229 HydrophobicContact CG-CB 4.36Å; R13-E229 WeakPolarHBondContact CG-OE2 2.9Å; R13-E229 IonicContact CZ-OE1 2.7Å; R13-E229 IonicContact CZ-OE2 3.77Å; R13-E229 IonicContact NE-OE1 3.68Å; R13-E229 PolarHBondContact NE-OE1 3.49Å; R13-E229 IonicContact NE-OE2 2.8Å; R13-E229 PolarHBondContact NE-OE2 3.22Å; R13-E229 IonicContact NH2-OE1 3.28Å; R13-E229 PolarHBondContact NH2-OE1 2.56Å; R13-E229 IonicContact NH2-OE2 3.84Å; R13-E229 PolarHBondContact NH2-OE2 3.23Å; R13-N231 PolarHBondContact NH2-ND2 3.42Å
14	K	92.8	Very high	86.9	Confident	41 Å²	41	51.3 Å²	51.3	18%	0.178	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	105.1	167.1	-175.8	-174.2	178.6	-176.4	0	108.6	Y16 Y38 Q39 T41 Y224 Y226	K14-Y16 HydrophobicContact CD-CD1 4.41Å; K14-Y16 HydrophobicContact CD-CE1 4.14Å; K14-Y16 HydrophobicContact CG-CD1 4.13Å; K14-Y16 HydrophobicContact CG-CE1 4.25Å; K14-Y16 WeakPolarHBondContact O-CD1 3.49Å; K14-Y38 CarbonylContact O-C 3.49Å; K14-Y38 VanDerWaalsContact O-CA 3.25Å; K14-Y38 WeakPolarHBondContact O-CA 3.42Å; K14-Y38 WeakPolarHBondContact O-CB 3.46Å; K14-Q39 HydrophobicContact CB-CB 4.42Å; K14-Q39 PolarHBondContact N-O 2.92Å; K14-Q39 PolarHBondContact O-N 2.93Å; K14-T41 HydrophobicContact CB-CG2 3.93Å; K14-Y224 HydrophobicContact CD-CD1 4.41Å; K14-Y224 HydrophobicContact CG-CD1 3.84Å; K14-Y224 HydrophobicContact CG-CG 3.83Å; K14-Y226 HydrophobicContact CB-CD1 4.3Å; K14-Y226 HydrophobicContact CB-CE1 3.7Å; K14-Y226 HydrophobicContact CD-CE1 4.4Å; K14-Y226 HydrophobicContact CG-CE1 3.88Å
15	H	90.3	Very high	84.8	Confident	32 Å²	32	52.4 Å²	52.4	15%	0.148	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	119.3	-174.5	-62.7	83.9	0	0	0	111.6	R13 G37 Y224 R225	R13-H15 WeakPolarHBondContact CB-CE1 3.42Å; R13-H15 PolarHBondContact O-ND1 2.88Å; H15-G37 WeakPolarHBondContact CA-O 3.45Å; H15-Y224 WeakPolarHBondContact CA-O 3.48Å; H15-Y224 WeakPolarHBondContact CB-O 3.29Å; H15-Y224 PolarHBondContact N-O 3.46Å; H15-Y224 WeakPolarHBondContact O-CA 3.39Å; H15-R225 HydrophobicContact CB-CB 4.45Å; H15-R225 PolarHBondContact CE1-O 3.48Å; H15-R225 PolarHBondContact ND1-O 3.48Å
16	Y	86.1	Confident	82.5	Confident	46 Å²	46	52.2 Å²	52.2	18%	0.18	26%	0.258	C	S	.	.			trans	-156.2	148.7	167.3	60.4	-82.5	0	0	0	109.1	K14 Q21 G37 Q39 T82 Y224	K14-Y16 HydrophobicContact CD-CD1 4.41Å; K14-Y16 HydrophobicContact CD-CE1 4.14Å; K14-Y16 HydrophobicContact CG-CD1 4.13Å; K14-Y16 HydrophobicContact CG-CE1 4.25Å; K14-Y16 WeakPolarHBondContact O-CD1 3.49Å; Y16-Q21 HydrophobicContact CE2-CB 4.09Å; Y16-Q21 HydrophobicContact CE2-CG 4.15Å; Y16-G37 PolarHBondContact N-O 2.76Å; Y16-G37 CarbonylContact O-C 3.58Å; Y16-Q39 HydrophobicContact CE1-CB 3.69Å; Y16-Q39 PolarHBondContact OH-OE1 3.44Å; Y16-T82 WeakPolarHBondContact OH-CG2 3.48Å; Y16-Y224 HydrophobicContact CD1-CD1 4.16Å; Y16-Y224 HydrophobicContact CD1-CE1 4.28Å; Y16-Y224 HydrophobicContact CG-CE1 4.42Å
17	F	85.2	Confident	80.3	Confident	147 Å²	147	55.7 Å²	55.7	65%	0.645	27%	0.273	S	S	*	.			trans	-99.5	118.8	179.5	-63.3	-80.9	0	0	0	109.5	A36	F17-A36 WeakPolarHBondContact CE1-O 3.17Å
18	Y	83.5	Confident	78.1	Confident	134 Å²	134	56.6 Å²	56.6	53%	0.525	29%	0.286	S	S	.	.			trans	-151.5	152.1	170	-149.2	-95.2	0	0	0	109.7	D20 Q21	Y18-D20 VanDerWaalsContact C-N 3.27Å; Y18-D20 HydrophobicContact CD1-CB 4.48Å; Y18-D20 VanDerWaalsContact CD1-CG 3.45Å; Y18-D20 WeakPolarHBondContact CD1-OD1 3.36Å; Y18-D20 WeakPolarHBondContact CD1-OD2 3.43Å; Y18-D20 WeakPolarHBondContact CE1-OD2 3.25Å; Y18-D20 PolarHBondContact O-N 3.32Å; Y18-Q21 PolarHBondContact O-N 3.04Å
19	A	83	Confident	76.2	Confident	62 Å²	62	63 Å²	63	51%	0.512	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-28.2	-171.9	0	0	0	0	0	113.3	I96	A19-I96 HydrophobicContact CB-CD1 3.52Å; A19-I96 HydrophobicContact CB-CG1 3.97Å
20	D	84	Confident	73.8	Confident	20 Å²	20	71.4 Å²	71.4	11%	0.107	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	1.3	177.5	58.6	22.5	0	0	0	114.5	Y18 P22 G83 T85	Y18-D20 VanDerWaalsContact C-N 3.27Å; Y18-D20 HydrophobicContact CD1-CB 4.48Å; Y18-D20 VanDerWaalsContact CD1-CG 3.45Å; Y18-D20 WeakPolarHBondContact CD1-OD1 3.36Å; Y18-D20 WeakPolarHBondContact CD1-OD2 3.43Å; Y18-D20 WeakPolarHBondContact CE1-OD2 3.25Å; Y18-D20 PolarHBondContact O-N 3.32Å; D20-P22 WeakPolarHBondContact O-CD 3.45Å; D20-G83 WeakPolarHBondContact O-CA 3.49Å; D20-G83 PolarHBondContact O-N 2.92Å; D20-T85 WeakPolarHBondContact CB-OG1 3.35Å; D20-T85 PolarHBondContact OD2-OG1 3.43Å
21	Q	83.6	Confident	71.3	Confident	2 Å²	2	75.4 Å²	75.4	1%	0.009	37%	0.366	C	S	.	.			trans	-117.2	67.5	176.9	-169.2	58.1	24	0	0	112	Y16 Y18 A36 Y38 T82	Y16-Q21 HydrophobicContact CE2-CB 4.09Å; Y16-Q21 HydrophobicContact CE2-CG 4.15Å; Y18-Q21 PolarHBondContact O-N 3.04Å; Q21-A36 WeakPolarHBondContact O-CA 3.21Å; Q21-Y38 PolarHBondContact NE2-O 3.41Å; Q21-T82 HydrophobicContact CB-CG2 4.33Å
22	P	70.6	Confident	69.1	Low	17 Å²	17	79.9 Å²	79.9	11%	0.11	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	136.9	171.2	33.2	-33.4	0	0	0	110.9	D20 F34 L98	D20-P22 WeakPolarHBondContact O-CD 3.45Å; P22-F34 HydrophobicContact CB-CB 4.02Å; P22-F34 HydrophobicContact CB-CD1 3.9Å; P22-F34 HydrophobicContact CB-CG 4.39Å; P22-F34 HydrophobicContact CG-CD1 4.31Å; P22-L98 HydrophobicContact CG-CD1 3.81Å; P22-L98 HydrophobicContact CG-CD2 3.54Å; P22-L98 HydrophobicContact CG-CG 4.31Å
23	V	59.9	Low	66.7	Low	20 Å²	20	82.5 Å²	82.5	12%	0.121	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	121	159.7	-174.5	0	0	0	0	107	F25 K35 Y38	V23-F25 HydrophobicContact CG1-CD2 4.14Å; V23-F25 HydrophobicContact CG1-CE2 4.03Å; V23-F25 PolarHBondContact O-N 2.99Å; V23-K35 VanDerWaalsContact CA-O 3.32Å; V23-K35 WeakPolarHBondContact CA-O 3.5Å; V23-K35 WeakPolarHBondContact CB-O 3.33Å; V23-K35 WeakPolarHBondContact CG2-O 3.29Å; V23-K35 PolarHBondContact N-O 2.97Å; V23-K35 PolarHBondContact O-N 3.17Å; V23-Y38 HydrophobicContact CB-CE1 4.38Å; V23-Y38 HydrophobicContact CG1-CE1 4.09Å; V23-Y38 HydrophobicContact CG1-CE2 4.32Å; V23-Y38 HydrophobicContact CG2-CD1 3.73Å; V23-Y38 HydrophobicContact CG2-CD2 4.12Å; V23-Y38 HydrophobicContact CG2-CE1 3.66Å; V23-Y38 HydrophobicContact CG2-CE2 4.06Å; V23-Y38 HydrophobicContact CG2-CG 3.96Å
24	L	53.8	Low	64.7	Low	97 Å²	97	85.8 Å²	85.8	51%	0.508	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	109.8	174.3	-163.9	79.3	0	0	0	108.9	V26 F32 F34	L24-V26 HydrophobicContact CD2-CG2 3.87Å; L24-V26 HydrophobicContact CG-CG2 4.13Å; L24-F32 HydrophobicContact CD1-CD1 3.58Å; L24-F32 HydrophobicContact CD1-CE1 3.75Å; L24-F32 HydrophobicContact CD2-CE1 4.05Å; L24-F32 HydrophobicContact CG-CD1 4.23Å; L24-F32 HydrophobicContact CG-CE1 4.17Å; L24-F34 HydrophobicContact CD1-CD1 3.96Å; L24-F34 HydrophobicContact CD1-CE1 3.44Å; L24-F34 VanDerWaalsContact CD1-CE1 3.44Å; L24-F34 HydrophobicContact CD1-CZ 4.16Å
25	F	51.1	Low	63	Low	94 Å²	94	89.1 Å²	89.1	41%	0.412	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.3	162.1	-91.6	-97.3	0	0	0	108.2	V23 S33 K35	V23-F25 HydrophobicContact CG1-CD2 4.14Å; V23-F25 HydrophobicContact CG1-CE2 4.03Å; V23-F25 PolarHBondContact O-N 2.99Å; F25-S33 WeakPolarHBondContact CA-O 3.39Å; F25-S33 WeakPolarHBondContact CB-O 3.21Å; F25-S33 PolarHBondContact N-O 3.43Å; F25-S33 PolarHBondContact O-N 2.94Å; F25-K35 HydrophobicContact CD2-CB 3.93Å; F25-K35 HydrophobicContact CD2-CD 3.7Å; F25-K35 HydrophobicContact CD2-CG 3.96Å; F25-K35 HydrophobicContact CE2-CB 4.35Å; F25-K35 HydrophobicContact CE2-CD 3.95Å; F25-K35 HydrophobicContact CG-CD 4.1Å; F25-K35 HydrophobicContact CG-CG 4.46Å
26	V	47.5	Very low	61.5	Low	67 Å²	67	89.9 Å²	89.9	41%	0.406	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	109.5	168.6	-177.8	0	0	0	0	107	L24 F32	L24-V26 HydrophobicContact CD2-CG2 3.87Å; L24-V26 HydrophobicContact CG-CG2 4.13Å; V26-F32 HydrophobicContact CG2-CE1 4.1Å; V26-F32 HydrophobicContact CG2-CZ 4.46Å
27	D	48.6	Very low	61.1	Low	101 Å²	101	88.1 Å²	88.1	54%	0.54	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	115.7	171.3	-147.9	-12.7	0	0	0	108.8	F29 K30 N31	D27-F29 VanDerWaalsContact C-N 3.27Å; D27-F29 PolarHBondContact O-N 2.89Å; D27-F29 VanDerWaalsContact O-N 3.08Å; D27-K30 PolarHBondContact O-N 3.37Å; D27-K30 VanDerWaalsContact O-N 3.11Å; D27-N31 PolarHBondContact N-O 3.46Å; D27-N31 VanDerWaalsContact N-O 3.1Å; D27-N31 PolarHBondContact O-N 2.65Å; D27-N31 VanDerWaalsContact O-N 3.16Å
28	N	45.8	Very low	61.3	Low	134 Å²	134	82.2 Å²	82.2	72%	0.717	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	36.4	174.8	-73.3	-46.2	0	0	0	116.2	K30	N28-K30 WeakPolarHBondContact O-CG 3.5Å; N28-K30 PolarHBondContact O-N 2.92Å
29	F	54.6	Low	61.6	Low	196 Å²	196	76.3 Å²	76.3	86%	0.86	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	13.7	-177.5	-75.7	-88.9	0	0	0	115.1	D27	D27-F29 VanDerWaalsContact C-N 3.27Å; D27-F29 PolarHBondContact O-N 2.89Å; D27-F29 VanDerWaalsContact O-N 3.08Å
30	K	45.9	Very low	62.1	Low	176 Å²	176	74.5 Å²	74.5	77%	0.765	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.2	-32.7	-171.2	-76.6	179.4	-179.3	-177.4	0	113.1	D27 N28	D27-K30 PolarHBondContact O-N 3.37Å; D27-K30 VanDerWaalsContact O-N 3.11Å; N28-K30 WeakPolarHBondContact O-CG 3.5Å; N28-K30 PolarHBondContact O-N 2.92Å
31	N	44.3	Very low	62.6	Low	114 Å²	114	73.6 Å²	73.6	61%	0.61	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	116.6	-179.2	-68.6	-33.6	0	0	0	110.1	D27 S33	D27-N31 PolarHBondContact N-O 3.46Å; D27-N31 VanDerWaalsContact N-O 3.1Å; D27-N31 PolarHBondContact O-N 2.65Å; D27-N31 VanDerWaalsContact O-N 3.16Å; N31-S33 PolarHBondContact O-N 3.3Å
32	F	50.7	Low	63.3	Low	131 Å²	131	73.5 Å²	73.5	58%	0.575	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	111.3	167.9	-82.7	-94.9	0	0	0	108.5	L24 V26 F34	L24-F32 HydrophobicContact CD1-CD1 3.58Å; L24-F32 HydrophobicContact CD1-CE1 3.75Å; L24-F32 HydrophobicContact CD2-CE1 4.05Å; L24-F32 HydrophobicContact CG-CD1 4.23Å; L24-F32 HydrophobicContact CG-CE1 4.17Å; V26-F32 HydrophobicContact CG2-CE1 4.1Å; V26-F32 HydrophobicContact CG2-CZ 4.46Å; F32-F34 HydrophobicContact CB-CE2 4.4Å
33	S	45.2	Very low	64.4	Low	56 Å²	56	77.5 Å²	77.5	39%	0.392	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	114.6	167.7	-173.1	0	0	0	0	107.9	F25 N31 K35	F25-S33 WeakPolarHBondContact CA-O 3.39Å; F25-S33 WeakPolarHBondContact CB-O 3.21Å; F25-S33 PolarHBondContact N-O 3.43Å; F25-S33 PolarHBondContact O-N 2.94Å; N31-S33 PolarHBondContact O-N 3.3Å; S33-K35 PolarHBondContact O-N 3.21Å
34	F	52.9	Low	66	Low	114 Å²	114	82 Å²	82	50%	0.5	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	112.6	171.9	-63.3	-81	0	0	0	108	P22 L24 F32 L98	P22-F34 HydrophobicContact CB-CB 4.02Å; P22-F34 HydrophobicContact CB-CD1 3.9Å; P22-F34 HydrophobicContact CB-CG 4.39Å; P22-F34 HydrophobicContact CG-CD1 4.31Å; L24-F34 HydrophobicContact CD1-CD1 3.96Å; L24-F34 HydrophobicContact CD1-CE1 3.44Å; L24-F34 VanDerWaalsContact CD1-CE1 3.44Å; L24-F34 HydrophobicContact CD1-CZ 4.16Å; F32-F34 HydrophobicContact CB-CE2 4.4Å; F34-L98 HydrophobicContact CD1-CD1 4.33Å; F34-L98 HydrophobicContact CE1-CD1 4.04Å; F34-L98 HydrophobicContact CZ-CD1 4.5Å
35	K	56.1	Low	68	Low	112 Å²	112	82.4 Å²	82.4	49%	0.487	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	104.2	172.1	-65.7	-170.9	-177.6	175.1	0	108	V23 F25 S33 G37	V23-K35 VanDerWaalsContact CA-O 3.32Å; V23-K35 WeakPolarHBondContact CA-O 3.5Å; V23-K35 WeakPolarHBondContact CB-O 3.33Å; V23-K35 WeakPolarHBondContact CG2-O 3.29Å; V23-K35 PolarHBondContact N-O 2.97Å; V23-K35 PolarHBondContact O-N 3.17Å; F25-K35 HydrophobicContact CD2-CB 3.93Å; F25-K35 HydrophobicContact CD2-CD 3.7Å; F25-K35 HydrophobicContact CD2-CG 3.96Å; F25-K35 HydrophobicContact CE2-CB 4.35Å; F25-K35 HydrophobicContact CE2-CD 3.95Å; F25-K35 HydrophobicContact CG-CD 4.1Å; F25-K35 HydrophobicContact CG-CG 4.46Å; S33-K35 PolarHBondContact O-N 3.21Å; K35-G37 PolarHBondContact O-N 3.33Å
36	A	58.5	Low	70.2	Confident	47 Å²	47	78.6 Å²	78.6	39%	0.388	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	135.7	169.2	0	0	0	0	0	109.6	F17 Q21	F17-A36 WeakPolarHBondContact CE1-O 3.17Å; Q21-A36 WeakPolarHBondContact O-CA 3.21Å
37	G	78.8	Confident	72.6	Confident	9 Å²	9	76.4 Å²	76.4	9%	0.093	37%	0.368	C	S	.	.			trans	178	-27.3	172	0	0	0	0	0	119.7	H15 Y16 K35	H15-G37 WeakPolarHBondContact CA-O 3.45Å; Y16-G37 PolarHBondContact N-O 2.76Å; Y16-G37 CarbonylContact O-C 3.58Å; K35-G37 PolarHBondContact O-N 3.33Å
38	Y	88.2	Confident	74.9	Confident	24 Å²	24	72 Å²	72	9%	0.094	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	158.7	179.1	60.2	-94.8	0	0	0	114.1	R13 K14 Q21 V23 I40	R13-Y38 HydrophobicContact CB-CD2 3.99Å; R13-Y38 HydrophobicContact CB-CG 4.08Å; R13-Y38 HydrophobicContact CG-CD2 3.61Å; R13-Y38 HydrophobicContact CG-CE2 3.8Å; R13-Y38 HydrophobicContact CG-CG 4.05Å; R13-Y38 PolarHBondContact NH2-OH 3.44Å; K14-Y38 CarbonylContact O-C 3.49Å; K14-Y38 VanDerWaalsContact O-CA 3.25Å; K14-Y38 WeakPolarHBondContact O-CA 3.42Å; K14-Y38 WeakPolarHBondContact O-CB 3.46Å; Q21-Y38 PolarHBondContact NE2-O 3.41Å; V23-Y38 HydrophobicContact CB-CE1 4.38Å; V23-Y38 HydrophobicContact CG1-CE1 4.09Å; V23-Y38 HydrophobicContact CG1-CE2 4.32Å; V23-Y38 HydrophobicContact CG2-CD1 3.73Å; V23-Y38 HydrophobicContact CG2-CD2 4.12Å; V23-Y38 HydrophobicContact CG2-CE1 3.66Å; V23-Y38 HydrophobicContact CG2-CE2 4.06Å; V23-Y38 HydrophobicContact CG2-CG 3.96Å; Y38-I40 HydrophobicContact CD2-CG1 4.27Å; Y38-I40 HydrophobicContact CE2-CG1 4.01Å
39	Q	91.4	Very high	77.4	Confident	9 Å²	9	68 Å²	68	4%	0.042	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.5	169.5	-176	-168.4	9.6	0	0	108.9	K14 Y16 E79 Q80	K14-Q39 HydrophobicContact CB-CB 4.42Å; K14-Q39 PolarHBondContact N-O 2.92Å; K14-Q39 PolarHBondContact O-N 2.93Å; Y16-Q39 HydrophobicContact CE1-CB 3.69Å; Y16-Q39 PolarHBondContact OH-OE1 3.44Å; Q39-E79 PolarHBondContact NE2-OE2 3.31Å; Q39-E79 VanDerWaalsContact NE2-OE2 3.15Å; Q39-Q80 HydrophobicContact CG-CB 4.47Å; Q39-Q80 WeakPolarHBondContact CG-O 3.35Å; Q39-Q80 PolarHBondContact NE2-O 3.03Å
40	I	93.1	Very high	79.4	Confident	24 Å²	24	64.2 Å²	64.2	12%	0.123	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	126.6	170.3	-56	-177.2	0	0	0	108.2	F11 D12 Y38 E79 Q80 E229 L232	F11-I40 HydrophobicContact CB-CG2 3.93Å; F11-I40 HydrophobicContact CD1-CG2 3.94Å; F11-I40 HydrophobicContact CG-CG2 4.24Å; D12-I40 WeakPolarHBondContact O-CA 3.26Å; Y38-I40 HydrophobicContact CD2-CG1 4.27Å; Y38-I40 HydrophobicContact CE2-CG1 4.01Å; I40-E79 WeakPolarHBondContact O-CA 3.44Å; I40-Q80 HydrophobicContact CB-CG 4.13Å; I40-Q80 PolarHBondContact O-N 2.98Å; I40-E229 HydrophobicContact CD1-CG 4.4Å; I40-L232 HydrophobicContact CD1-CD1 4.2Å; I40-L232 HydrophobicContact CG2-CD1 3.86Å
41	T	94.9	Very high	81.8	Confident	2 Å²	2	56 Å²	56	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	-168.9	-178.5	-172.8	0	0	0	0	109.7	F11 D12 K14 I78 Y226	F11-T41 CarbonylContact C-O 3.54Å; F11-T41 WeakPolarHBondContact CA-O 3.12Å; D12-T41 PolarHBondContact N-O 3.3Å; D12-T41 PolarHBondContact O-N 2.92Å; K14-T41 HydrophobicContact CB-CG2 3.93Å; T41-I78 CarbonylContact C-O 3.53Å; T41-I78 WeakPolarHBondContact CA-O 3.23Å; T41-Y226 HydrophobicContact CG2-CE1 3.96Å
42	Q	96.6	Very high	84.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.265	C	S	.	.			trans	-128.2	118.2	169.8	-53.3	175.3	-37.9	0	0	108.7	S9 T10 F11 I47 Q77 I78	S9-Q42 PolarHBondContact OG-NE2 3.29Å; T10-Q42 WeakPolarHBondContact O-CG 3.36Å; F11-Q42 HydrophobicContact CD1-CG 3.88Å; F11-Q42 HydrophobicContact CE1-CG 4.1Å; Q42-I47 VanDerWaalsContact OE1-N 3.12Å; Q42-Q77 HydrophobicContact CB-CB 4.08Å; Q42-Q77 PolarHBondContact O-OE1 3.02Å; Q42-Q77 VanDerWaalsContact O-OE1 3.13Å; Q42-I78 PolarHBondContact N-O 3.09Å; Q42-I78 VanDerWaalsContact OE1-N 3.09Å
43	Y	93.9	Very high	86.5	Confident	101 Å²	101	47.4 Å²	47.4	40%	0.396	24%	0.24	S	C	.	.	S	Bend	trans	-114.6	-52.1	-178.6	-178.3	-102.5	0	0	0	111.9	D12 Y226	D12-Y43 WeakPolarHBondContact OD2-CA 3.33Å; D12-Y43 PolarHBondContact OD2-N 3.45Å; Y43-Y226 HydrophobicContact CD1-CD1 4.23Å; Y43-Y226 HydrophobicContact CD1-CD2 4.3Å; Y43-Y226 AromaticContact CD1-CG 3.97Å; Y43-Y226 HydrophobicContact CD1-CG 3.97Å; Y43-Y226 HydrophobicContact CD2-CD1 4.13Å; Y43-Y226 HydrophobicContact CD2-CD2 4.18Å; Y43-Y226 AromaticContact CD2-CE1 3.85Å; Y43-Y226 HydrophobicContact CD2-CE1 3.85Å; Y43-Y226 AromaticContact CD2-CE2 3.93Å; Y43-Y226 HydrophobicContact CD2-CE2 3.93Å; Y43-Y226 HydrophobicContact CD2-CG 4.27Å; Y43-Y226 AromaticContact CD2-CZ 3.74Å; Y43-Y226 HydrophobicContact CE1-CD2 4.36Å; Y43-Y226 HydrophobicContact CE1-CG 4.43Å; Y43-Y226 HydrophobicContact CE2-CD2 4.25Å; Y43-Y226 AromaticContact CE2-CE2 4Å; Y43-Y226 HydrophobicContact CE2-CE2 4Å; Y43-Y226 AromaticContact CG-CD1 3.72Å; Y43-Y226 HydrophobicContact CG-CD1 3.72Å; Y43-Y226 HydrophobicContact CG-CD2 4.21Å; Y43-Y226 AromaticContact CG-CE1 3.88Å; Y43-Y226 HydrophobicContact CG-CE1 3.88Å; Y43-Y226 HydrophobicContact CG-CE2 4.37Å; Y43-Y226 AromaticContact CG-CG 3.88Å; Y43-Y226 HydrophobicContact CG-CG 3.88Å
44	Y	94.5	Very high	88.9	Confident	115 Å²	115	48.3 Å²	48.3	45%	0.451	24%	0.238	S	C	.	.	S	Bend	trans	-80.1	-42.3	-175.6	-62.4	-66.5	0	0	0	112.8	D12 Y226 P228	D12-Y44 VanDerWaalsContact OD1-CD2 3.22Å; D12-Y44 WeakPolarHBondContact OD1-CD2 3.49Å; D12-Y44 PolarHBondContact OD2-N 2.86Å; Y44-Y226 PolarHBondContact OH-O 2.98Å; Y44-P228 HydrophobicContact CE2-CG 4.5Å
45	H	96.1	Very high	90.8	Very high	104 Å²	104	43 Å²	43	48%	0.481	22%	0.215	S	C	.	.	S	Bend	trans	-129.5	70.7	-176.3	-52.8	103.2	0	0	0	111.1	S9 T10	S9-H45 WeakPolarHBondContact CA-O 3.23Å; S9-H45 WeakPolarHBondContact CB-O 2.99Å; S9-H45 PolarHBondContact OG-O 3.22Å; T10-H45 PolarHBondContact N-O 3.35Å; T10-H45 WeakPolarHBondContact OG1-CB 3.36Å; T10-H45 PolarHBondContact OG1-ND1 3.16Å
46	P	97.1	Very high	92.5	Very high	14 Å²	14	38.7 Å²	38.7	9%	0.091	20%	0.196	C	C	.	.			trans	-61.7	156.3	177.9	28.6	-36.4	0	0	0	111.7	A6 A48 V49 R75 Q77	A6-P46 WeakPolarHBondContact CB-O 2.97Å; P46-A48 VanDerWaalsContact C-N 3.28Å; P46-A48 PolarHBondContact O-N 2.93Å; P46-V49 HydrophobicContact CG-CG1 3.59Å; P46-R75 HydrophobicContact CG-CB 4.4Å; P46-Q77 HydrophobicContact CB-CB 4.21Å
47	I	96.9	Very high	94	Very high	22 Å²	22	36.6 Å²	36.6	11%	0.113	18%	0.178	C	C	.	.	S	Bend	trans	-65	-29.7	-174.2	-164.1	63	0	0	0	113.4	A6 Q42 L76 I78 L235 L237	A6-I47 PolarHBondContact N-O 2.88Å; Q42-I47 VanDerWaalsContact OE1-N 3.12Å; I47-L76 HydrophobicContact CG2-CD2 3.33Å; I47-L76 WeakPolarHBondContact CG2-O 3.28Å; I47-L76 PolarHBondContact N-O 3.26Å; I47-I78 HydrophobicContact CG2-CG1 4.32Å; I47-L235 HydrophobicContact CD1-CD2 3.67Å; I47-L237 HydrophobicContact CD1-CD1 3.69Å; I47-L237 HydrophobicContact CD1-CG 4.36Å; I47-L237 HydrophobicContact CG1-CD1 4.41Å
48	A	97.4	Very high	94.2	Very high	9 Å²	9	37.3 Å²	37.3	7%	0.074	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	149.6	174.1	0	0	0	0	0	112.8	C3 S4 P46 R75 L76	C3-A48 HydrophobicContact CB-CB 3.61Å; S4-A48 VanDerWaalsContact O-CA 3.29Å; S4-A48 WeakPolarHBondContact O-CA 3.33Å; P46-A48 VanDerWaalsContact C-N 3.28Å; P46-A48 PolarHBondContact O-N 2.93Å; A48-R75 CarbonylContact O-C 3.53Å; A48-R75 WeakPolarHBondContact O-CA 3.38Å; A48-L76 HydrophobicContact CB-CB 4.29Å; A48-L76 PolarHBondContact N-O 3.39Å; A48-L76 PolarHBondContact O-N 2.84Å
49	V	97.7	Very high	93.7	Very high	48 Å²	48	37.1 Å²	37.1	29%	0.291	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	166.5	-178.7	-63	0	0	0	0	111.7	C3 S4 P46 G51 A74 R75	C3-V49 CarbonylContact C-O 3.57Å; C3-V49 WeakPolarHBondContact CA-O 3.21Å; C3-V49 WeakPolarHBondContact CB-O 3.47Å; S4-V49 PolarHBondContact N-O 2.87Å; S4-V49 PolarHBondContact O-N 2.92Å; P46-V49 HydrophobicContact CG-CG1 3.59Å; V49-G51 PolarHBondContact O-N 3.46Å; V49-A74 WeakPolarHBondContact CA-O 3.23Å; V49-R75 HydrophobicContact CG1-CB 4.3Å
50	N	97.2	Very high	92.4	Very high	117 Å²	117	42.4 Å²	42.4	63%	0.626	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	54.9	51.4	168.3	-58.5	-27.7	0	0	0	114.1	I73 A74	N50-I73 CarbonylContact C-O 3.57Å; N50-I73 WeakPolarHBondContact CA-O 3.45Å; N50-I73 PolarHBondContact N-O 2.82Å; N50-A74 PolarHBondContact N-O 3.09Å; N50-A74 VanDerWaalsContact N-O 3.14Å
51	G	97.4	Very high	91.2	Very high	5 Å²	5	49.7 Å²	49.7	5%	0.052	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	-175.9	176.9	0	0	0	0	0	114.4	M1 C3 V49 R72 I73	M1-G51 CarbonylContact O-C 3.12Å; M1-G51 VanDerWaalsContact O-CA 3.25Å; M1-G51 WeakPolarHBondContact O-CA 3.46Å; C3-G51 VanDerWaalsContact SG-CA 3.55Å; V49-G51 PolarHBondContact O-N 3.46Å; G51-R72 WeakPolarHBondContact O-CA 3.32Å; G51-I73 PolarHBondContact N-O 3.29Å; G51-I73 PolarHBondContact O-N 2.77Å
52	N	96.9	Very high	89.8	Confident	55 Å²	55	54.8 Å²	54.8	29%	0.294	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	156.9	168.6	57.3	73.6	0	0	0	111.1	M1 N2 T70 C71	M1-N52 CarbonylContact C-O 3.52Å; M1-N52 VanDerWaalsContact CA-O 3.31Å; M1-N52 WeakPolarHBondContact CA-O 3.34Å; M1-N52 PolarHBondContact O-N 3.1Å; N2-N52 PolarHBondContact ND2-OD1 2.88Å; N52-T70 HydrophobicContact CB-CG2 3.98Å; N52-C71 CarbonylContact C-O 3.59Å; N52-C71 WeakPolarHBondContact CA-O 3.37Å
53	I	95.6	Very high	88.2	Confident	8 Å²	8	58.1 Å²	58.1	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.3	173	-175.4	167.2	0	0	0	109.7	T70 C71 I73 L123 E126 L127	I53-T70 WeakPolarHBondContact O-CA 3.4Å; I53-C71 HydrophobicContact CG2-CB 4.16Å; I53-C71 PolarHBondContact N-O 2.95Å; I53-C71 PolarHBondContact O-N 3.18Å; I53-I73 HydrophobicContact CB-CD1 4.31Å; I53-I73 HydrophobicContact CG2-CD1 4.28Å; I53-I73 HydrophobicContact CG2-CG1 4.4Å; I53-L123 HydrophobicContact CG2-CD1 3.44Å; I53-L123 VanDerWaalsContact CG2-CD1 3.44Å; I53-E126 HydrophobicContact CD1-CB 4.38Å; I53-E126 HydrophobicContact CD1-CG 3.95Å; I53-E126 HydrophobicContact CG1-CG 4.27Å; I53-L127 HydrophobicContact CD1-CD2 3.53Å; I53-L127 HydrophobicContact CD1-CG 3.88Å
54	E	95	Very high	87	Confident	76 Å²	76	58.5 Å²	58.5	36%	0.355	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.8	170.3	-66	178.9	157.9	0	0	109	L68 K69	E54-L68 HydrophobicContact CB-CD1 4.14Å; E54-K69 WeakPolarHBondContact CA-O 3.33Å
55	F	93.5	Very high	86.4	Confident	1 Å²	1	60.3 Å²	60.3	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	151.7	179.1	69.4	-76.4	0	0	0	110.5	V57 K69 C71 I114 E119 C122 L123 E126	F55-V57 HydrophobicContact CD2-CG2 4.38Å; F55-V57 HydrophobicContact CE2-CG2 3.81Å; F55-K69 HydrophobicContact CD1-CB 4.47Å; F55-K69 WeakPolarHBondContact CD1-O 3.18Å; F55-K69 HydrophobicContact CE1-CB 3.83Å; F55-K69 HydrophobicContact CE2-CB 4.37Å; F55-K69 HydrophobicContact CZ-CB 3.77Å; F55-K69 PolarHBondContact N-O 3.32Å; F55-K69 PolarHBondContact O-N 3.31Å; F55-K69 VanDerWaalsContact O-O 3.09Å; F55-C71 HydrophobicContact CD1-CB 4.34Å; F55-C71 HydrophobicContact CE1-CB 3.79Å; F55-I114 HydrophobicContact CE1-CD1 3.96Å; F55-I114 HydrophobicContact CE2-CD1 4.27Å; F55-I114 HydrophobicContact CZ-CD1 3.43Å; F55-I114 VanDerWaalsContact CZ-CD1 3.43Å; F55-E119 HydrophobicContact CE2-CB 4.34Å; F55-E119 WeakPolarHBondContact CE2-O 3.11Å; F55-C122 HydrophobicContact CD2-CB 4.02Å; F55-C122 HydrophobicContact CE2-CB 4.35Å; F55-L123 HydrophobicContact CD1-CB 4.49Å; F55-L123 HydrophobicContact CD1-CD1 3.86Å; F55-L123 HydrophobicContact CD2-CB 4.1Å; F55-L123 HydrophobicContact CE1-CD1 4.21Å; F55-L123 HydrophobicContact CE2-CB 4.09Å; F55-L123 HydrophobicContact CG-CB 4.3Å; F55-L123 HydrophobicContact CG-CD1 4.19Å; F55-L123 HydrophobicContact CZ-CB 4.31Å; F55-E126 HydrophobicContact CB-CB 3.82Å; F55-E126 HydrophobicContact CB-CG 3.94Å
56	Y	91.5	Very high	85.9	Confident	23 Å²	23	56.2 Å²	56.2	9%	0.09	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.1	175.5	-76.3	-92.4	0	0	0	110.4	Y58 P66 L67 L68 C122 R271 E281 C285	Y56-Y58 WeakPolarHBondContact O-CD1 3.43Å; Y56-P66 HydrophobicContact CD1-CB 3.56Å; Y56-P66 HydrophobicContact CE1-CB 4.36Å; Y56-P66 HydrophobicContact CG-CB 4.24Å; Y56-L67 CarbonylContact C-O 3.57Å; Y56-L67 WeakPolarHBondContact CA-O 3.07Å; Y56-L68 HydrophobicContact CD1-CB 4.23Å; Y56-L68 HydrophobicContact CD1-CD1 4.47Å; Y56-L68 HydrophobicContact CD2-CD1 4Å; Y56-L68 HydrophobicContact CE1-CB 3.9Å; Y56-L68 HydrophobicContact CE1-CD1 4.24Å; Y56-L68 HydrophobicContact CE2-CD1 3.67Å; Y56-L68 HydrophobicContact CG-CD1 4.39Å; Y56-C122 WeakPolarHBondContact O-CB 3.41Å; Y56-R271 VanDerWaalsContact CD2-NH1 3.34Å; Y56-E281 HydrophobicContact CE1-CB 4.39Å; Y56-E281 HydrophobicContact CE1-CG 4.44Å; Y56-E281 WeakPolarHBondContact CE1-OE2 3.5Å; Y56-E281 PolarHBondContact OH-OE1 3.32Å; Y56-C285 VanDerWaalsContact CB-SG 3.59Å
57	V	91.1	Very high	85.6	Confident	3 Å²	3	60 Å²	60	2%	0.018	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	114.8	167.3	-171.3	0	0	0	0	107.3	F55 P66 L67 K69 L118 E119	F55-V57 HydrophobicContact CD2-CG2 4.38Å; F55-V57 HydrophobicContact CE2-CG2 3.81Å; V57-P66 CarbonylContact O-C 3.54Å; V57-P66 WeakPolarHBondContact O-CA 3.35Å; V57-L67 HydrophobicContact CB-CB 4.34Å; V57-L67 PolarHBondContact N-O 2.86Å; V57-L67 PolarHBondContact O-N 3.45Å; V57-K69 HydrophobicContact CG2-CB 4.39Å; V57-K69 HydrophobicContact CG2-CD 3.71Å; V57-K69 HydrophobicContact CG2-CG 3.87Å; V57-L118 HydrophobicContact CG1-CD2 3.83Å; V57-L118 HydrophobicContact CG1-CG 3.85Å; V57-E119 HydrophobicContact CG1-CG 4.08Å; V57-E119 HydrophobicContact CG2-CG 3.71Å
58	Y	83	Confident	85.4	Confident	23 Å²	23	62.6 Å²	62.6	9%	0.09	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	132	179.7	66.5	-83.1	0	0	0	111.4	Y56 Y60 K125 C285 I289	Y56-Y58 WeakPolarHBondContact O-CD1 3.43Å; Y58-Y60 HydrophobicContact CD2-CE2 4.45Å; Y58-K125 PolarHBondContact OH-NZ 3.38Å; Y58-C285 HydrophobicContact CD1-CB 4.2Å; Y58-C285 HydrophobicContact CE1-CB 4.3Å; Y58-C285 HydrophobicContact CG-CB 4.39Å; Y58-I289 HydrophobicContact CE1-CD1 4.04Å; Y58-I289 HydrophobicContact CE1-CG2 4.44Å; Y58-I289 WeakPolarHBondContact OH-CG2 3.16Å
59	D	76.1	Confident	85.3	Confident	20 Å²	20	64.2 Å²	64.2	11%	0.107	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	113.9	171.9	-176.4	-28.7	0	0	0	107	Q61 L62 H63 L118 R178	D59-Q61 PolarHBondContact O-N 3Å; D59-Q61 WeakPolarHBondContact OD1-CB 3.23Å; D59-Q61 PolarHBondContact OD1-N 3.32Å; D59-L62 HydrophobicContact CB-CB 4.13Å; D59-L62 PolarHBondContact O-N 2.85Å; D59-L62 VanDerWaalsContact O-N 3.09Å; D59-H63 CarbonylContact O-C 3.55Å; D59-H63 WeakPolarHBondContact O-CA 3.32Å; D59-H63 PolarHBondContact O-N 3.33Å; D59-L118 HydrophobicContact CB-CD1 3.96Å; D59-L118 HydrophobicContact CB-CD2 3.91Å; D59-R178 IonicContact OD2-CZ 3.4Å; D59-R178 VanDerWaalsContact OD2-CZ 3.24Å; D59-R178 IonicContact OD2-NH1 2.66Å; D59-R178 PolarHBondContact OD2-NH1 3.45Å; D59-R178 IonicContact OD2-NH2 2.63Å; D59-R178 PolarHBondContact OD2-NH2 3.18Å
60	Y	65.3	Low	85.3	Confident	121 Å²	121	65.4 Å²	65.4	48%	0.475	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-24.1	-178.1	-64.9	-71.6	0	0	0	114.2	Y58 Q286	Y58-Y60 HydrophobicContact CD2-CE2 4.45Å; Y60-Q286 HydrophobicContact CE1-CG 4.44Å; Y60-Q286 WeakPolarHBondContact OH-CG 3.48Å; Y60-Q286 PolarHBondContact OH-NE2 2.96Å
61	Q	68	Low	85.3	Confident	177 Å²	177	59.8 Å²	59.8	83%	0.827	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-35.5	-179	-61.4	-177.4	-16.2	0	0	112.3	D59	D59-Q61 PolarHBondContact O-N 3Å; D59-Q61 WeakPolarHBondContact OD1-CB 3.23Å; D59-Q61 PolarHBondContact OD1-N 3.32Å
62	L	66.2	Low	85.3	Confident	109 Å²	109	65.1 Å²	65.1	57%	0.571	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-29.1	-171.1	-60.2	177.8	0	0	0	113.7	D59	D59-L62 HydrophobicContact CB-CB 4.13Å; D59-L62 PolarHBondContact O-N 2.85Å; D59-L62 VanDerWaalsContact O-N 3.09Å
63	H	62.9	Low	85.4	Confident	70 Å²	70	62.6 Å²	62.6	32%	0.324	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	81.9	-173	-65.6	60.3	0	0	0	108.5	D59 M65	D59-H63 CarbonylContact O-C 3.55Å; D59-H63 WeakPolarHBondContact O-CA 3.32Å; D59-H63 PolarHBondContact O-N 3.33Å; H63-M65 PolarHBondContact O-N 2.95Å
64	P	68.1	Low	85.5	Confident	108 Å²	108	63 Å²	63	70%	0.701	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.9	-25.4	-177.3	25	-33.7	0	0	0	112.5
65	M	81.7	Confident	85.6	Confident	154 Å²	154	63.7 Å²	63.7	76%	0.759	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.3	169	-56.3	-159.3	-27.1	0	0	110.2	H63	H63-M65 PolarHBondContact O-N 2.95Å
66	P	85.9	Confident	85.8	Confident	17 Å²	17	64.3 Å²	64.3	11%	0.11	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	140.5	172.5	-23.6	34.1	0	0	0	112.1	Y56 V57 E281	Y56-P66 HydrophobicContact CD1-CB 3.56Å; Y56-P66 HydrophobicContact CE1-CB 4.36Å; Y56-P66 HydrophobicContact CG-CB 4.24Å; V57-P66 CarbonylContact O-C 3.54Å; V57-P66 WeakPolarHBondContact O-CA 3.35Å; P66-E281 HydrophobicContact CG-CB 4.42Å
67	L	90.4	Very high	86	Confident	93 Å²	93	64 Å²	64	49%	0.487	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122	174.6	176.5	66.8	0	0	0	109.8	Y56 V57 K69	Y56-L67 CarbonylContact C-O 3.57Å; Y56-L67 WeakPolarHBondContact CA-O 3.07Å; V57-L67 HydrophobicContact CB-CB 4.34Å; V57-L67 PolarHBondContact N-O 2.86Å; V57-L67 PolarHBondContact O-N 3.45Å; L67-K69 HydrophobicContact CD2-CD 4.44Å; L67-K69 HydrophobicContact CD2-CG 4.31Å; L67-K69 HydrophobicContact CG-CG 4.29Å
68	L	93	Very high	86.2	Confident	78 Å²	78	66.7 Å²	66.7	41%	0.408	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	125.7	173.8	-174.9	61.4	0	0	0	110.4	E54 Y56	E54-L68 HydrophobicContact CB-CD1 4.14Å; Y56-L68 HydrophobicContact CD1-CB 4.23Å; Y56-L68 HydrophobicContact CD1-CD1 4.47Å; Y56-L68 HydrophobicContact CD2-CD1 4Å; Y56-L68 HydrophobicContact CE1-CB 3.9Å; Y56-L68 HydrophobicContact CE1-CD1 4.24Å; Y56-L68 HydrophobicContact CE2-CD1 3.67Å; Y56-L68 HydrophobicContact CG-CD1 4.39Å
69	K	95.4	Very high	86.8	Confident	42 Å²	42	67 Å²	67	18%	0.183	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	162.1	170.9	-64.1	-166.2	91.2	-179.7	0	110.3	E54 F55 V57 L67 E119	E54-K69 WeakPolarHBondContact CA-O 3.33Å; F55-K69 HydrophobicContact CD1-CB 4.47Å; F55-K69 WeakPolarHBondContact CD1-O 3.18Å; F55-K69 HydrophobicContact CE1-CB 3.83Å; F55-K69 HydrophobicContact CE2-CB 4.37Å; F55-K69 HydrophobicContact CZ-CB 3.77Å; F55-K69 PolarHBondContact N-O 3.32Å; F55-K69 PolarHBondContact O-N 3.31Å; F55-K69 VanDerWaalsContact O-O 3.09Å; V57-K69 HydrophobicContact CG2-CB 4.39Å; V57-K69 HydrophobicContact CG2-CD 3.71Å; V57-K69 HydrophobicContact CG2-CG 3.87Å; L67-K69 HydrophobicContact CD2-CD 4.44Å; L67-K69 HydrophobicContact CD2-CG 4.31Å; L67-K69 HydrophobicContact CG-CG 4.29Å; K69-E119 HydrophobicContact CD-CG 4.17Å; K69-E119 IonicContact NZ-OE1 3.41Å; K69-E119 PolarHBondContact NZ-OE1 2.8Å; K69-E119 IonicContact NZ-OE2 2.77Å; K69-E119 PolarHBondContact NZ-OE2 2.69Å
70	T	97	Very high	87.6	Confident	73 Å²	73	69 Å²	69	45%	0.448	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135.4	175.1	-56.8	0	0	0	0	109	N52 I53	N52-T70 HydrophobicContact CB-CG2 3.98Å; I53-T70 WeakPolarHBondContact O-CA 3.4Å
71	C	97.8	Very high	88.9	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129	172.2	179.1	0	0	0	0	108.8	N52 I53 F55 I114 L123	N52-C71 CarbonylContact C-O 3.59Å; N52-C71 WeakPolarHBondContact CA-O 3.37Å; I53-C71 HydrophobicContact CG2-CB 4.16Å; I53-C71 PolarHBondContact N-O 2.95Å; I53-C71 PolarHBondContact O-N 3.18Å; F55-C71 HydrophobicContact CD1-CB 4.34Å; F55-C71 HydrophobicContact CE1-CB 3.79Å; C71-I114 HydrophobicContact CB-CD1 4.21Å; C71-L123 HydrophobicContact CB-CD1 3.98Å; C71-L123 HydrophobicContact CB-CD2 4.15Å
72	R	98.1	Very high	89.9	Confident	116 Å²	116	56.3 Å²	56.3	44%	0.438	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	144.7	175.6	-61.8	171.9	-65.5	154.2	3	110	G51 E111 D113	G51-R72 WeakPolarHBondContact O-CA 3.32Å; R72-E111 HydrophobicContact CB-CB 3.88Å; R72-E111 HydrophobicContact CB-CG 3.63Å; R72-E111 PolarHBondContact O-N 3.48Å; R72-D113 VanDerWaalsContact CB-OD2 3.25Å; R72-D113 WeakPolarHBondContact CB-OD2 3.24Å; R72-D113 VanDerWaalsContact CG-OD2 3.27Å; R72-D113 WeakPolarHBondContact CG-OD2 3.14Å; R72-D113 IonicContact CZ-OD1 3.66Å; R72-D113 IonicContact CZ-OD2 3.22Å; R72-D113 PolarHBondContact N-OD2 2.82Å; R72-D113 IonicContact NE-OD1 3.19Å; R72-D113 PolarHBondContact NE-OD1 2.73Å; R72-D113 IonicContact NE-OD2 2.98Å; R72-D113 PolarHBondContact NE-OD2 3.42Å; R72-D113 IonicContact NH2-OD1 2.74Å; R72-D113 PolarHBondContact NH2-OD1 2.63Å; R72-D113 IonicContact NH2-OD2 2.87Å
73	I	97.9	Very high	91	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.2	175.9	-61.8	170.5	0	0	0	106.8	M1 N50 G51 I53 I108	M1-I73 HydrophobicContact CB-CD1 3.58Å; M1-I73 HydrophobicContact CG-CD1 3.53Å; M1-I73 HydrophobicContact SD-CD1 3.76Å; N50-I73 CarbonylContact C-O 3.57Å; N50-I73 WeakPolarHBondContact CA-O 3.45Å; N50-I73 PolarHBondContact N-O 2.82Å; G51-I73 PolarHBondContact N-O 3.29Å; G51-I73 PolarHBondContact O-N 2.77Å; I53-I73 HydrophobicContact CB-CD1 4.31Å; I53-I73 HydrophobicContact CG2-CD1 4.28Å; I53-I73 HydrophobicContact CG2-CG1 4.4Å; I73-I108 HydrophobicContact CG2-CG2 4.12Å
74	A	97.4	Very high	92.2	Very high	18 Å²	18	52.8 Å²	52.8	15%	0.149	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	-51.9	-180	0	0	0	0	0	110.3	V49 N50 V109 E111	V49-A74 WeakPolarHBondContact CA-O 3.23Å; N50-A74 PolarHBondContact N-O 3.09Å; N50-A74 VanDerWaalsContact N-O 3.14Å; A74-V109 HydrophobicContact CB-CG1 4.44Å; A74-V109 PolarHBondContact N-O 3.07Å; A74-E111 HydrophobicContact CB-CG 4.28Å; A74-E111 WeakPolarHBondContact CB-OE1 3.25Å
75	R	97.3	Very high	93.2	Very high	90 Å²	90	49.7 Å²	49.7	34%	0.34	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	158.8	-177.7	64	-176	71.4	-169.1	-0.6	112.5	P46 A48 V49 V109	P46-R75 HydrophobicContact CG-CB 4.4Å; A48-R75 CarbonylContact O-C 3.53Å; A48-R75 WeakPolarHBondContact O-CA 3.38Å; V49-R75 HydrophobicContact CG1-CB 4.3Å; R75-V109 HydrophobicContact CG-CB 3.86Å; R75-V109 HydrophobicContact CG-CG2 3.98Å; R75-V109 PolarHBondContact N-O 2.94Å; R75-V109 PolarHBondContact O-N 3.17Å
76	L	97.3	Very high	93.6	Very high	14 Å²	14	45.5 Å²	45.5	7%	0.073	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.3	168.5	-172.2	160.6	0	0	0	107.2	M1 I47 A48 M106 E107 I108	M1-L76 HydrophobicContact CE-CD1 3.3Å; M1-L76 HydrophobicContact SD-CD1 4.2Å; I47-L76 HydrophobicContact CG2-CD2 3.33Å; I47-L76 WeakPolarHBondContact CG2-O 3.28Å; I47-L76 PolarHBondContact N-O 3.26Å; A48-L76 HydrophobicContact CB-CB 4.29Å; A48-L76 PolarHBondContact N-O 3.39Å; A48-L76 PolarHBondContact O-N 2.84Å; L76-M106 HydrophobicContact CD1-CG 4.27Å; L76-M106 HydrophobicContact CD1-SD 3.71Å; L76-M106 HydrophobicContact CD2-CE 4.2Å; L76-M106 HydrophobicContact CD2-CG 3.69Å; L76-M106 HydrophobicContact CD2-SD 3.95Å; L76-M106 HydrophobicContact CG-CG 3.83Å; L76-M106 HydrophobicContact CG-SD 3.97Å; L76-E107 WeakPolarHBondContact CA-O 3.46Å; L76-I108 HydrophobicContact CD1-CG1 4.3Å; L76-I108 HydrophobicContact CG-CG1 4.27Å
77	Q	96.5	Very high	93.7	Very high	15 Å²	15	49.8 Å²	49.8	7%	0.07	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.8	-176.8	60.9	-166.9	42.5	0	0	111.7	Q42 P46 M106 E107	Q42-Q77 HydrophobicContact CB-CB 4.08Å; Q42-Q77 PolarHBondContact O-OE1 3.02Å; Q42-Q77 VanDerWaalsContact O-OE1 3.13Å; P46-Q77 HydrophobicContact CB-CB 4.21Å; Q77-M106 WeakPolarHBondContact O-CA 3.22Å; Q77-E107 HydrophobicContact CG-CB 3.73Å; Q77-E107 HydrophobicContact CG-CG 4.37Å; Q77-E107 PolarHBondContact N-O 3.4Å; Q77-E107 PolarHBondContact NE2-OE2 2.72Å; Q77-E107 PolarHBondContact O-N 2.94Å
78	I	95.9	Very high	93.5	Very high	60 Å²	60	47.7 Å²	47.7	31%	0.308	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.4	176.6	-57.6	172.5	0	0	0	108.7	F11 T41 Q42 I47 L105	F11-I78 HydrophobicContact CE1-CB 4.4Å; F11-I78 HydrophobicContact CE1-CG2 4.38Å; T41-I78 CarbonylContact C-O 3.53Å; T41-I78 WeakPolarHBondContact CA-O 3.23Å; Q42-I78 PolarHBondContact N-O 3.09Å; Q42-I78 VanDerWaalsContact OE1-N 3.09Å; I47-I78 HydrophobicContact CG2-CG1 4.32Å; I78-L105 WeakPolarHBondContact CA-O 3.21Å
79	E	94.4	Very high	93	Very high	29 Å²	29	52.4 Å²	52.4	14%	0.136	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	169.9	177.2	68.9	177.7	-173	0	0	112.6	Q39 I40 L105	Q39-E79 PolarHBondContact NE2-OE2 3.31Å; Q39-E79 VanDerWaalsContact NE2-OE2 3.15Å; I40-E79 WeakPolarHBondContact O-CA 3.44Å; E79-L105 HydrophobicContact CG-CB 3.7Å; E79-L105 HydrophobicContact CG-CD1 4.23Å; E79-L105 PolarHBondContact N-O 3.36Å; E79-L105 PolarHBondContact O-N 3.46Å
80	Q	92.6	Very high	92.5	Very high	62 Å²	62	59.8 Å²	59.8	29%	0.29	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	138.2	173.6	-68.7	177.4	-26.7	0	0	111.2	Q39 I40	Q39-Q80 HydrophobicContact CG-CB 4.47Å; Q39-Q80 WeakPolarHBondContact CG-O 3.35Å; Q39-Q80 PolarHBondContact NE2-O 3.03Å; I40-Q80 HydrophobicContact CB-CG 4.13Å; I40-Q80 PolarHBondContact O-N 2.98Å
81	D	92.1	Very high	91.9	Very high	8 Å²	8	58.1 Å²	58.1	4%	0.043	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-74.6	156	168.8	-153.4	-2.3	0	0	0	111.4	R100 G102 V103 L105 R147	D81-R100 HydrophobicContact CB-CG 4.32Å; D81-R100 IonicContact OD1-NE 3.42Å; D81-R100 WeakPolarHBondContact OD2-CD 3.47Å; D81-R100 WeakPolarHBondContact OD2-CG 3.36Å; D81-R100 IonicContact OD2-CZ 2.98Å; D81-R100 IonicContact OD2-NE 2.77Å; D81-R100 PolarHBondContact OD2-NE 3.3Å; D81-G102 PolarHBondContact O-N 3.46Å; D81-V103 HydrophobicContact CB-CB 4.28Å; D81-V103 PolarHBondContact N-O 3.02Å; D81-L105 HydrophobicContact CB-CD1 3.63Å; D81-L105 HydrophobicContact CB-CD2 4.22Å; D81-L105 HydrophobicContact CB-CG 3.8Å; D81-R147 IonicContact OD1-CZ 2.88Å; D81-R147 IonicContact OD1-NH1 2.82Å; D81-R147 PolarHBondContact OD1-NH1 3.23Å; D81-R147 IonicContact OD1-NH2 3.38Å; D81-R147 IonicContact OD2-CZ 2.58Å; D81-R147 IonicContact OD2-NH1 3.34Å; D81-R147 PolarHBondContact OD2-NH1 3.43Å; D81-R147 IonicContact OD2-NH2 3.88Å; D81-R147 PolarHBondContact OD2-NH2 3.37Å
82	T	89.5	Confident	91.4	Very high	24 Å²	24	61.6 Å²	61.6	15%	0.147	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-87.6	162.5	174.8	54.9	0	0	0	0	110.4	Y16 Q21 R100	Y16-T82 WeakPolarHBondContact OH-CG2 3.48Å; Q21-T82 HydrophobicContact CB-CG2 4.33Å; T82-R100 PolarHBondContact O-NE 2.9Å; T82-R100 PolarHBondContact O-NH2 2.93Å
83	G	89.3	Confident	91	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.338	C	S	.	.			trans	-62.9	-173.9	165.1	0	0	0	0	0	112.6	D20 D97 R100	D20-G83 WeakPolarHBondContact O-CA 3.49Å; D20-G83 PolarHBondContact O-N 2.92Å; G83-D97 CarbonylContact C-O 3.22Å; G83-D97 WeakPolarHBondContact CA-O 3.14Å; G83-R100 PolarHBondContact O-NH2 2.88Å
84	K	89.5	Confident	90.4	Very high	105 Å²	105	68.5 Å²	68.5	46%	0.457	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.6	177.1	-174.7	-174.8	-174.7	-169.7	0	109.6	L86 D97	K84-L86 HydrophobicContact CD-CD2 3.96Å; K84-L86 HydrophobicContact CD-CG 4.45Å; K84-L86 VanDerWaalsContact CE-CD2 3.47Å; K84-L86 HydrophobicContact CG-CD2 4.23Å; K84-L86 HydrophobicContact CG-CG 4.46Å; K84-D97 HydrophobicContact CB-CB 4.29Å; K84-D97 PolarHBondContact N-O 3.17Å; K84-D97 PolarHBondContact O-N 3.1Å
85	T	88.9	Confident	90.1	Very high	43 Å²	43	71.8 Å²	71.8	26%	0.264	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.3	171.5	-59.9	0	0	0	0	109.8	D20 V94 I96	D20-T85 WeakPolarHBondContact CB-OG1 3.35Å; D20-T85 PolarHBondContact OD2-OG1 3.43Å; T85-V94 HydrophobicContact CG2-CG1 3.41Å; T85-V94 VanDerWaalsContact CG2-CG1 3.41Å; T85-I96 HydrophobicContact CG2-CD1 3.95Å
86	L	89.2	Confident	89.7	Confident	67 Å²	67	70.6 Å²	70.6	35%	0.351	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.8	176.5	-62.3	172.7	0	0	0	108.8	K84 V94 L95	K84-L86 HydrophobicContact CD-CD2 3.96Å; K84-L86 HydrophobicContact CD-CG 4.45Å; K84-L86 VanDerWaalsContact CE-CD2 3.47Å; K84-L86 HydrophobicContact CG-CD2 4.23Å; K84-L86 HydrophobicContact CG-CG 4.46Å; L86-V94 WeakPolarHBondContact O-CA 3.11Å; L86-L95 HydrophobicContact CB-CB 4.15Å; L86-L95 PolarHBondContact N-O 3.48Å; L86-L95 PolarHBondContact O-N 3.3Å
87	T	87.3	Confident	89.4	Confident	106 Å²	106	72.6 Å²	72.6	65%	0.65	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	125.3	175.1	-53.2	0	0	0	0	108.8	E89	T87-E89 HydrophobicContact CG2-CG 4.37Å
88	D	87.2	Confident	89.1	Confident	50 Å²	50	74.8 Å²	74.8	27%	0.267	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	94.2	169.9	173.7	16.9	0	0	0	107.8	E90 G91 G92 R93 L95	D88-E90 VanDerWaalsContact C-N 3.31Å; D88-E90 PolarHBondContact O-N 3.43Å; D88-E90 PolarHBondContact OD1-N 2.93Å; D88-G91 PolarHBondContact O-N 3.21Å; D88-G91 PolarHBondContact OD1-N 3.12Å; D88-G91 VanDerWaalsContact OD1-N 3.13Å; D88-G91 WeakPolarHBondContact OD2-CA 3.36Å; D88-G92 PolarHBondContact O-N 3.07Å; D88-R93 HydrophobicContact CB-CB 4.37Å; D88-R93 PolarHBondContact N-O 2.9Å; D88-R93 PolarHBondContact O-N 3.25Å; D88-L95 HydrophobicContact CB-CD1 4.07Å; D88-L95 HydrophobicContact CB-CG 4.15Å
89	E	82.9	Confident	88.8	Confident	176 Å²	176	78.9 Å²	78.9	82%	0.822	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-36	-176.9	-66.6	-175	178.4	0	0	112	T87	T87-E89 HydrophobicContact CG2-CG 4.37Å
90	E	84	Confident	88.6	Confident	198 Å²	198	81.6 Å²	81.6	93%	0.925	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-40.4	-179.5	-66.6	-178.2	-179.3	0	0	111.5	D88	D88-E90 VanDerWaalsContact C-N 3.31Å; D88-E90 PolarHBondContact O-N 3.43Å; D88-E90 PolarHBondContact OD1-N 2.93Å
91	G	84.2	Confident	88.4	Confident	37 Å²	37	80.5 Å²	80.5	38%	0.381	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-12.1	179.9	0	0	0	0	0	115	D88 R93	D88-G91 PolarHBondContact O-N 3.21Å; D88-G91 PolarHBondContact OD1-N 3.12Å; D88-G91 VanDerWaalsContact OD1-N 3.13Å; D88-G91 WeakPolarHBondContact OD2-CA 3.36Å; G91-R93 PolarHBondContact O-N 3.47Å
92	G	88.1	Confident	88.1	Confident	73 Å²	73	82.1 Å²	82.1	75%	0.753	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	28.7	-171.3	0	0	0	0	0	112.9	D88	D88-G92 PolarHBondContact O-N 3.07Å
93	R	90.2	Very high	88.2	Confident	174 Å²	174	84.6 Å²	84.6	66%	0.657	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	158.4	-173.7	-68.8	171.4	-166.3	-172.3	3.6	111.1	D88 G91	D88-R93 HydrophobicContact CB-CB 4.37Å; D88-R93 PolarHBondContact N-O 2.9Å; D88-R93 PolarHBondContact O-N 3.25Å; G91-R93 PolarHBondContact O-N 3.47Å
94	V	85.6	Confident	88.4	Confident	89 Å²	89	87.5 Å²	87.5	54%	0.539	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.2	168.2	-179.7	0	0	0	0	107.7	T85 L86 I96	T85-V94 HydrophobicContact CG2-CG1 3.41Å; T85-V94 VanDerWaalsContact CG2-CG1 3.41Å; L86-V94 WeakPolarHBondContact O-CA 3.11Å; V94-I96 HydrophobicContact CG1-CD1 3.78Å
95	L	90.5	Very high	88.6	Confident	87 Å²	87	84.7 Å²	84.7	46%	0.455	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132.5	177.3	-53	176.1	0	0	0	108.5	L86 D88	L86-L95 HydrophobicContact CB-CB 4.15Å; L86-L95 PolarHBondContact N-O 3.48Å; L86-L95 PolarHBondContact O-N 3.3Å; D88-L95 HydrophobicContact CB-CD1 4.07Å; D88-L95 HydrophobicContact CB-CG 4.15Å
96	I	89.4	Confident	89	Confident	65 Å²	65	87 Å²	87	33%	0.333	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	121.3	-178.4	-53.9	-60.1	0	0	0	109.3	A19 T85 V94 L98	A19-I96 HydrophobicContact CB-CD1 3.52Å; A19-I96 HydrophobicContact CB-CG1 3.97Å; T85-I96 HydrophobicContact CG2-CD1 3.95Å; V94-I96 HydrophobicContact CG1-CD1 3.78Å; I96-L98 HydrophobicContact CG2-CD2 3.54Å; I96-L98 HydrophobicContact CG2-CG 4.06Å
97	D	90.3	Very high	89.3	Confident	57 Å²	57	87 Å²	87	31%	0.305	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	113.4	173.7	175.7	3.2	0	0	0	109.6	G83 K84 N99	G83-D97 CarbonylContact C-O 3.22Å; G83-D97 WeakPolarHBondContact CA-O 3.14Å; K84-D97 HydrophobicContact CB-CB 4.29Å; K84-D97 PolarHBondContact N-O 3.17Å; K84-D97 PolarHBondContact O-N 3.1Å; D97-N99 VanDerWaalsContact OD1-CB 3.28Å; D97-N99 WeakPolarHBondContact OD1-CB 3.18Å; D97-N99 VanDerWaalsContact OD1-CG 3.23Å; D97-N99 PolarHBondContact OD1-N 3.16Å; D97-N99 PolarHBondContact OD1-ND2 3.07Å
98	L	89.7	Confident	89.8	Confident	60 Å²	60	84 Å²	84	31%	0.314	47%	0.47	S	S	.	.			trans	-94.3	4.5	-175.9	-61.3	-179.9	0	0	0	114.1	P22 F34 I96 R100 C101	P22-L98 HydrophobicContact CG-CD1 3.81Å; P22-L98 HydrophobicContact CG-CD2 3.54Å; P22-L98 HydrophobicContact CG-CG 4.31Å; F34-L98 HydrophobicContact CD1-CD1 4.33Å; F34-L98 HydrophobicContact CE1-CD1 4.04Å; F34-L98 HydrophobicContact CZ-CD1 4.5Å; I96-L98 HydrophobicContact CG2-CD2 3.54Å; I96-L98 HydrophobicContact CG2-CG 4.06Å; L98-R100 PolarHBondContact O-N 2.83Å; L98-R100 VanDerWaalsContact O-N 3.08Å; L98-C101 HydrophobicContact CB-CB 4.37Å; L98-C101 HydrophobicContact CD2-CB 4.43Å; L98-C101 VanDerWaalsContact O-CB 3.28Å; L98-C101 WeakPolarHBondContact O-CB 3.46Å; L98-C101 PolarHBondContact O-N 2.93Å
99	N	90.9	Very high	90.3	Very high	146 Å²	146	84 Å²	84	78%	0.781	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-25.1	-177.4	-71.9	-48.9	0	0	0	113.9	D97	D97-N99 VanDerWaalsContact OD1-CB 3.28Å; D97-N99 WeakPolarHBondContact OD1-CB 3.18Å; D97-N99 VanDerWaalsContact OD1-CG 3.23Å; D97-N99 PolarHBondContact OD1-N 3.16Å; D97-N99 PolarHBondContact OD1-ND2 3.07Å
100	R	89.8	Confident	91	Very high	86 Å²	86	78.1 Å²	78.1	33%	0.325	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-17.2	178	-169.9	176.6	69.8	176.4	-1.1	113.6	D81 T82 G83 L98 G102 V103	D81-R100 HydrophobicContact CB-CG 4.32Å; D81-R100 IonicContact OD1-NE 3.42Å; D81-R100 WeakPolarHBondContact OD2-CD 3.47Å; D81-R100 WeakPolarHBondContact OD2-CG 3.36Å; D81-R100 IonicContact OD2-CZ 2.98Å; D81-R100 IonicContact OD2-NE 2.77Å; D81-R100 PolarHBondContact OD2-NE 3.3Å; T82-R100 PolarHBondContact O-NE 2.9Å; T82-R100 PolarHBondContact O-NH2 2.93Å; G83-R100 PolarHBondContact O-NH2 2.88Å; L98-R100 PolarHBondContact O-N 2.83Å; L98-R100 VanDerWaalsContact O-N 3.08Å; R100-G102 PolarHBondContact O-N 3.42Å; R100-V103 WeakPolarHBondContact O-CB 3.49Å; R100-V103 VanDerWaalsContact O-CG2 3.23Å; R100-V103 WeakPolarHBondContact O-CG2 3.42Å; R100-V103 PolarHBondContact O-N 3.14Å
101	C	88	Confident	91.6	Very high	40 Å²	40	71.6 Å²	71.6	27%	0.27	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	131.2	-174	-173.1	0	0	0	0	110.7	L98 V103	L98-C101 HydrophobicContact CB-CB 4.37Å; L98-C101 HydrophobicContact CD2-CB 4.43Å; L98-C101 VanDerWaalsContact O-CB 3.28Å; L98-C101 WeakPolarHBondContact O-CB 3.46Å; L98-C101 PolarHBondContact O-N 2.93Å; C101-V103 VanDerWaalsContact C-N 3.34Å
102	G	86.4	Confident	92.1	Very high	41 Å²	41	75.9 Å²	75.9	42%	0.423	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	-0.7	178.1	0	0	0	0	0	115.5	D81 R100 G104	D81-G102 PolarHBondContact O-N 3.46Å; R100-G102 PolarHBondContact O-N 3.42Å; G102-G104 PolarHBondContact O-N 3.24Å
103	V	91.5	Very high	92.5	Very high	77 Å²	77	74.3 Å²	74.3	47%	0.467	40%	0.402	S	S	.	.			trans	-60	134.6	169.4	173.1	0	0	0	0	109.4	D81 R100 C101	D81-V103 HydrophobicContact CB-CB 4.28Å; D81-V103 PolarHBondContact N-O 3.02Å; R100-V103 WeakPolarHBondContact O-CB 3.49Å; R100-V103 VanDerWaalsContact O-CG2 3.23Å; R100-V103 WeakPolarHBondContact O-CG2 3.42Å; R100-V103 PolarHBondContact O-N 3.14Å; C101-V103 VanDerWaalsContact C-N 3.34Å
104	G	92.1	Very high	92.7	Very high	61 Å²	61	68.2 Å²	68.2	63%	0.629	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	130.2	179.4	0	0	0	0	0	112.3	G102	G102-G104 PolarHBondContact O-N 3.24Å
105	L	95.1	Very high	93.1	Very high	46 Å²	46	70.8 Å²	70.8	24%	0.241	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	153.8	174.6	-65.8	179.5	0	0	0	110.9	I78 E79 D81	I78-L105 WeakPolarHBondContact CA-O 3.21Å; E79-L105 HydrophobicContact CG-CB 3.7Å; E79-L105 HydrophobicContact CG-CD1 4.23Å; E79-L105 PolarHBondContact N-O 3.36Å; E79-L105 PolarHBondContact O-N 3.46Å; D81-L105 HydrophobicContact CB-CD1 3.63Å; D81-L105 HydrophobicContact CB-CD2 4.22Å; D81-L105 HydrophobicContact CB-CG 3.8Å
106	M	95.7	Very high	93.3	Very high	90 Å²	90	68.1 Å²	68.1	44%	0.443	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	116.5	168.5	178.9	-176.3	-63.2	0	0	108	L76 Q77 I108 L131	L76-M106 HydrophobicContact CD1-CG 4.27Å; L76-M106 HydrophobicContact CD1-SD 3.71Å; L76-M106 HydrophobicContact CD2-CE 4.2Å; L76-M106 HydrophobicContact CD2-CG 3.69Å; L76-M106 HydrophobicContact CD2-SD 3.95Å; L76-M106 HydrophobicContact CG-CG 3.83Å; L76-M106 HydrophobicContact CG-SD 3.97Å; Q77-M106 WeakPolarHBondContact O-CA 3.22Å; M106-I108 HydrophobicContact CG-CG1 4.08Å; M106-I108 HydrophobicContact SD-CD1 4.14Å; M106-I108 HydrophobicContact SD-CG1 4.19Å; M106-L131 HydrophobicContact SD-CD2 4.3Å
107	E	97	Very high	93.6	Very high	69 Å²	69	65 Å²	65	32%	0.322	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	122.2	172.7	-176.2	-177.6	176.2	0	0	109.1	L76 Q77 V109	L76-E107 WeakPolarHBondContact CA-O 3.46Å; Q77-E107 HydrophobicContact CG-CB 3.73Å; Q77-E107 HydrophobicContact CG-CG 4.37Å; Q77-E107 PolarHBondContact N-O 3.4Å; Q77-E107 PolarHBondContact NE2-OE2 2.72Å; Q77-E107 PolarHBondContact O-N 2.94Å; E107-V109 HydrophobicContact CG-CG2 4.08Å
108	I	97.3	Very high	93.7	Very high	42 Å²	42	62.9 Å²	62.9	22%	0.215	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	113.8	177.9	-57.5	169.8	0	0	0	107.3	M1 I73 L76 M106 L127 L131	M1-I108 HydrophobicContact CE-CD1 4.32Å; M1-I108 HydrophobicContact SD-CD1 3.93Å; M1-I108 HydrophobicContact SD-CG2 4.37Å; I73-I108 HydrophobicContact CG2-CG2 4.12Å; L76-I108 HydrophobicContact CD1-CG1 4.3Å; L76-I108 HydrophobicContact CG-CG1 4.27Å; M106-I108 HydrophobicContact CG-CG1 4.08Å; M106-I108 HydrophobicContact SD-CD1 4.14Å; M106-I108 HydrophobicContact SD-CG1 4.19Å; I108-L127 HydrophobicContact CD1-CD2 4.43Å; I108-L131 HydrophobicContact CD1-CD1 4.44Å; I108-L131 HydrophobicContact CD1-CD2 4.47Å
109	V	97.5	Very high	94	Very high	50 Å²	50	61 Å²	61	30%	0.303	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	121.5	178.8	-174.7	0	0	0	0	109	A74 R75 E107	A74-V109 HydrophobicContact CB-CG1 4.44Å; A74-V109 PolarHBondContact N-O 3.07Å; R75-V109 HydrophobicContact CG-CB 3.86Å; R75-V109 HydrophobicContact CG-CG2 3.98Å; R75-V109 PolarHBondContact N-O 2.94Å; R75-V109 PolarHBondContact O-N 3.17Å; E107-V109 HydrophobicContact CG-CG2 4.08Å
110	T	97.9	Very high	94.2	Very high	53 Å²	53	54.4 Å²	54.4	33%	0.325	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	157.5	176.8	64.2	0	0	0	0	111	L123	T110-L123 HydrophobicContact CG2-CD2 4.1Å
111	E	97	Very high	94.4	Very high	61 Å²	61	51.1 Å²	51.1	29%	0.285	29%	0.294	S	S	.	.			trans	-71.6	169.5	162.3	-67.2	-64	162.3	0	0	110.7	R72 A74 D113	R72-E111 HydrophobicContact CB-CB 3.88Å; R72-E111 HydrophobicContact CB-CG 3.63Å; R72-E111 PolarHBondContact O-N 3.48Å; A74-E111 HydrophobicContact CB-CG 4.28Å; A74-E111 WeakPolarHBondContact CB-OE1 3.25Å; E111-D113 PolarHBondContact O-N 3.48Å
112	H	94.5	Very high	94.6	Very high	127 Å²	127	49.5 Å²	49.5	59%	0.588	28%	0.284	S	S	*	.	S	Bend	trans	-80.1	42.7	-177.7	59.9	64.3	0	0	0	113.5	L162	H112-L162 HydrophobicContact CB-CD1 4.45Å
113	D	95.7	Very high	95	Very high	40 Å²	40	48 Å²	48	21%	0.214	27%	0.266	C	S	.	.			trans	-86.1	-13.2	-174.6	-64.3	-25.1	0	0	0	113.7	R72 E111	R72-D113 VanDerWaalsContact CB-OD2 3.25Å; R72-D113 WeakPolarHBondContact CB-OD2 3.24Å; R72-D113 VanDerWaalsContact CG-OD2 3.27Å; R72-D113 WeakPolarHBondContact CG-OD2 3.14Å; R72-D113 IonicContact CZ-OD1 3.66Å; R72-D113 IonicContact CZ-OD2 3.22Å; R72-D113 PolarHBondContact N-OD2 2.82Å; R72-D113 IonicContact NE-OD1 3.19Å; R72-D113 PolarHBondContact NE-OD1 2.73Å; R72-D113 IonicContact NE-OD2 2.98Å; R72-D113 PolarHBondContact NE-OD2 3.42Å; R72-D113 IonicContact NH2-OD1 2.74Å; R72-D113 PolarHBondContact NH2-OD1 2.63Å; R72-D113 IonicContact NH2-OD2 2.87Å; E111-D113 PolarHBondContact O-N 3.48Å
114	I	95.6	Very high	95.2	Very high	46 Å²	46	44.9 Å²	44.9	24%	0.236	25%	0.247	C	C	.	.			trans	-85.6	132.7	-175	-61.9	-62.9	0	0	0	111.1	F55 C71 E119 A120 L123	F55-I114 HydrophobicContact CE1-CD1 3.96Å; F55-I114 HydrophobicContact CE2-CD1 4.27Å; F55-I114 HydrophobicContact CZ-CD1 3.43Å; F55-I114 VanDerWaalsContact CZ-CD1 3.43Å; C71-I114 HydrophobicContact CB-CD1 4.21Å; I114-E119 HydrophobicContact CD1-CB 4.28Å; I114-E119 HydrophobicContact CG2-CB 3.83Å; I114-A120 HydrophobicContact CG2-CB 3.83Å; I114-L123 HydrophobicContact CD1-CB 4.23Å; I114-L123 HydrophobicContact CD1-CD2 3.78Å; I114-L123 HydrophobicContact CG1-CD2 3.82Å
115	Q	94	Very high	95.1	Very high	143 Å²	143	43.4 Å²	43.4	67%	0.668	22%	0.223	S	C	*	.			trans	-112.7	-12.4	-169.8	-63.5	177.6	-42.4	0	0	114.6	E119	Q115-E119 PolarHBondContact N-OE2 3.39Å
116	S	94.5	Very high	94.9	Very high	31 Å²	31	41.5 Å²	41.5	22%	0.217	21%	0.213	C	C	.	.	S	Bend	trans	-149.5	162.4	-178.6	66.4	0	0	0	0	112.6	L118 E119 A120	S116-L118 PolarHBondContact O-N 2.65Å; S116-E119 PolarHBondContact O-N 2.77Å; S116-E119 WeakPolarHBondContact OG-CG 3.3Å; S116-E119 PolarHBondContact OG-N 2.84Å; S116-A120 PolarHBondContact O-N 3.24Å
117	G	94.8	Very high	94.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-31	173.6	0	0	0	0	0	112.8	S121 D182	G117-S121 WeakPolarHBondContact O-CB 3.4Å; G117-S121 PolarHBondContact O-N 3.34Å; G117-S121 PolarHBondContact O-OG 3.24Å; G117-D182 VanDerWaalsContact CA-OD1 3.28Å; G117-D182 WeakPolarHBondContact CA-OD1 3.14Å; G117-D182 PolarHBondContact N-OD1 3.26Å
118	L	93.3	Very high	94.5	Very high	12 Å²	12	35.7 Å²	35.7	6%	0.063	19%	0.186	C	C	.	.	H	α-helix	trans	-63.2	-50	173.7	175.6	60.3	0	0	0	110.9	V57 D59 S116 A120 S121 C122	V57-L118 HydrophobicContact CG1-CD2 3.83Å; V57-L118 HydrophobicContact CG1-CG 3.85Å; D59-L118 HydrophobicContact CB-CD1 3.96Å; D59-L118 HydrophobicContact CB-CD2 3.91Å; S116-L118 PolarHBondContact O-N 2.65Å; L118-A120 PolarHBondContact O-N 2.88Å; L118-S121 PolarHBondContact O-N 3.46Å; L118-S121 PolarHBondContact O-OG 3.34Å; L118-C122 PolarHBondContact O-N 3.34Å; L118-C122 PolarHBondContact O-SG 2.99Å
119	E	95.4	Very high	94	Very high	19 Å²	19	33.9 Å²	33.9	9%	0.089	18%	0.177	C	C	.	.	H	α-helix	trans	-59	-47	177.1	-75	178.1	-160.8	0	0	111.9	F55 V57 K69 I114 Q115 S116 S121 C122 L123	F55-E119 HydrophobicContact CE2-CB 4.34Å; F55-E119 WeakPolarHBondContact CE2-O 3.11Å; V57-E119 HydrophobicContact CG1-CG 4.08Å; V57-E119 HydrophobicContact CG2-CG 3.71Å; K69-E119 HydrophobicContact CD-CG 4.17Å; K69-E119 IonicContact NZ-OE1 3.41Å; K69-E119 PolarHBondContact NZ-OE1 2.8Å; K69-E119 IonicContact NZ-OE2 2.77Å; K69-E119 PolarHBondContact NZ-OE2 2.69Å; I114-E119 HydrophobicContact CD1-CB 4.28Å; I114-E119 HydrophobicContact CG2-CB 3.83Å; Q115-E119 PolarHBondContact N-OE2 3.39Å; S116-E119 PolarHBondContact O-N 2.77Å; S116-E119 WeakPolarHBondContact OG-CG 3.3Å; S116-E119 PolarHBondContact OG-N 2.84Å; E119-S121 VanDerWaalsContact C-N 3.34Å; E119-S121 PolarHBondContact O-N 2.77Å; E119-C122 PolarHBondContact O-N 2.84Å; E119-C122 VanDerWaalsContact O-N 3.15Å; E119-L123 WeakPolarHBondContact O-CB 3.34Å; E119-L123 PolarHBondContact O-N 3.05Å
120	A	96	Very high	93.7	Very high	9 Å²	9	32 Å²	32	7%	0.074	17%	0.165	C	C	.	.	H	α-helix	trans	-57.3	-47	177.3	0	0	0	0	0	111.7	I114 S116 L118 C122 L123 V124 I177 I181	I114-A120 HydrophobicContact CG2-CB 3.83Å; S116-A120 PolarHBondContact O-N 3.24Å; L118-A120 PolarHBondContact O-N 2.88Å; A120-C122 VanDerWaalsContact C-N 3.3Å; A120-C122 PolarHBondContact O-N 3.29Å; A120-L123 PolarHBondContact O-N 3.28Å; A120-V124 WeakPolarHBondContact O-CG2 3.46Å; A120-V124 PolarHBondContact O-N 2.81Å; A120-I177 HydrophobicContact CB-CG2 3.95Å; A120-I181 HydrophobicContact CB-CD1 3.33Å
121	S	93.1	Very high	93.4	Very high	16 Å²	16	30.2 Å²	30.2	11%	0.112	15%	0.153	C	C	.	.	H	α-helix	trans	-63.6	-36.2	178.5	74.8	0	0	0	0	112.5	G117 L118 E119 K125	G117-S121 WeakPolarHBondContact O-CB 3.4Å; G117-S121 PolarHBondContact O-N 3.34Å; G117-S121 PolarHBondContact O-OG 3.24Å; L118-S121 PolarHBondContact O-N 3.46Å; L118-S121 PolarHBondContact O-OG 3.34Å; E119-S121 VanDerWaalsContact C-N 3.34Å; E119-S121 PolarHBondContact O-N 2.77Å; S121-K125 WeakPolarHBondContact O-CB 3.43Å; S121-K125 PolarHBondContact O-N 3.09Å; S121-K125 VanDerWaalsContact O-N 3.17Å
122	C	92.2	Very high	92.9	Very high	7 Å²	7	28.6 Å²	28.6	5%	0.047	15%	0.146	C	C	.	.	H	α-helix	trans	-71.4	-41.8	177.5	-67.3	0	0	0	0	111.6	F55 Y56 L118 E119 A120 K125 E126	F55-C122 HydrophobicContact CD2-CB 4.02Å; F55-C122 HydrophobicContact CE2-CB 4.35Å; Y56-C122 WeakPolarHBondContact O-CB 3.41Å; L118-C122 PolarHBondContact O-N 3.34Å; L118-C122 PolarHBondContact O-SG 2.99Å; E119-C122 PolarHBondContact O-N 2.84Å; E119-C122 VanDerWaalsContact O-N 3.15Å; A120-C122 VanDerWaalsContact C-N 3.3Å; A120-C122 PolarHBondContact O-N 3.29Å; C122-K125 WeakPolarHBondContact O-CB 3.48Å; C122-K125 PolarHBondContact O-N 3.27Å; C122-E126 PolarHBondContact O-N 3.17Å
123	L	95.2	Very high	92.5	Very high	8 Å²	8	23.4 Å²	23.4	4%	0.042	13%	0.126	C	C	.	.	H	α-helix	trans	-59.3	-50.9	175.1	173.4	66.5	0	0	0	111.5	I53 F55 C71 T110 I114 E119 A120 K125 E126 L127	I53-L123 HydrophobicContact CG2-CD1 3.44Å; I53-L123 VanDerWaalsContact CG2-CD1 3.44Å; F55-L123 HydrophobicContact CD1-CB 4.49Å; F55-L123 HydrophobicContact CD1-CD1 3.86Å; F55-L123 HydrophobicContact CD2-CB 4.1Å; F55-L123 HydrophobicContact CE1-CD1 4.21Å; F55-L123 HydrophobicContact CE2-CB 4.09Å; F55-L123 HydrophobicContact CG-CB 4.3Å; F55-L123 HydrophobicContact CG-CD1 4.19Å; F55-L123 HydrophobicContact CZ-CB 4.31Å; C71-L123 HydrophobicContact CB-CD1 3.98Å; C71-L123 HydrophobicContact CB-CD2 4.15Å; T110-L123 HydrophobicContact CG2-CD2 4.1Å; I114-L123 HydrophobicContact CD1-CB 4.23Å; I114-L123 HydrophobicContact CD1-CD2 3.78Å; I114-L123 HydrophobicContact CG1-CD2 3.82Å; E119-L123 WeakPolarHBondContact O-CB 3.34Å; E119-L123 PolarHBondContact O-N 3.05Å; A120-L123 PolarHBondContact O-N 3.28Å; L123-K125 PolarHBondContact O-N 3.22Å; L123-E126 PolarHBondContact O-N 3.22Å; L123-E126 VanDerWaalsContact O-N 3.1Å; L123-L127 HydrophobicContact CD1-CD1 4.38Å; L123-L127 HydrophobicContact CD1-CG 4.48Å; L123-L127 HydrophobicContact CG-CD1 4.19Å; L123-L127 PolarHBondContact O-N 2.77Å
124	V	94.2	Very high	92.2	Very high	13 Å²	13	24.9 Å²	24.9	8%	0.079	13%	0.133	C	C	.	.	H	α-helix	trans	-59.6	-36	178.9	171.9	0	0	0	0	110.7	A120 L127 Q128 L146 V148 L174 I177	A120-V124 WeakPolarHBondContact O-CG2 3.46Å; A120-V124 PolarHBondContact O-N 2.81Å; V124-L127 PolarHBondContact O-N 3.49Å; V124-Q128 VanDerWaalsContact O-CB 3.3Å; V124-Q128 WeakPolarHBondContact O-CB 3.46Å; V124-Q128 PolarHBondContact O-N 3.46Å; V124-L146 HydrophobicContact CG1-CD2 4.23Å; V124-V148 HydrophobicContact CG1-CG2 3.86Å; V124-V148 HydrophobicContact CG2-CG1 4.22Å; V124-V148 HydrophobicContact CG2-CG2 3.99Å; V124-L174 HydrophobicContact CB-CD2 3.91Å; V124-L174 HydrophobicContact CG1-CD2 3.59Å; V124-I177 HydrophobicContact CB-CD1 4.38Å; V124-I177 HydrophobicContact CG1-CD1 4.11Å; V124-I177 HydrophobicContact CG2-CD1 4.16Å
125	K	89.9	Confident	91.8	Very high	29 Å²	29	25.8 Å²	25.8	13%	0.126	15%	0.153	C	C	.	.	H	α-helix	trans	-68.5	-38.3	176.8	-154	178.5	-174.2	-163.1	0	112.8	Y58 S121 C122 L123 Q128 A129 L174 I289	Y58-K125 PolarHBondContact OH-NZ 3.38Å; S121-K125 WeakPolarHBondContact O-CB 3.43Å; S121-K125 PolarHBondContact O-N 3.09Å; S121-K125 VanDerWaalsContact O-N 3.17Å; C122-K125 WeakPolarHBondContact O-CB 3.48Å; C122-K125 PolarHBondContact O-N 3.27Å; L123-K125 PolarHBondContact O-N 3.22Å; K125-Q128 PolarHBondContact O-N 3.49Å; K125-A129 WeakPolarHBondContact O-CB 3.3Å; K125-A129 PolarHBondContact O-N 2.97Å; K125-L174 HydrophobicContact CB-CD1 4.15Å; K125-L174 HydrophobicContact CD-CD1 3.95Å; K125-L174 HydrophobicContact CG-CD1 3.84Å; K125-I289 HydrophobicContact CB-CG2 4.03Å; K125-I289 HydrophobicContact CD-CG2 3.58Å; K125-I289 WeakPolarHBondContact CE-O 3.22Å; K125-I289 HydrophobicContact CG-CG2 3.5Å; K125-I289 VanDerWaalsContact CG-CG2 3.5Å; K125-I289 PolarHBondContact NZ-O 3.29Å
126	E	91.8	Very high	91.6	Very high	7 Å²	7	22.3 Å²	22.3	3%	0.033	15%	0.145	C	C	.	.	H	α-helix	trans	-66.2	-44	173.6	-168.7	72.4	-173.6	0	0	111	I53 F55 C122 L123 Q128 A129 L130 R271 I289	I53-E126 HydrophobicContact CD1-CB 4.38Å; I53-E126 HydrophobicContact CD1-CG 3.95Å; I53-E126 HydrophobicContact CG1-CG 4.27Å; F55-E126 HydrophobicContact CB-CB 3.82Å; F55-E126 HydrophobicContact CB-CG 3.94Å; C122-E126 PolarHBondContact O-N 3.17Å; L123-E126 PolarHBondContact O-N 3.22Å; L123-E126 VanDerWaalsContact O-N 3.1Å; E126-Q128 PolarHBondContact O-N 2.99Å; E126-A129 PolarHBondContact O-N 2.9Å; E126-L130 WeakPolarHBondContact O-CB 3.49Å; E126-L130 PolarHBondContact O-N 3.28Å; E126-R271 VanDerWaalsContact CD-NH2 3.28Å; E126-R271 IonicContact OE1-CZ 2.73Å; E126-R271 IonicContact OE1-NH1 3.39Å; E126-R271 PolarHBondContact OE1-NH1 3.11Å; E126-R271 IonicContact OE1-NH2 3.03Å; E126-R271 PolarHBondContact OE1-NH2 3.47Å; E126-R271 IonicContact OE2-NH2 2.77Å; E126-R271 PolarHBondContact OE2-NH2 3.36Å; E126-I289 WeakPolarHBondContact OE2-CD1 3.29Å; E126-I289 WeakPolarHBondContact OE2-CG1 3.48Å
127	L	93.6	Very high	91.2	Very high	19 Å²	19	22.2 Å²	22.2	10%	0.099	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-45.8	174.2	-74.9	169	0	0	0	111.5	M1 I53 I108 L123 V124 A129 L130 L131	M1-L127 HydrophobicContact SD-CD2 4.16Å; I53-L127 HydrophobicContact CD1-CD2 3.53Å; I53-L127 HydrophobicContact CD1-CG 3.88Å; I108-L127 HydrophobicContact CD1-CD2 4.43Å; L123-L127 HydrophobicContact CD1-CD1 4.38Å; L123-L127 HydrophobicContact CD1-CG 4.48Å; L123-L127 HydrophobicContact CG-CD1 4.19Å; L123-L127 PolarHBondContact O-N 2.77Å; V124-L127 PolarHBondContact O-N 3.49Å; L127-A129 VanDerWaalsContact C-N 3.35Å; L127-A129 PolarHBondContact O-N 3Å; L127-L130 PolarHBondContact O-N 3.02Å; L127-L131 VanDerWaalsContact O-CG 3.31Å; L127-L131 WeakPolarHBondContact O-CG 3.38Å; L127-L131 PolarHBondContact O-N 2.98Å
128	Q	91	Very high	90.7	Very high	18 Å²	18	28.6 Å²	28.6	8%	0.084	17%	0.174	C	C	.	.	H	α-helix	trans	-56.6	-48.6	174.9	-177.7	-171.4	61.9	0	0	111.1	V124 K125 E126 L130 L131 I132 G139 L146	V124-Q128 VanDerWaalsContact O-CB 3.3Å; V124-Q128 WeakPolarHBondContact O-CB 3.46Å; V124-Q128 PolarHBondContact O-N 3.46Å; K125-Q128 PolarHBondContact O-N 3.49Å; E126-Q128 PolarHBondContact O-N 2.99Å; Q128-L130 VanDerWaalsContact C-N 3.29Å; Q128-L130 PolarHBondContact O-N 3.38Å; Q128-L131 PolarHBondContact O-N 3.26Å; Q128-I132 HydrophobicContact CG-CD1 3.79Å; Q128-I132 WeakPolarHBondContact O-CB 3.27Å; Q128-I132 VanDerWaalsContact O-CG1 3.25Å; Q128-I132 WeakPolarHBondContact O-CG1 3.22Å; Q128-I132 PolarHBondContact O-N 3.4Å; Q128-G139 PolarHBondContact NE2-O 3.01Å; Q128-L146 HydrophobicContact CB-CD2 3.95Å; Q128-L146 HydrophobicContact CG-CD2 4.13Å
129	A	87.2	Confident	90.3	Very high	4 Å²	4	28 Å²	28	3%	0.033	17%	0.171	C	C	.	.	H	α-helix	trans	-62.2	-36.9	178.9	0	0	0	0	0	112.4	K125 E126 L127 A133 P267	K125-A129 WeakPolarHBondContact O-CB 3.3Å; K125-A129 PolarHBondContact O-N 2.97Å; E126-A129 PolarHBondContact O-N 2.9Å; L127-A129 VanDerWaalsContact C-N 3.35Å; L127-A129 PolarHBondContact O-N 3Å; A129-A133 VanDerWaalsContact O-CB 3.31Å; A129-A133 WeakPolarHBondContact O-CB 3.24Å; A129-A133 PolarHBondContact O-N 3.38Å; A129-P267 HydrophobicContact CB-CG 4.04Å
130	L	91.2	Very high	89.6	Confident	10 Å²	10	28.8 Å²	28.8	5%	0.052	17%	0.173	C	C	.	.	H	α-helix	trans	-67	-48.4	176.2	-178	149	0	0	0	111.7	M1 E126 L127 Q128 I132 A133 I134	M1-L130 HydrophobicContact CE-CD2 4.4Å; M1-L130 HydrophobicContact CG-CD1 4.27Å; M1-L130 HydrophobicContact CG-CD2 4.41Å; E126-L130 WeakPolarHBondContact O-CB 3.49Å; E126-L130 PolarHBondContact O-N 3.28Å; L127-L130 PolarHBondContact O-N 3.02Å; Q128-L130 VanDerWaalsContact C-N 3.29Å; Q128-L130 PolarHBondContact O-N 3.38Å; L130-I132 PolarHBondContact O-N 3.32Å; L130-A133 WeakPolarHBondContact O-CB 3.47Å; L130-A133 PolarHBondContact O-N 3.32Å; L130-I134 HydrophobicContact CD2-CD1 3.54Å; L130-I134 HydrophobicContact CG-CD1 4.19Å; L130-I134 WeakPolarHBondContact O-CG1 3.3Å; L130-I134 PolarHBondContact O-N 3.43Å; L130-I134 VanDerWaalsContact O-N 3.07Å
131	L	91.5	Very high	89.3	Confident	15 Å²	15	28.9 Å²	28.9	8%	0.079	17%	0.172	C	C	.	.	H	α-helix	trans	-64.8	-40.2	-179.4	-67.1	171.1	0	0	0	112	M106 I108 L127 Q128 A133 I134 G135 S136 C137 L146	M106-L131 HydrophobicContact SD-CD2 4.3Å; I108-L131 HydrophobicContact CD1-CD1 4.44Å; I108-L131 HydrophobicContact CD1-CD2 4.47Å; L127-L131 VanDerWaalsContact O-CG 3.31Å; L127-L131 WeakPolarHBondContact O-CG 3.38Å; L127-L131 PolarHBondContact O-N 2.98Å; Q128-L131 PolarHBondContact O-N 3.26Å; L131-A133 VanDerWaalsContact C-N 3.34Å; L131-I134 PolarHBondContact O-N 3.33Å; L131-G135 PolarHBondContact O-N 3.33Å; L131-S136 PolarHBondContact O-N 2.96Å; L131-S136 PolarHBondContact O-OG 3.06Å; L131-C137 HydrophobicContact CB-CB 4.33Å; L131-L146 HydrophobicContact CD1-CD1 4.43Å
132	I	86.8	Confident	88.7	Confident	27 Å²	27	34.2 Å²	34.2	14%	0.138	20%	0.195	C	C	.	.	H	α-helix	trans	-63.3	-41.7	173.4	-68.6	169.3	0	0	0	110.7	Q128 L130 I134 G135 C137 H138 V299	Q128-I132 HydrophobicContact CG-CD1 3.79Å; Q128-I132 WeakPolarHBondContact O-CB 3.27Å; Q128-I132 VanDerWaalsContact O-CG1 3.25Å; Q128-I132 WeakPolarHBondContact O-CG1 3.22Å; Q128-I132 PolarHBondContact O-N 3.4Å; L130-I132 PolarHBondContact O-N 3.32Å; I132-I134 VanDerWaalsContact C-N 3.3Å; I132-I134 PolarHBondContact O-N 3.3Å; I132-G135 PolarHBondContact O-N 3.32Å; I132-G135 VanDerWaalsContact O-N 3.14Å; I132-C137 WeakPolarHBondContact CA-O 3.37Å; I132-C137 WeakPolarHBondContact CG1-O 3.35Å; I132-H138 WeakPolarHBondContact CD1-O 3.49Å; I132-V299 HydrophobicContact CG2-CG1 4.37Å; I132-V299 HydrophobicContact CG2-CG2 4.46Å
133	A	85.4	Confident	88.3	Confident	19 Å²	19	41.7 Å²	41.7	16%	0.157	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-40.4	179.4	0	0	0	0	0	112.2	A129 L130 L131 G135 P264 P267	A129-A133 VanDerWaalsContact O-CB 3.31Å; A129-A133 WeakPolarHBondContact O-CB 3.24Å; A129-A133 PolarHBondContact O-N 3.38Å; L130-A133 WeakPolarHBondContact O-CB 3.47Å; L130-A133 PolarHBondContact O-N 3.32Å; L131-A133 VanDerWaalsContact C-N 3.34Å; A133-G135 VanDerWaalsContact C-N 3.28Å; A133-P264 WeakPolarHBondContact O-CG 3.45Å; A133-P267 HydrophobicContact CB-CG 4.36Å
134	I	89.7	Confident	87.8	Confident	70 Å²	70	42.4 Å²	42.4	36%	0.359	23%	0.232	S	C	.	.	H	α-helix	trans	-73.9	-22.4	178.5	-65.2	170	0	0	0	111.4	L130 L131 I132 L266	L130-I134 HydrophobicContact CD2-CD1 3.54Å; L130-I134 HydrophobicContact CG-CD1 4.19Å; L130-I134 WeakPolarHBondContact O-CG1 3.3Å; L130-I134 PolarHBondContact O-N 3.43Å; L130-I134 VanDerWaalsContact O-N 3.07Å; L131-I134 PolarHBondContact O-N 3.33Å; I132-I134 VanDerWaalsContact C-N 3.3Å; I132-I134 PolarHBondContact O-N 3.3Å; I134-L266 HydrophobicContact CD1-CD2 4.07Å; I134-L266 HydrophobicContact CG1-CD2 3.67Å
135	G	87.6	Confident	87.6	Confident	65 Å²	65	45 Å²	45	67%	0.67	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.8	14.5	-178	0	0	0	0	0	113.9	L131 I132 A133	L131-G135 PolarHBondContact O-N 3.33Å; I132-G135 PolarHBondContact O-N 3.32Å; I132-G135 VanDerWaalsContact O-N 3.14Å; A133-G135 VanDerWaalsContact C-N 3.28Å
136	S	88.8	Confident	87.7	Confident	71 Å²	71	44.8 Å²	44.8	50%	0.497	24%	0.243	S	C	.	.	S	Bend	trans	-81.9	-24.6	179.2	60.9	0	0	0	0	113.6	L131	L131-S136 PolarHBondContact O-N 2.96Å; L131-S136 PolarHBondContact O-OG 3.06Å
137	C	86.7	Confident	87.8	Confident	29 Å²	29	50 Å²	50	20%	0.196	26%	0.263	C	S	.	.			trans	-152.8	144.1	179.7	179.7	0	0	0	0	110.4	L131 I132 G139 E145	L131-C137 HydrophobicContact CB-CB 4.33Å; I132-C137 WeakPolarHBondContact CA-O 3.37Å; I132-C137 WeakPolarHBondContact CG1-O 3.35Å; C137-G139 VanDerWaalsContact C-N 3.25Å; C137-G139 PolarHBondContact SG-N 3.39Å; C137-E145 PolarHBondContact SG-O 3.46Å
138	H	83.8	Confident	87.9	Confident	133 Å²	133	50.5 Å²	50.5	62%	0.616	27%	0.266	S	S	*	.			trans	-79.4	-9.8	172.5	-57.6	-63.7	0	0	0	113.2	I132 R140 E145	I132-H138 WeakPolarHBondContact CD1-O 3.49Å; H138-R140 PolarHBondContact O-N 3.22Å; H138-E145 VanDerWaalsContact CB-OE2 3.3Å; H138-E145 WeakPolarHBondContact CB-OE2 3.44Å
139	G	84.4	Confident	88.1	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.01	28%	0.282	C	S	.	.			trans	76	13.5	169.1	0	0	0	0	0	115.2	Q128 C137 M141	Q128-G139 PolarHBondContact NE2-O 3.01Å; C137-G139 VanDerWaalsContact C-N 3.25Å; C137-G139 PolarHBondContact SG-N 3.39Å; G139-M141 PolarHBondContact O-N 2.87Å
140	R	82.6	Confident	88.6	Confident	34 Å²	34	53.6 Å²	53.6	13%	0.128	28%	0.284	C	S	.	.			trans	-78.9	106.7	-174.4	-57.8	175.5	-155.9	-123.1	3.4	111.7	H138 E142 R143 G144 E145 D298	H138-R140 PolarHBondContact O-N 3.22Å; R140-E142 VanDerWaalsContact C-N 3.31Å; R140-E142 PolarHBondContact O-N 3.24Å; R140-R143 HydrophobicContact CB-CB 4.09Å; R140-R143 HydrophobicContact CB-CG 4.21Å; R140-R143 PolarHBondContact O-N 3.41Å; R140-G144 PolarHBondContact O-N 2.99Å; R140-E145 HydrophobicContact CB-CG 4.4Å; R140-E145 VanDerWaalsContact CB-OE2 3.25Å; R140-E145 WeakPolarHBondContact CB-OE2 3.3Å; R140-E145 WeakPolarHBondContact CD-OE1 3.34Å; R140-E145 VanDerWaalsContact CG-OE2 3.31Å; R140-E145 WeakPolarHBondContact CG-OE2 3.27Å; R140-E145 PolarHBondContact N-OE2 3.34Å; R140-E145 IonicContact NE-OE1 3.36Å; R140-E145 IonicContact NE-OE2 3.28Å; R140-E145 PolarHBondContact O-N 3.31Å; R140-D298 IonicContact CZ-OD1 2.91Å; R140-D298 IonicContact NH1-OD1 3.28Å; R140-D298 PolarHBondContact NH1-OD1 3.09Å; R140-D298 IonicContact NH2-OD1 3.52Å; R140-D298 PolarHBondContact NH2-OD1 2.95Å
141	M	88.4	Confident	88.8	Confident	11 Å²	11	57.3 Å²	57.3	5%	0.054	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-65.5	-35.9	177.2	-60.3	-176.5	77.3	0	0	111.8	G139 R143 G144 L146 V148 L171 N172 L174 I177	G139-M141 PolarHBondContact O-N 2.87Å; M141-R143 PolarHBondContact O-N 3.44Å; M141-G144 PolarHBondContact O-N 3.2Å; M141-L146 WeakPolarHBondContact CA-O 3.07Å; M141-L146 HydrophobicContact CG-CB 4.17Å; M141-L146 HydrophobicContact CG-CD2 4.11Å; M141-L146 HydrophobicContact CG-CG 4.31Å; M141-V148 HydrophobicContact CE-CG2 4.21Å; M141-L171 WeakPolarHBondContact CE-O 3.18Å; M141-N172 VanDerWaalsContact CB-O 3.32Å; M141-N172 WeakPolarHBondContact CB-O 3.33Å; M141-L174 HydrophobicContact SD-CD2 4.04Å; M141-L174 HydrophobicContact SD-CG 4.13Å; M141-I177 HydrophobicContact CE-CD1 3.61Å; M141-I177 HydrophobicContact CE-CG1 4.45Å
142	E	81.2	Confident	89.1	Confident	128 Å²	128	57.1 Å²	57.1	60%	0.598	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-69.8	-19.9	-179.2	76.6	-76.6	-176.2	0	0	113.8	R140	R140-E142 VanDerWaalsContact C-N 3.31Å; R140-E142 PolarHBondContact O-N 3.24Å
143	R	83.5	Confident	89.5	Confident	164 Å²	164	57.5 Å²	57.5	62%	0.619	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-97.1	-1.8	172.9	-62.9	-161.9	-179.6	170.5	-7.6	112.9	R140 M141 E145	R140-R143 HydrophobicContact CB-CB 4.09Å; R140-R143 HydrophobicContact CB-CG 4.21Å; R140-R143 PolarHBondContact O-N 3.41Å; M141-R143 PolarHBondContact O-N 3.44Å; R143-E145 VanDerWaalsContact C-N 3.32Å; R143-E145 HydrophobicContact CB-CG 4.12Å
144	G	85.4	Confident	89.9	Confident	23 Å²	23	57.7 Å²	57.7	24%	0.237	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	19.1	-178.3	0	0	0	0	0	114.7	R140 M141 R147	R140-G144 PolarHBondContact O-N 2.99Å; M141-G144 PolarHBondContact O-N 3.2Å; G144-R147 PolarHBondContact O-NE 3.21Å; G144-R147 PolarHBondContact O-NH2 2.96Å
145	E	89.1	Confident	90.1	Very high	67 Å²	67	58.8 Å²	58.8	31%	0.313	31%	0.31	S	S	.	.	S	Bend	trans	-77.2	-27.3	175.7	-61.2	168.5	-172.4	0	0	112.1	C137 H138 R140 R143	C137-E145 PolarHBondContact SG-O 3.46Å; H138-E145 VanDerWaalsContact CB-OE2 3.3Å; H138-E145 WeakPolarHBondContact CB-OE2 3.44Å; R140-E145 HydrophobicContact CB-CG 4.4Å; R140-E145 VanDerWaalsContact CB-OE2 3.25Å; R140-E145 WeakPolarHBondContact CB-OE2 3.3Å; R140-E145 WeakPolarHBondContact CD-OE1 3.34Å; R140-E145 VanDerWaalsContact CG-OE2 3.31Å; R140-E145 WeakPolarHBondContact CG-OE2 3.27Å; R140-E145 PolarHBondContact N-OE2 3.34Å; R140-E145 IonicContact NE-OE1 3.36Å; R140-E145 IonicContact NE-OE2 3.28Å; R140-E145 PolarHBondContact O-N 3.31Å; R143-E145 VanDerWaalsContact C-N 3.32Å; R143-E145 HydrophobicContact CB-CG 4.12Å
146	L	92.1	Very high	90.3	Very high	26 Å²	26	61.3 Å²	61.3	14%	0.136	30%	0.302	C	S	.	.	S	Bend	trans	-126.9	118.1	172.5	179.1	66.3	0	0	0	108.3	V124 Q128 L131 M141	V124-L146 HydrophobicContact CG1-CD2 4.23Å; Q128-L146 HydrophobicContact CB-CD2 3.95Å; Q128-L146 HydrophobicContact CG-CD2 4.13Å; L131-L146 HydrophobicContact CD1-CD1 4.43Å; M141-L146 WeakPolarHBondContact CA-O 3.07Å; M141-L146 HydrophobicContact CG-CB 4.17Å; M141-L146 HydrophobicContact CG-CD2 4.11Å; M141-L146 HydrophobicContact CG-CG 4.31Å
147	R	94.1	Very high	90.3	Very high	117 Å²	117	67.5 Å²	67.5	44%	0.442	32%	0.323	S	S	.	.			trans	-116.8	144.8	-179.2	-56.7	178.3	-163.3	158.9	11.3	109.2	D81 G144	D81-R147 IonicContact OD1-CZ 2.88Å; D81-R147 IonicContact OD1-NH1 2.82Å; D81-R147 PolarHBondContact OD1-NH1 3.23Å; D81-R147 IonicContact OD1-NH2 3.38Å; D81-R147 IonicContact OD2-CZ 2.58Å; D81-R147 IonicContact OD2-NH1 3.34Å; D81-R147 PolarHBondContact OD2-NH1 3.43Å; D81-R147 IonicContact OD2-NH2 3.88Å; D81-R147 PolarHBondContact OD2-NH2 3.37Å; G144-R147 PolarHBondContact O-NE 3.21Å; G144-R147 PolarHBondContact O-NH2 2.96Å
148	V	95.7	Very high	90.5	Very high	29 Å²	29	73.1 Å²	73.1	18%	0.176	35%	0.347	C	S	.	.			trans	-137.3	124.5	-180	-179.7	0	0	0	0	108.6	V124 M141 L171 I177	V124-V148 HydrophobicContact CG1-CG2 3.86Å; V124-V148 HydrophobicContact CG2-CG1 4.22Å; V124-V148 HydrophobicContact CG2-CG2 3.99Å; M141-V148 HydrophobicContact CE-CG2 4.21Å; V148-L171 WeakPolarHBondContact O-CB 3.45Å; V148-I177 HydrophobicContact CB-CD1 4.02Å; V148-I177 HydrophobicContact CG1-CD1 4.08Å; V148-I177 HydrophobicContact CG1-CG1 4.44Å; V148-I177 HydrophobicContact CG2-CD1 4.04Å
149	D	95.5	Very high	90.8	Very high	77 Å²	77	69.3 Å²	69.3	41%	0.412	33%	0.329	S	S	.	.			trans	-106.8	138.5	164	-73.4	-8.3	0	0	0	107.9	V168 K169	D149-V168 WeakPolarHBondContact CA-O 3.32Å; D149-K169 IonicContact OD2-NZ 3.95Å; D149-K169 PolarHBondContact OD2-NZ 2.55Å
150	A	96.7	Very high	90.9	Very high	10 Å²	10	75.2 Å²	75.2	8%	0.083	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	136.1	-177.1	0	0	0	0	0	111	E167 V168 L171 I181	A150-E167 CarbonylContact O-C 3.59Å; A150-E167 WeakPolarHBondContact O-CA 3.5Å; A150-V168 HydrophobicContact CB-CB 4.49Å; A150-V168 PolarHBondContact N-O 2.79Å; A150-V168 PolarHBondContact O-N 3.28Å; A150-L171 HydrophobicContact CB-CD1 3.65Å; A150-I181 HydrophobicContact CB-CD1 3.96Å; A150-I181 HydrophobicContact CB-CG1 3.93Å
151	N	96.6	Very high	91.2	Very high	88 Å²	88	81.1 Å²	81.1	47%	0.471	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	118.1	174.5	-71.8	-83.7	0	0	0	108.9	R165 T166	N151-R165 HydrophobicContact CB-CG 4.16Å; N151-R165 VanDerWaalsContact OD1-CD 3.28Å; N151-R165 WeakPolarHBondContact OD1-CD 3.46Å; N151-R165 PolarHBondContact OD1-NE 2.88Å; N151-T166 WeakPolarHBondContact CA-O 3.11Å
152	V	96.4	Very high	91.2	Very high	11 Å²	11	85.2 Å²	85.2	7%	0.067	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.7	-175.5	-174.1	0	0	0	0	110.2	R165 T166 I181 E184 I185	V152-R165 CarbonylContact O-C 3.6Å; V152-R165 WeakPolarHBondContact O-CA 3.25Å; V152-T166 PolarHBondContact N-O 3.07Å; V152-T166 PolarHBondContact O-N 3.43Å; V152-I181 HydrophobicContact CG2-CG1 4.17Å; V152-I181 HydrophobicContact CG2-CG2 4.31Å; V152-E184 HydrophobicContact CB-CB 4.02Å; V152-E184 HydrophobicContact CG1-CB 3.83Å; V152-E184 HydrophobicContact CG2-CB 4.08Å; V152-I185 HydrophobicContact CG1-CG1 3.91Å
153	S	95.2	Very high	91.7	Very high	35 Å²	35	82.4 Å²	82.4	25%	0.245	40%	0.4	C	S	.	.			trans	-150.3	147.3	170.3	176.7	0	0	0	0	107.3	R163 T164	S153-R163 VanDerWaalsContact OG-C 3.29Å; S153-R163 PolarHBondContact OG-N 2.58Å; S153-R163 PolarHBondContact OG-O 3.38Å; S153-T164 PolarHBondContact OG-O 3.12Å
154	V	95	Very high	92.1	Very high	22 Å²	22	76.7 Å²	76.7	13%	0.133	38%	0.383	C	S	.	.			trans	-122.2	152.4	175.9	-52.6	0	0	0	0	109.6	R163 I185 H188 I189 Y192	V154-R163 WeakPolarHBondContact O-CB 3.19Å; V154-R163 VanDerWaalsContact O-CD 3.28Å; V154-R163 WeakPolarHBondContact O-CD 3.3Å; V154-R163 WeakPolarHBondContact O-CG 3.22Å; V154-I185 HydrophobicContact CG1-CB 4.4Å; V154-I185 HydrophobicContact CG1-CG1 4.35Å; V154-I185 HydrophobicContact CG1-CG2 4.16Å; V154-H188 HydrophobicContact CB-CB 4.34Å; V154-H188 HydrophobicContact CG1-CB 3.92Å; V154-H188 HydrophobicContact CG2-CB 3.48Å; V154-H188 VanDerWaalsContact CG2-CB 3.48Å; V154-I189 HydrophobicContact CG1-CG1 4.43Å; V154-I189 HydrophobicContact CG2-CG1 4.24Å; V154-Y192 HydrophobicContact CG2-CD2 3.67Å; V154-Y192 HydrophobicContact CG2-CE2 3.62Å
155	K	92.8	Very high	92.5	Very high	93 Å²	93	81.3 Å²	81.3	40%	0.404	39%	0.393	S	S	.	.			trans	-145.5	159.7	175.9	63.8	175.2	-176	162.6	0	109.7	E159 T160 E161 L162 R163	K155-E159 HydrophobicContact CB-CB 4.17Å; K155-E159 HydrophobicContact CD-CB 4.37Å; K155-E159 VanDerWaalsContact CD-O 3.3Å; K155-E159 WeakPolarHBondContact CD-O 3.24Å; K155-E159 VanDerWaalsContact CE-O 3.28Å; K155-E159 WeakPolarHBondContact CE-O 3.38Å; K155-E159 PolarHBondContact NZ-O 3.13Å; K155-T160 PolarHBondContact NZ-O 3.32Å; K155-E161 WeakPolarHBondContact CD-O 3.01Å; K155-L162 HydrophobicContact CD-CD2 4.32Å; K155-R163 HydrophobicContact CB-CG 4.44Å
156	K	92	Very high	92.8	Very high	118 Å²	118	78.1 Å²	78.1	51%	0.513	38%	0.378	S	S	.	.			trans	-68.5	154	172.1	-66.4	-177.9	178.6	178.4	0	110	H158 E159	K156-H158 PolarHBondContact O-N 3.36Å; K156-H158 VanDerWaalsContact O-N 3.1Å; K156-E159 HydrophobicContact CB-CG 4.02Å; K156-E159 PolarHBondContact N-OE2 3.03Å; K156-E159 WeakPolarHBondContact O-CB 3.46Å; K156-E159 PolarHBondContact O-N 3.44Å
157	Q	88.8	Confident	92.9	Very high	201 Å²	201	78.9 Å²	78.9	94%	0.939	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.6	-175.3	-171.9	176	0.9	0	0	113.9
158	H	90.5	Very high	93	Very high	148 Å²	148	73.3 Å²	73.3	69%	0.685	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-9.3	178.5	58.7	-94.4	0	0	0	113.9	K156	K156-H158 PolarHBondContact O-N 3.36Å; K156-H158 VanDerWaalsContact O-N 3.1Å
159	E	89.9	Confident	92.9	Very high	53 Å²	53	74 Å²	74	25%	0.248	36%	0.361	C	S	.	.			trans	-81.7	137.1	-179.8	-71.1	171.6	178.4	0	0	110.2	K155 K156 R163	K155-E159 HydrophobicContact CB-CB 4.17Å; K155-E159 HydrophobicContact CD-CB 4.37Å; K155-E159 VanDerWaalsContact CD-O 3.3Å; K155-E159 WeakPolarHBondContact CD-O 3.24Å; K155-E159 VanDerWaalsContact CE-O 3.28Å; K155-E159 WeakPolarHBondContact CE-O 3.38Å; K155-E159 PolarHBondContact NZ-O 3.13Å; K156-E159 HydrophobicContact CB-CG 4.02Å; K156-E159 PolarHBondContact N-OE2 3.03Å; K156-E159 WeakPolarHBondContact O-CB 3.46Å; K156-E159 PolarHBondContact O-N 3.44Å; E159-R163 IonicContact OE1-CZ 3.75Å; E159-R163 IonicContact OE1-NE 3.82Å; E159-R163 IonicContact OE1-NH2 2.63Å; E159-R163 PolarHBondContact OE1-NH2 2.87Å; E159-R163 IonicContact OE2-CZ 2.7Å; E159-R163 VanDerWaalsContact OE2-CZ 3.28Å; E159-R163 IonicContact OE2-NE 3.98Å; E159-R163 PolarHBondContact OE2-NE 2.95Å; E159-R163 IonicContact OE2-NH2 2.99Å; E159-R163 PolarHBondContact OE2-NH2 3.35Å
160	T	87.1	Confident	92.5	Very high	125 Å²	125	74.3 Å²	74.3	77%	0.767	36%	0.363	S	S	*	.			trans	-88.2	-43.1	175.2	47.8	0	0	0	0	111	K155	K155-T160 PolarHBondContact NZ-O 3.32Å
161	E	89.3	Confident	92.3	Very high	158 Å²	158	74 Å²	74	74%	0.738	36%	0.36	S	S	*	.	S	Bend	trans	-74.1	142	-176.2	-61.3	-174.8	171.2	0	0	112.7	K155	K155-E161 WeakPolarHBondContact CD-O 3.01Å
162	L	88.7	Confident	91.9	Very high	97 Å²	97	74.3 Å²	74.3	51%	0.508	36%	0.361	S	S	.	.			trans	-78.2	140.6	171.6	-65.9	174.6	0	0	0	109.5	H112 K155	H112-L162 HydrophobicContact CB-CD1 4.45Å; K155-L162 HydrophobicContact CD-CD2 4.32Å
163	R	92	Very high	91.5	Very high	69 Å²	69	75.3 Å²	75.3	26%	0.26	37%	0.369	S	S	.	.			trans	-87.9	-170.5	175.2	-54.8	-175.4	-179.3	-169.5	-9.7	111	S153 V154 K155 E159 R165 Y192	S153-R163 VanDerWaalsContact OG-C 3.29Å; S153-R163 PolarHBondContact OG-N 2.58Å; S153-R163 PolarHBondContact OG-O 3.38Å; V154-R163 WeakPolarHBondContact O-CB 3.19Å; V154-R163 VanDerWaalsContact O-CD 3.28Å; V154-R163 WeakPolarHBondContact O-CD 3.3Å; V154-R163 WeakPolarHBondContact O-CG 3.22Å; K155-R163 HydrophobicContact CB-CG 4.44Å; E159-R163 IonicContact OE1-CZ 3.75Å; E159-R163 IonicContact OE1-NE 3.82Å; E159-R163 IonicContact OE1-NH2 2.63Å; E159-R163 PolarHBondContact OE1-NH2 2.87Å; E159-R163 IonicContact OE2-CZ 2.7Å; E159-R163 VanDerWaalsContact OE2-CZ 3.28Å; E159-R163 IonicContact OE2-NE 3.98Å; E159-R163 PolarHBondContact OE2-NE 2.95Å; E159-R163 IonicContact OE2-NH2 2.99Å; E159-R163 PolarHBondContact OE2-NH2 3.35Å; R163-R165 PolarHBondContact O-N 2.9Å; R163-Y192 HydrophobicContact CB-CE2 4.39Å; R163-Y192 VanDerWaalsContact CB-OH 3.31Å; R163-Y192 WeakPolarHBondContact CB-OH 3.27Å; R163-Y192 VanDerWaalsContact NH1-CD1 3.34Å
164	T	92	Very high	91.1	Very high	44 Å²	44	75.6 Å²	75.6	27%	0.27	37%	0.367	S	S	.	.			trans	-49.7	135.6	-179.5	-53.5	0	0	0	0	112.7	S153 M198 T199 N200	S153-T164 PolarHBondContact OG-O 3.12Å; T164-M198 HydrophobicContact CG2-CB 4.11Å; T164-M198 WeakPolarHBondContact CG2-O 3.48Å; T164-M198 PolarHBondContact OG1-O 2.81Å; T164-T199 WeakPolarHBondContact CG2-O 3.45Å; T164-N200 HydrophobicContact CG2-CB 4.09Å
165	R	93.5	Very high	90.8	Very high	119 Å²	119	82.5 Å²	82.5	45%	0.449	39%	0.391	S	S	.	.			trans	-91.7	144.1	179.8	-172	179.8	73.4	169.1	5.8	110.9	N151 V152 R163 N200	N151-R165 HydrophobicContact CB-CG 4.16Å; N151-R165 VanDerWaalsContact OD1-CD 3.28Å; N151-R165 WeakPolarHBondContact OD1-CD 3.46Å; N151-R165 PolarHBondContact OD1-NE 2.88Å; V152-R165 CarbonylContact O-C 3.6Å; V152-R165 WeakPolarHBondContact O-CA 3.25Å; R163-R165 PolarHBondContact O-N 2.9Å; R165-N200 PolarHBondContact O-OD1 3Å
166	T	94.3	Very high	90.8	Very high	0 Å²	0	80.6 Å²	80.6	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128	163.1	-62.4	0	0	0	0	108.9	N151 V152 V168 E184 R187 H188 E201 R203	N151-T166 WeakPolarHBondContact CA-O 3.11Å; V152-T166 PolarHBondContact N-O 3.07Å; V152-T166 PolarHBondContact O-N 3.43Å; T166-V168 HydrophobicContact CG2-CG2 4.36Å; T166-E184 HydrophobicContact CG2-CG 4.48Å; T166-R187 PolarHBondContact OG1-NH2 2.95Å; T166-H188 PolarHBondContact OG1-CE1 3.5Å; T166-H188 PolarHBondContact OG1-NE2 3.19Å; T166-E201 WeakPolarHBondContact CA-O 3.45Å; T166-R203 HydrophobicContact CG2-CB 4.27Å; T166-R203 VanDerWaalsContact CG2-CD 3.47Å; T166-R203 HydrophobicContact CG2-CG 3.73Å
167	E	95.3	Very high	90.9	Very high	42 Å²	42	75 Å²	75	20%	0.196	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.1	173.8	-176	-175.8	-172.3	0	0	109	A150 K169 E201 T202 R203	A150-E167 CarbonylContact O-C 3.59Å; A150-E167 WeakPolarHBondContact O-CA 3.5Å; E167-K169 HydrophobicContact CG-CG 4.46Å; E167-K169 VanDerWaalsContact OE1-CE 3.25Å; E167-K169 WeakPolarHBondContact OE1-CE 3.48Å; E167-K169 IonicContact OE1-NZ 3.44Å; E167-K169 PolarHBondContact OE1-NZ 3.04Å; E167-K169 IonicContact OE2-NZ 3.52Å; E167-E201 PolarHBondContact N-O 3.05Å; E167-T202 HydrophobicContact CB-CG2 4.22Å; E167-T202 HydrophobicContact CG-CG2 4.3Å; E167-T202 CarbonylContact O-C 3.52Å; E167-T202 WeakPolarHBondContact O-CA 2.91Å; E167-R203 PolarHBondContact O-N 3.42Å
168	V	95.4	Very high	91.1	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.2	178.5	-168.8	0	0	0	0	110	D149 A150 T166 L171 A180 E184 R203 F205 T212	D149-V168 WeakPolarHBondContact CA-O 3.32Å; A150-V168 HydrophobicContact CB-CB 4.49Å; A150-V168 PolarHBondContact N-O 2.79Å; A150-V168 PolarHBondContact O-N 3.28Å; T166-V168 HydrophobicContact CG2-CG2 4.36Å; V168-L171 HydrophobicContact CG1-CD2 3.96Å; V168-L171 HydrophobicContact CG1-CG 4.48Å; V168-A180 HydrophobicContact CG1-CB 4.1Å; V168-E184 HydrophobicContact CG2-CG 3.54Å; V168-R203 CarbonylContact C-O 3.56Å; V168-R203 WeakPolarHBondContact CA-O 3.32Å; V168-F205 HydrophobicContact CG1-CB 4.41Å; V168-T212 HydrophobicContact CG1-CG2 3.95Å; V168-T212 HydrophobicContact CG2-CG2 4.39Å
169	K	93.2	Very high	91.3	Very high	44 Å²	44	66.2 Å²	66.2	19%	0.191	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	174.5	179.1	-55.9	-160.5	-179.8	-95.5	0	112.3	D149 E167 T202 R203 F205 M215	D149-K169 IonicContact OD2-NZ 3.95Å; D149-K169 PolarHBondContact OD2-NZ 2.55Å; E167-K169 HydrophobicContact CG-CG 4.46Å; E167-K169 VanDerWaalsContact OE1-CE 3.25Å; E167-K169 WeakPolarHBondContact OE1-CE 3.48Å; E167-K169 IonicContact OE1-NZ 3.44Å; E167-K169 PolarHBondContact OE1-NZ 3.04Å; E167-K169 IonicContact OE2-NZ 3.52Å; K169-T202 HydrophobicContact CD-CG2 3.87Å; K169-T202 VanDerWaalsContact CE-CG2 3.43Å; K169-T202 HydrophobicContact CG-CG2 3.87Å; K169-R203 PolarHBondContact N-O 2.9Å; K169-F205 PolarHBondContact O-N 3.34Å; K169-M215 HydrophobicContact CB-CE 4.19Å; K169-M215 HydrophobicContact CD-CE 3.67Å; K169-M215 HydrophobicContact CG-CE 4.01Å
170	N	88.3	Confident	91.6	Very high	84 Å²	84	63.7 Å²	63.7	45%	0.449	30%	0.301	S	S	.	.			trans	65.9	36.6	177.2	-61	-35.8	0	0	0	114.5	N172 S204	N170-N172 PolarHBondContact O-N 3.4Å; N170-N172 VanDerWaalsContact O-N 3.12Å; N170-S204 PolarHBondContact ND2-OG 3.11Å
171	L	92.2	Very high	92.1	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.021	27%	0.269	C	S	.	.			trans	-87.1	72.9	-179.5	-55.2	175.4	0	0	0	112.3	M141 V148 A150 V168 S173 I177 A180 F205	M141-L171 WeakPolarHBondContact CE-O 3.18Å; V148-L171 WeakPolarHBondContact O-CB 3.45Å; A150-L171 HydrophobicContact CB-CD1 3.65Å; V168-L171 HydrophobicContact CG1-CD2 3.96Å; V168-L171 HydrophobicContact CG1-CG 4.48Å; L171-S173 PolarHBondContact O-N 2.91Å; L171-S173 VanDerWaalsContact O-N 3.16Å; L171-I177 HydrophobicContact CB-CG1 3.69Å; L171-I177 HydrophobicContact CD1-CG1 4.1Å; L171-I177 HydrophobicContact CG-CG1 4.42Å; L171-A180 HydrophobicContact CD2-CB 3.49Å; L171-A180 VanDerWaalsContact CD2-CB 3.49Å; L171-F205 HydrophobicContact CD2-CB 3.88Å; L171-F205 HydrophobicContact CD2-CG 4.4Å
172	N	87.5	Confident	92.4	Very high	93 Å²	93	54 Å²	54	50%	0.497	25%	0.25	S	C	.	.			trans	-76.9	2.7	-171.5	-62	-34.7	0	0	0	115.7	M141 N170 F176	M141-N172 VanDerWaalsContact CB-O 3.32Å; M141-N172 WeakPolarHBondContact CB-O 3.33Å; N170-N172 PolarHBondContact O-N 3.4Å; N170-N172 VanDerWaalsContact O-N 3.12Å; N172-F176 HydrophobicContact CB-CD2 4.47Å
173	S	88.1	Confident	92.8	Very high	33 Å²	33	52.3 Å²	52.3	23%	0.231	24%	0.238	C	C	.	.	S	Bend	trans	-153.9	154.6	175.6	76.8	0	0	0	0	112	L171 R175 F176 I177	L171-S173 PolarHBondContact O-N 2.91Å; L171-S173 VanDerWaalsContact O-N 3.16Å; S173-R175 PolarHBondContact O-N 3.26Å; S173-F176 WeakPolarHBondContact O-CA 3.48Å; S173-F176 WeakPolarHBondContact O-CB 3.29Å; S173-F176 PolarHBondContact O-N 2.85Å; S173-F176 VanDerWaalsContact OG-CD1 3.31Å; S173-F176 WeakPolarHBondContact OG-CD1 3.36Å; S173-F176 WeakPolarHBondContact OG-CD2 3.5Å; S173-F176 WeakPolarHBondContact OG-CG 3.3Å; S173-F176 PolarHBondContact OG-N 3.29Å; S173-F176 VanDerWaalsContact OG-N 3.16Å; S173-I177 PolarHBondContact O-N 2.73Å
174	L	88.2	Confident	93	Very high	40 Å²	40	49 Å²	49	21%	0.209	23%	0.226	C	C	.	.	H	α-helix	trans	-54.8	-35.4	174.4	-62.1	177.2	0	0	0	112.8	V124 K125 M141 I177 R178	V124-L174 HydrophobicContact CB-CD2 3.91Å; V124-L174 HydrophobicContact CG1-CD2 3.59Å; K125-L174 HydrophobicContact CB-CD1 4.15Å; K125-L174 HydrophobicContact CD-CD1 3.95Å; K125-L174 HydrophobicContact CG-CD1 3.84Å; M141-L174 HydrophobicContact SD-CD2 4.04Å; M141-L174 HydrophobicContact SD-CG 4.13Å; L174-I177 HydrophobicContact CD2-CD1 4.21Å; L174-R178 PolarHBondContact O-N 2.88Å; L174-R178 VanDerWaalsContact O-N 3.13Å
175	R	88.7	Confident	93.2	Very high	168 Å²	168	48.9 Å²	48.9	63%	0.634	22%	0.223	S	C	*	.	H	α-helix	trans	-66.4	-38.6	175.7	-174.4	-176.8	-177.5	-159.7	0.3	111.5	S173 K179	S173-R175 PolarHBondContact O-N 3.26Å; R175-K179 WeakPolarHBondContact O-CB 3.37Å; R175-K179 WeakPolarHBondContact O-CG 3.39Å; R175-K179 PolarHBondContact O-N 3.39Å; R175-K179 VanDerWaalsContact O-N 3.11Å
176	F	92.8	Very high	93.4	Very high	53 Å²	53	45.8 Å²	45.8	23%	0.232	22%	0.223	C	C	.	.	H	α-helix	trans	-71.3	-41.4	178.5	-62.4	-10.8	0	0	0	110.9	N172 S173 R178 K179 A180 F205 F207	N172-F176 HydrophobicContact CB-CD2 4.47Å; S173-F176 WeakPolarHBondContact O-CA 3.48Å; S173-F176 WeakPolarHBondContact O-CB 3.29Å; S173-F176 PolarHBondContact O-N 2.85Å; S173-F176 VanDerWaalsContact OG-CD1 3.31Å; S173-F176 WeakPolarHBondContact OG-CD1 3.36Å; S173-F176 WeakPolarHBondContact OG-CD2 3.5Å; S173-F176 WeakPolarHBondContact OG-CG 3.3Å; S173-F176 PolarHBondContact OG-N 3.29Å; S173-F176 VanDerWaalsContact OG-N 3.16Å; F176-R178 VanDerWaalsContact C-N 3.34Å; F176-R178 PolarHBondContact O-N 3.47Å; F176-K179 PolarHBondContact O-N 3.37Å; F176-A180 WeakPolarHBondContact O-CB 3.4Å; F176-A180 PolarHBondContact O-N 3.03Å; F176-F205 HydrophobicContact CB-CD1 3.78Å; F176-F205 HydrophobicContact CB-CE1 3.72Å; F176-F205 HydrophobicContact CD1-CD1 4.43Å; F176-F205 AromaticContact CD1-CE1 3.69Å; F176-F205 HydrophobicContact CD1-CE1 3.69Å; F176-F205 HydrophobicContact CD2-CD1 4.38Å; F176-F205 HydrophobicContact CD2-CE1 4.4Å; F176-F205 HydrophobicContact CE1-CE1 4.42Å; F176-F205 AromaticContact CG-CD1 3.97Å; F176-F205 HydrophobicContact CG-CD1 3.97Å; F176-F205 AromaticContact CG-CE1 3.68Å; F176-F205 HydrophobicContact CG-CE1 3.68Å; F176-F207 HydrophobicContact CE1-CB 4.01Å; F176-F207 HydrophobicContact CE2-CB 4.06Å; F176-F207 HydrophobicContact CZ-CB 3.68Å; F176-F207 HydrophobicContact CZ-CG 4.38Å
177	I	93.8	Very high	93.5	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-52.6	-54	172.6	-66.2	166.6	0	0	0	110.3	A120 V124 M141 V148 L171 S173 L174 A180 I181	A120-I177 HydrophobicContact CB-CG2 3.95Å; V124-I177 HydrophobicContact CB-CD1 4.38Å; V124-I177 HydrophobicContact CG1-CD1 4.11Å; V124-I177 HydrophobicContact CG2-CD1 4.16Å; M141-I177 HydrophobicContact CE-CD1 3.61Å; M141-I177 HydrophobicContact CE-CG1 4.45Å; V148-I177 HydrophobicContact CB-CD1 4.02Å; V148-I177 HydrophobicContact CG1-CD1 4.08Å; V148-I177 HydrophobicContact CG1-CG1 4.44Å; V148-I177 HydrophobicContact CG2-CD1 4.04Å; L171-I177 HydrophobicContact CB-CG1 3.69Å; L171-I177 HydrophobicContact CD1-CG1 4.1Å; L171-I177 HydrophobicContact CG-CG1 4.42Å; S173-I177 PolarHBondContact O-N 2.73Å; L174-I177 HydrophobicContact CD2-CD1 4.21Å; I177-A180 PolarHBondContact O-N 3.5Å; I177-I181 HydrophobicContact CG2-CD1 3.72Å; I177-I181 WeakPolarHBondContact O-CG1 3.41Å; I177-I181 PolarHBondContact O-N 3.16Å; I177-I181 VanDerWaalsContact O-N 3.08Å
178	R	93.3	Very high	93.5	Very high	69 Å²	69	46.1 Å²	46.1	26%	0.26	22%	0.223	S	C	.	.	H	α-helix	trans	-57.6	-54.5	-179.3	177.7	169.9	177.9	-178.4	0.3	111.8	D59 L174 F176 A180 I181 D182	D59-R178 IonicContact OD2-CZ 3.4Å; D59-R178 VanDerWaalsContact OD2-CZ 3.24Å; D59-R178 IonicContact OD2-NH1 2.66Å; D59-R178 PolarHBondContact OD2-NH1 3.45Å; D59-R178 IonicContact OD2-NH2 2.63Å; D59-R178 PolarHBondContact OD2-NH2 3.18Å; L174-R178 PolarHBondContact O-N 2.88Å; L174-R178 VanDerWaalsContact O-N 3.13Å; F176-R178 VanDerWaalsContact C-N 3.34Å; F176-R178 PolarHBondContact O-N 3.47Å; R178-A180 PolarHBondContact O-N 3.06Å; R178-I181 PolarHBondContact O-N 3.33Å; R178-D182 WeakPolarHBondContact CG-OD2 3.35Å; R178-D182 IonicContact NE-OD2 3.77Å; R178-D182 WeakPolarHBondContact O-CB 3.04Å; R178-D182 PolarHBondContact O-N 3.14Å
179	K	94	Very high	93.5	Very high	94 Å²	94	49.3 Å²	49.3	41%	0.409	24%	0.239	S	C	.	.	H	α-helix	trans	-59.7	-43.9	-178.7	-78.2	-171.1	164.2	-152.2	0	112.9	R175 F176 F183 F205	R175-K179 WeakPolarHBondContact O-CB 3.37Å; R175-K179 WeakPolarHBondContact O-CG 3.39Å; R175-K179 PolarHBondContact O-N 3.39Å; R175-K179 VanDerWaalsContact O-N 3.11Å; F176-K179 PolarHBondContact O-N 3.37Å; K179-F183 VanDerWaalsContact O-CB 3.24Å; K179-F183 WeakPolarHBondContact O-CB 3.35Å; K179-F183 PolarHBondContact O-N 3.42Å; K179-F205 HydrophobicContact CB-CE2 4.07Å; K179-F205 HydrophobicContact CB-CZ 3.83Å; K179-F205 HydrophobicContact CD-CZ 4.31Å
180	A	96.6	Very high	93.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-67.2	-42	-176.2	0	0	0	0	0	111.9	V168 L171 F176 I177 R178 E184 F205 T212	V168-A180 HydrophobicContact CG1-CB 4.1Å; L171-A180 HydrophobicContact CD2-CB 3.49Å; L171-A180 VanDerWaalsContact CD2-CB 3.49Å; F176-A180 WeakPolarHBondContact O-CB 3.4Å; F176-A180 PolarHBondContact O-N 3.03Å; I177-A180 PolarHBondContact O-N 3.5Å; R178-A180 PolarHBondContact O-N 3.06Å; A180-E184 PolarHBondContact O-N 2.95Å; A180-F205 HydrophobicContact CB-CB 4.09Å; A180-F205 HydrophobicContact CB-CD2 3.39Å; A180-F205 HydrophobicContact CB-CE2 3.94Å; A180-F205 HydrophobicContact CB-CG 3.83Å; A180-T212 HydrophobicContact CB-CG2 4.36Å
181	I	97	Very high	93.9	Very high	16 Å²	16	50.7 Å²	50.7	8%	0.082	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-46.8	176.5	-67.8	170.4	0	0	0	110.4	A120 A150 V152 I177 R178 F183 E184 I185	A120-I181 HydrophobicContact CB-CD1 3.33Å; A150-I181 HydrophobicContact CB-CD1 3.96Å; A150-I181 HydrophobicContact CB-CG1 3.93Å; V152-I181 HydrophobicContact CG2-CG1 4.17Å; V152-I181 HydrophobicContact CG2-CG2 4.31Å; I177-I181 HydrophobicContact CG2-CD1 3.72Å; I177-I181 WeakPolarHBondContact O-CG1 3.41Å; I177-I181 PolarHBondContact O-N 3.16Å; I177-I181 VanDerWaalsContact O-N 3.08Å; R178-I181 PolarHBondContact O-N 3.33Å; I181-F183 VanDerWaalsContact C-N 3.27Å; I181-F183 PolarHBondContact O-N 3.41Å; I181-E184 PolarHBondContact O-N 3.39Å; I181-I185 HydrophobicContact CG2-CD1 3.74Å; I181-I185 HydrophobicContact CG2-CG1 4.33Å; I181-I185 VanDerWaalsContact O-CG1 3.28Å; I181-I185 WeakPolarHBondContact O-CG1 3.19Å; I181-I185 PolarHBondContact O-N 3.39Å
182	D	95.9	Very high	94	Very high	63 Å²	63	52.6 Å²	52.6	34%	0.337	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-38.3	179.1	-65.5	-19.8	0	0	0	111	G117 R178 A186	G117-D182 VanDerWaalsContact CA-OD1 3.28Å; G117-D182 WeakPolarHBondContact CA-OD1 3.14Å; G117-D182 PolarHBondContact N-OD1 3.26Å; R178-D182 WeakPolarHBondContact CG-OD2 3.35Å; R178-D182 IonicContact NE-OD2 3.77Å; R178-D182 WeakPolarHBondContact O-CB 3.04Å; R178-D182 PolarHBondContact O-N 3.14Å; D182-A186 PolarHBondContact O-N 3.46Å; D182-A186 VanDerWaalsContact O-N 3.13Å
183	F	96.9	Very high	94.4	Very high	62 Å²	62	55.8 Å²	55.8	27%	0.272	27%	0.265	S	S	.	.	H	α-helix	trans	-64.2	-47.6	173.5	-179	-90.2	0	0	0	112.4	K179 I181 I185 A186 R187 E211 T212	K179-F183 VanDerWaalsContact O-CB 3.24Å; K179-F183 WeakPolarHBondContact O-CB 3.35Å; K179-F183 PolarHBondContact O-N 3.42Å; I181-F183 VanDerWaalsContact C-N 3.27Å; I181-F183 PolarHBondContact O-N 3.41Å; F183-I185 VanDerWaalsContact C-N 3.34Å; F183-I185 PolarHBondContact O-N 3.15Å; F183-A186 PolarHBondContact O-N 2.78Å; F183-R187 WeakPolarHBondContact O-CB 2.93Å; F183-R187 PolarHBondContact O-N 2.99Å; F183-E211 HydrophobicContact CD2-CB 4.48Å; F183-E211 HydrophobicContact CD2-CG 4.42Å; F183-E211 HydrophobicContact CE1-CB 4.12Å; F183-E211 HydrophobicContact CE2-CB 3.83Å; F183-E211 HydrophobicContact CE2-CG 3.64Å; F183-E211 HydrophobicContact CZ-CB 3.62Å; F183-E211 HydrophobicContact CZ-CG 3.85Å; F183-T212 HydrophobicContact CD1-CG2 3.98Å; F183-T212 WeakPolarHBondContact CD1-OG1 3.4Å; F183-T212 WeakPolarHBondContact CE1-OG1 3.25Å
184	E	96.8	Very high	94.7	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-39.2	177.7	-80.8	-57.6	145.4	0	0	112.8	V152 T166 V168 A180 I181 R187 H188 R203 T212	V152-E184 HydrophobicContact CB-CB 4.02Å; V152-E184 HydrophobicContact CG1-CB 3.83Å; V152-E184 HydrophobicContact CG2-CB 4.08Å; T166-E184 HydrophobicContact CG2-CG 4.48Å; V168-E184 HydrophobicContact CG2-CG 3.54Å; A180-E184 PolarHBondContact O-N 2.95Å; I181-E184 PolarHBondContact O-N 3.39Å; E184-R187 PolarHBondContact O-N 2.87Å; E184-R187 IonicContact OE1-NE 4Å; E184-R187 IonicContact OE1-NH2 3.51Å; E184-R187 IonicContact OE2-CZ 3.87Å; E184-R187 VanDerWaalsContact OE2-CZ 3.28Å; E184-R187 IonicContact OE2-NE 3.83Å; E184-R187 PolarHBondContact OE2-NE 3.39Å; E184-R187 IonicContact OE2-NH2 2.97Å; E184-R187 PolarHBondContact OE2-NH2 3.07Å; E184-H188 WeakPolarHBondContact O-CB 3.41Å; E184-H188 PolarHBondContact O-CD2 2.82Å; E184-H188 PolarHBondContact O-N 3.5Å; E184-H188 IonicContact OE2-CD2 3.89Å; E184-H188 PolarHBondContact OE2-CD2 3.45Å; E184-H188 IonicContact OE2-NE2 3.2Å; E184-H188 PolarHBondContact OE2-NE2 2.82Å; E184-R203 VanDerWaalsContact OE1-CD 3.23Å; E184-R203 WeakPolarHBondContact OE1-CD 3.37Å; E184-R203 IonicContact OE1-NE 3.96Å; E184-R203 PolarHBondContact OE1-NE 2.82Å; E184-T212 HydrophobicContact CG-CG2 4.02Å; E184-T212 WeakPolarHBondContact OE1-CB 3.43Å; E184-T212 WeakPolarHBondContact OE1-CG2 2.95Å; E184-T212 PolarHBondContact OE1-OG1 2.95Å
185	I	96.6	Very high	94.8	Very high	41 Å²	41	58.7 Å²	58.7	21%	0.21	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-50.9	175.2	-70.5	168.2	0	0	0	109.5	V152 V154 I181 F183 R187 H188 I189	V152-I185 HydrophobicContact CG1-CG1 3.91Å; V154-I185 HydrophobicContact CG1-CB 4.4Å; V154-I185 HydrophobicContact CG1-CG1 4.35Å; V154-I185 HydrophobicContact CG1-CG2 4.16Å; I181-I185 HydrophobicContact CG2-CD1 3.74Å; I181-I185 HydrophobicContact CG2-CG1 4.33Å; I181-I185 VanDerWaalsContact O-CG1 3.28Å; I181-I185 WeakPolarHBondContact O-CG1 3.19Å; I181-I185 PolarHBondContact O-N 3.39Å; F183-I185 VanDerWaalsContact C-N 3.34Å; F183-I185 PolarHBondContact O-N 3.15Å; I185-R187 PolarHBondContact O-N 2.89Å; I185-H188 PolarHBondContact O-N 2.86Å; I185-I189 HydrophobicContact CG2-CD1 3.76Å; I185-I189 VanDerWaalsContact O-CG1 3.26Å; I185-I189 WeakPolarHBondContact O-CG1 3.41Å; I185-I189 PolarHBondContact O-N 2.93Å
186	A	96.5	Very high	95	Very high	55 Å²	55	55.2 Å²	55.2	46%	0.455	29%	0.292	S	S	.	.	H	α-helix	trans	-60.3	-45.7	178.8	0	0	0	0	0	112	D182 F183 H188 I189 E190	D182-A186 PolarHBondContact O-N 3.46Å; D182-A186 VanDerWaalsContact O-N 3.13Å; F183-A186 PolarHBondContact O-N 2.78Å; A186-H188 PolarHBondContact O-N 2.86Å; A186-I189 PolarHBondContact O-N 3.34Å; A186-E190 WeakPolarHBondContact O-CB 3.5Å; A186-E190 PolarHBondContact O-N 3.14Å
187	R	96	Very high	94.7	Very high	48 Å²	48	61.8 Å²	61.8	18%	0.181	32%	0.321	C	S	.	.	H	α-helix	trans	-61	-44.5	178.8	-172.4	-171.7	73.6	90.4	-8.1	112.5	T166 F183 E184 I185 C191 M198	T166-R187 PolarHBondContact OG1-NH2 2.95Å; F183-R187 WeakPolarHBondContact O-CB 2.93Å; F183-R187 PolarHBondContact O-N 2.99Å; E184-R187 PolarHBondContact O-N 2.87Å; E184-R187 IonicContact OE1-NE 4Å; E184-R187 IonicContact OE1-NH2 3.51Å; E184-R187 IonicContact OE2-CZ 3.87Å; E184-R187 VanDerWaalsContact OE2-CZ 3.28Å; E184-R187 IonicContact OE2-NE 3.83Å; E184-R187 PolarHBondContact OE2-NE 3.39Å; E184-R187 IonicContact OE2-NH2 2.97Å; E184-R187 PolarHBondContact OE2-NH2 3.07Å; I185-R187 PolarHBondContact O-N 2.89Å; R187-C191 VanDerWaalsContact O-CB 3.3Å; R187-C191 WeakPolarHBondContact O-CB 3.49Å; R187-C191 PolarHBondContact O-N 3.37Å; R187-M198 VanDerWaalsContact NH1-CE 3.27Å
188	H	95.9	Very high	94.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64	-44.2	177.5	-80	-137.7	0	0	0	110.9	V154 T166 E184 I185 A186 C191 Y192 M198	V154-H188 HydrophobicContact CB-CB 4.34Å; V154-H188 HydrophobicContact CG1-CB 3.92Å; V154-H188 HydrophobicContact CG2-CB 3.48Å; V154-H188 VanDerWaalsContact CG2-CB 3.48Å; T166-H188 PolarHBondContact OG1-CE1 3.5Å; T166-H188 PolarHBondContact OG1-NE2 3.19Å; E184-H188 WeakPolarHBondContact O-CB 3.41Å; E184-H188 PolarHBondContact O-CD2 2.82Å; E184-H188 PolarHBondContact O-N 3.5Å; E184-H188 IonicContact OE2-CD2 3.89Å; E184-H188 PolarHBondContact OE2-CD2 3.45Å; E184-H188 IonicContact OE2-NE2 3.2Å; E184-H188 PolarHBondContact OE2-NE2 2.82Å; I185-H188 PolarHBondContact O-N 2.86Å; A186-H188 PolarHBondContact O-N 2.86Å; H188-C191 PolarHBondContact O-N 3.03Å; H188-Y192 HydrophobicContact CB-CD2 4.47Å; H188-Y192 HydrophobicContact CB-CE2 4.24Å; H188-Y192 WeakPolarHBondContact O-CD2 3.24Å; H188-Y192 PolarHBondContact O-N 3.33Å; H188-M198 HydrophobicContact CB-CE 4.48Å; H188-M198 WeakPolarHBondContact CD2-CE 3.2Å; H188-M198 VanDerWaalsContact NE2-CE 3.25Å; H188-M198 WeakPolarHBondContact NE2-CE 2.84Å
189	I	95.3	Very high	94.1	Very high	68 Å²	68	63.4 Å²	63.4	35%	0.349	34%	0.338	S	S	.	.	H	α-helix	trans	-59.9	-52.6	178.1	-69.5	168.1	0	0	0	110.1	V154 I185 A186 C191 Y192 E193	V154-I189 HydrophobicContact CG1-CG1 4.43Å; V154-I189 HydrophobicContact CG2-CG1 4.24Å; I185-I189 HydrophobicContact CG2-CD1 3.76Å; I185-I189 VanDerWaalsContact O-CG1 3.26Å; I185-I189 WeakPolarHBondContact O-CG1 3.41Å; I185-I189 PolarHBondContact O-N 2.93Å; A186-I189 PolarHBondContact O-N 3.34Å; I189-C191 VanDerWaalsContact C-N 3.3Å; I189-C191 PolarHBondContact O-N 2.78Å; I189-Y192 PolarHBondContact O-N 3.4Å; I189-E193 HydrophobicContact CG2-CG 4.14Å; I189-E193 WeakPolarHBondContact O-CB 3.43Å; I189-E193 WeakPolarHBondContact O-CG 3.33Å; I189-E193 PolarHBondContact O-N 3.3Å
190	E	96	Very high	93.8	Very high	133 Å²	133	64.4 Å²	64.4	62%	0.621	35%	0.347	S	S	*	.	H	α-helix	trans	-57.6	-42.6	179.7	-177.4	179.5	-173.3	0	0	112	A186 E193 S194	A186-E190 WeakPolarHBondContact O-CB 3.5Å; A186-E190 PolarHBondContact O-N 3.14Å; E190-E193 PolarHBondContact O-N 3.01Å; E190-S194 VanDerWaalsContact O-CB 3.29Å; E190-S194 WeakPolarHBondContact O-CB 3.22Å; E190-S194 PolarHBondContact O-N 3.01Å; E190-S194 PolarHBondContact O-OG 3.16Å
191	C	94.6	Very high	93.4	Very high	24 Å²	24	66.2 Å²	66.2	16%	0.162	36%	0.356	C	S	.	.	H	α-helix	trans	-60.2	-50.2	176.6	-175.5	0	0	0	0	111.7	R187 H188 I189 S194 G195 N196 M198	R187-C191 VanDerWaalsContact O-CB 3.3Å; R187-C191 WeakPolarHBondContact O-CB 3.49Å; R187-C191 PolarHBondContact O-N 3.37Å; H188-C191 PolarHBondContact O-N 3.03Å; I189-C191 VanDerWaalsContact C-N 3.3Å; I189-C191 PolarHBondContact O-N 2.78Å; C191-S194 PolarHBondContact O-N 2.98Å; C191-G195 PolarHBondContact O-N 3.07Å; C191-N196 WeakPolarHBondContact O-CB 3.39Å; C191-N196 PolarHBondContact O-N 3.21Å; C191-N196 WeakPolarHBondContact SG-CB 3.37Å; C191-M198 HydrophobicContact CB-CG 4.24Å; C191-M198 HydrophobicContact CB-SD 3.57Å; C191-M198 VanDerWaalsContact CB-SD 3.57Å; C191-M198 PolarHBondContact SG-SD 3.48Å
192	Y	94.2	Very high	93.2	Very high	43 Å²	43	66.9 Å²	66.9	17%	0.169	36%	0.361	C	S	.	.	H	α-helix	trans	-68.4	-35.7	179.9	-69.7	-52.6	0	0	0	113.2	V154 R163 H188 I189 S194 G195 M198	V154-Y192 HydrophobicContact CG2-CD2 3.67Å; V154-Y192 HydrophobicContact CG2-CE2 3.62Å; R163-Y192 HydrophobicContact CB-CE2 4.39Å; R163-Y192 VanDerWaalsContact CB-OH 3.31Å; R163-Y192 WeakPolarHBondContact CB-OH 3.27Å; R163-Y192 VanDerWaalsContact NH1-CD1 3.34Å; H188-Y192 HydrophobicContact CB-CD2 4.47Å; H188-Y192 HydrophobicContact CB-CE2 4.24Å; H188-Y192 WeakPolarHBondContact O-CD2 3.24Å; H188-Y192 PolarHBondContact O-N 3.33Å; I189-Y192 PolarHBondContact O-N 3.4Å; Y192-S194 VanDerWaalsContact C-N 3.3Å; Y192-G195 PolarHBondContact O-N 3.12Å; Y192-M198 HydrophobicContact CD1-CG 4.48Å; Y192-M198 HydrophobicContact CE1-CB 4.24Å; Y192-M198 HydrophobicContact CE1-CG 3.82Å; Y192-M198 HydrophobicContact CE2-CG 4.05Å
193	E	94.4	Very high	93.1	Very high	160 Å²	160	65.2 Å²	65.2	75%	0.748	35%	0.35	S	S	*	.	H	α-helix	trans	-70.1	-28.6	176.3	-72.7	-176.6	164.9	0	0	112.2	I189 E190 G195	I189-E193 HydrophobicContact CG2-CG 4.14Å; I189-E193 WeakPolarHBondContact O-CB 3.43Å; I189-E193 WeakPolarHBondContact O-CG 3.33Å; I189-E193 PolarHBondContact O-N 3.3Å; E190-E193 PolarHBondContact O-N 3.01Å; E193-G195 PolarHBondContact O-N 2.91Å
194	S	94.5	Very high	92.9	Very high	78 Å²	78	63.2 Å²	63.2	55%	0.545	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-0.4	172.8	-56.9	0	0	0	0	113.8	E190 C191 Y192 N196	E190-S194 VanDerWaalsContact O-CB 3.29Å; E190-S194 WeakPolarHBondContact O-CB 3.22Å; E190-S194 PolarHBondContact O-N 3.01Å; E190-S194 PolarHBondContact O-OG 3.16Å; C191-S194 PolarHBondContact O-N 2.98Å; Y192-S194 VanDerWaalsContact C-N 3.3Å; S194-N196 VanDerWaalsContact C-N 3.29Å; S194-N196 PolarHBondContact O-N 3.26Å
195	G	91.8	Very high	92.8	Very high	57 Å²	57	63.7 Å²	63.7	59%	0.588	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	12.4	-177.5	0	0	0	0	0	114.5	C191 Y192 E193	C191-G195 PolarHBondContact O-N 3.07Å; Y192-G195 PolarHBondContact O-N 3.12Å; E193-G195 PolarHBondContact O-N 2.91Å
196	N	91.2	Very high	92.6	Very high	94 Å²	94	64.3 Å²	64.3	50%	0.503	35%	0.349	S	S	.	.			trans	-86.6	163.5	176.8	-66.9	-46.9	0	0	0	111.3	C191 S194	C191-N196 WeakPolarHBondContact O-CB 3.39Å; C191-N196 PolarHBondContact O-N 3.21Å; C191-N196 WeakPolarHBondContact SG-CB 3.37Å; S194-N196 VanDerWaalsContact C-N 3.29Å; S194-N196 PolarHBondContact O-N 3.26Å
197	F	86.6	Confident	92.2	Very high	191 Å²	191	67.9 Å²	67.9	84%	0.838	36%	0.355	S	S	*	.			trans	-108.5	144.2	176	-61.1	-83.7	0	0	0	110.6
198	M	88	Confident	91.9	Very high	15 Å²	15	73.7 Å²	73.7	7%	0.074	38%	0.381	C	S	.	.			trans	-93	135.3	177.9	-68.3	-70.3	-68.3	0	0	110.5	T164 R187 H188 C191 Y192	T164-M198 HydrophobicContact CG2-CB 4.11Å; T164-M198 WeakPolarHBondContact CG2-O 3.48Å; T164-M198 PolarHBondContact OG1-O 2.81Å; R187-M198 VanDerWaalsContact NH1-CE 3.27Å; H188-M198 HydrophobicContact CB-CE 4.48Å; H188-M198 WeakPolarHBondContact CD2-CE 3.2Å; H188-M198 VanDerWaalsContact NE2-CE 3.25Å; H188-M198 WeakPolarHBondContact NE2-CE 2.84Å; C191-M198 HydrophobicContact CB-CG 4.24Å; C191-M198 HydrophobicContact CB-SD 3.57Å; C191-M198 VanDerWaalsContact CB-SD 3.57Å; C191-M198 PolarHBondContact SG-SD 3.48Å; Y192-M198 HydrophobicContact CD1-CG 4.48Å; Y192-M198 HydrophobicContact CE1-CB 4.24Å; Y192-M198 HydrophobicContact CE1-CG 3.82Å; Y192-M198 HydrophobicContact CE2-CG 4.05Å
199	T	86.7	Confident	91.7	Very high	90 Å²	90	76.4 Å²	76.4	55%	0.552	40%	0.4	S	S	*	.			trans	-93.4	149.9	169.6	32	0	0	0	0	111.5	T164 E201	T164-T199 WeakPolarHBondContact CG2-O 3.45Å; T199-E201 PolarHBondContact O-N 3.43Å; T199-E201 PolarHBondContact OG1-OE1 3.5Å
200	N	88.1	Confident	91.5	Very high	114 Å²	114	74 Å²	74	61%	0.61	39%	0.393	S	S	*	.			trans	-75.5	112.8	179.9	-157.7	-7.5	0	0	0	107.9	T164 R165	T164-N200 HydrophobicContact CG2-CB 4.09Å; R165-N200 PolarHBondContact O-OD1 3Å
201	E	89.2	Confident	91.4	Very high	38 Å²	38	72.4 Å²	72.4	18%	0.178	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	148.8	-167.8	-76.2	171.9	-153.3	0	0	111.3	T166 E167 T199 R203	T166-E201 WeakPolarHBondContact CA-O 3.45Å; E167-E201 PolarHBondContact N-O 3.05Å; T199-E201 PolarHBondContact O-N 3.43Å; T199-E201 PolarHBondContact OG1-OE1 3.5Å; E201-R203 HydrophobicContact CB-CG 4.23Å; E201-R203 IonicContact OE2-CZ 2.78Å; E201-R203 IonicContact OE2-NH1 3.21Å; E201-R203 PolarHBondContact OE2-NH1 3.17Å
202	T	91.2	Very high	91.4	Very high	30 Å²	30	71.4 Å²	71.4	18%	0.184	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.2	164.3	-47	0	0	0	0	108.8	E167 K169 M215	E167-T202 HydrophobicContact CB-CG2 4.22Å; E167-T202 HydrophobicContact CG-CG2 4.3Å; E167-T202 CarbonylContact O-C 3.52Å; E167-T202 WeakPolarHBondContact O-CA 2.91Å; K169-T202 HydrophobicContact CD-CG2 3.87Å; K169-T202 VanDerWaalsContact CE-CG2 3.43Å; K169-T202 HydrophobicContact CG-CG2 3.87Å; T202-M215 HydrophobicContact CG2-CE 3.24Å; T202-M215 WeakPolarHBondContact O-CB 3.36Å; T202-M215 PolarHBondContact O-N 3.12Å
203	R	94.1	Very high	91.3	Very high	28 Å²	28	72.1 Å²	72.1	11%	0.106	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	155.4	-176.6	-56.9	-177.7	71.2	86.6	-2.4	110.5	T166 E167 V168 K169 E184 E201 T212 V213	T166-R203 HydrophobicContact CG2-CB 4.27Å; T166-R203 VanDerWaalsContact CG2-CD 3.47Å; T166-R203 HydrophobicContact CG2-CG 3.73Å; E167-R203 PolarHBondContact O-N 3.42Å; V168-R203 CarbonylContact C-O 3.56Å; V168-R203 WeakPolarHBondContact CA-O 3.32Å; K169-R203 PolarHBondContact N-O 2.9Å; E184-R203 VanDerWaalsContact OE1-CD 3.23Å; E184-R203 WeakPolarHBondContact OE1-CD 3.37Å; E184-R203 IonicContact OE1-NE 3.96Å; E184-R203 PolarHBondContact OE1-NE 2.82Å; E201-R203 HydrophobicContact CB-CG 4.23Å; E201-R203 IonicContact OE2-CZ 2.78Å; E201-R203 IonicContact OE2-NH1 3.21Å; E201-R203 PolarHBondContact OE2-NH1 3.17Å; R203-T212 PolarHBondContact NE-OG1 3.33Å; R203-T212 VanDerWaalsContact NE-OG1 3.14Å; R203-T212 PolarHBondContact NH2-O 3.24Å; R203-V213 CarbonylContact C-O 3.54Å; R203-V213 VanDerWaalsContact CA-O 3.23Å; R203-V213 WeakPolarHBondContact CA-O 3.48Å; R203-V213 WeakPolarHBondContact CB-O 3.27Å
204	S	93.6	Very high	91.2	Very high	20 Å²	20	68.2 Å²	68.2	14%	0.14	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.7	172.9	179.9	0	0	0	0	109.3	N170 T212 V213	N170-S204 PolarHBondContact ND2-OG 3.11Å; S204-T212 CarbonylContact O-C 3.45Å; S204-T212 WeakPolarHBondContact O-CA 3.23Å; S204-V213 PolarHBondContact N-O 2.76Å; S204-V213 WeakPolarHBondContact O-CG2 3.34Å; S204-V213 PolarHBondContact O-N 3.17Å
205	F	94.2	Very high	90.7	Very high	11 Å²	11	67.2 Å²	67.2	5%	0.048	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	122.5	171.4	-176.2	-109.2	0	0	0	110.9	V168 K169 L171 F176 K179 A180 F207 G210 T212	V168-F205 HydrophobicContact CG1-CB 4.41Å; K169-F205 PolarHBondContact O-N 3.34Å; L171-F205 HydrophobicContact CD2-CB 3.88Å; L171-F205 HydrophobicContact CD2-CG 4.4Å; F176-F205 HydrophobicContact CB-CD1 3.78Å; F176-F205 HydrophobicContact CB-CE1 3.72Å; F176-F205 HydrophobicContact CD1-CD1 4.43Å; F176-F205 AromaticContact CD1-CE1 3.69Å; F176-F205 HydrophobicContact CD1-CE1 3.69Å; F176-F205 HydrophobicContact CD2-CD1 4.38Å; F176-F205 HydrophobicContact CD2-CE1 4.4Å; F176-F205 HydrophobicContact CE1-CE1 4.42Å; F176-F205 AromaticContact CG-CD1 3.97Å; F176-F205 HydrophobicContact CG-CD1 3.97Å; F176-F205 AromaticContact CG-CE1 3.68Å; F176-F205 HydrophobicContact CG-CE1 3.68Å; K179-F205 HydrophobicContact CB-CE2 4.07Å; K179-F205 HydrophobicContact CB-CZ 3.83Å; K179-F205 HydrophobicContact CD-CZ 4.31Å; A180-F205 HydrophobicContact CB-CB 4.09Å; A180-F205 HydrophobicContact CB-CD2 3.39Å; A180-F205 HydrophobicContact CB-CE2 3.94Å; A180-F205 HydrophobicContact CB-CG 3.83Å; F205-F207 HydrophobicContact CE1-CB 4.2Å; F205-G210 WeakPolarHBondContact CE2-O 3.2Å; F205-T212 HydrophobicContact CD2-CG2 4.27Å
206	D	93	Very high	89.6	Confident	53 Å²	53	76.2 Å²	76.2	28%	0.283	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	114	167.5	177.5	17.1	0	0	0	109.6	K208 S209 G210 E211	D206-K208 PolarHBondContact O-N 3.43Å; D206-K208 WeakPolarHBondContact OD1-CB 3.46Å; D206-K208 PolarHBondContact OD1-N 3.16Å; D206-S209 WeakPolarHBondContact CB-OG 3.22Å; D206-S209 PolarHBondContact OD2-N 3Å; D206-S209 PolarHBondContact OD2-OG 3.23Å; D206-G210 VanDerWaalsContact O-CA 3.29Å; D206-G210 WeakPolarHBondContact O-CA 3.29Å; D206-G210 PolarHBondContact O-N 2.97Å; D206-E211 PolarHBondContact N-O 2.88Å; D206-E211 PolarHBondContact O-N 2.83Å
207	F	88	Confident	87.8	Confident	130 Å²	130	76.9 Å²	76.9	57%	0.57	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-20.6	-179.4	72.9	-88.7	0	0	0	113.4	F176 F205	F176-F207 HydrophobicContact CE1-CB 4.01Å; F176-F207 HydrophobicContact CE2-CB 4.06Å; F176-F207 HydrophobicContact CZ-CB 3.68Å; F176-F207 HydrophobicContact CZ-CG 4.38Å; F205-F207 HydrophobicContact CE1-CB 4.2Å
208	K	90.3	Very high	86.2	Confident	171 Å²	171	73.1 Å²	73.1	74%	0.743	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-53.2	-179.1	-67.5	-177.4	-179.5	176	0	110.8	D206 G210	D206-K208 PolarHBondContact O-N 3.43Å; D206-K208 WeakPolarHBondContact OD1-CB 3.46Å; D206-K208 PolarHBondContact OD1-N 3.16Å; K208-G210 VanDerWaalsContact C-N 3.34Å
209	S	91.1	Very high	84	Confident	57 Å²	57	80.7 Å²	80.7	40%	0.399	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-31.5	174	64	0	0	0	0	111.9	D206 E211	D206-S209 WeakPolarHBondContact CB-OG 3.22Å; D206-S209 PolarHBondContact OD2-N 3Å; D206-S209 PolarHBondContact OD2-OG 3.23Å; S209-E211 VanDerWaalsContact C-N 3.27Å; S209-E211 WeakPolarHBondContact OG-CB 3.32Å; S209-E211 PolarHBondContact OG-N 3.49Å; S209-E211 VanDerWaalsContact OG-N 3.11Å
210	G	90.6	Very high	82.3	Confident	18 Å²	18	81.7 Å²	81.7	19%	0.186	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	14.6	-169.4	0	0	0	0	0	113	F205 D206 K208	F205-G210 WeakPolarHBondContact CE2-O 3.2Å; D206-G210 VanDerWaalsContact O-CA 3.29Å; D206-G210 WeakPolarHBondContact O-CA 3.29Å; D206-G210 PolarHBondContact O-N 2.97Å; K208-G210 VanDerWaalsContact C-N 3.34Å
211	E	93.8	Very high	80.9	Confident	98 Å²	98	88 Å²	88	46%	0.458	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	164.9	-177	-55.2	178.7	165.6	0	0	110.6	F183 D206 S209	F183-E211 HydrophobicContact CD2-CB 4.48Å; F183-E211 HydrophobicContact CD2-CG 4.42Å; F183-E211 HydrophobicContact CE1-CB 4.12Å; F183-E211 HydrophobicContact CE2-CB 3.83Å; F183-E211 HydrophobicContact CE2-CG 3.64Å; F183-E211 HydrophobicContact CZ-CB 3.62Å; F183-E211 HydrophobicContact CZ-CG 3.85Å; D206-E211 PolarHBondContact N-O 2.88Å; D206-E211 PolarHBondContact O-N 2.83Å; S209-E211 VanDerWaalsContact C-N 3.27Å; S209-E211 WeakPolarHBondContact OG-CB 3.32Å; S209-E211 PolarHBondContact OG-N 3.49Å; S209-E211 VanDerWaalsContact OG-N 3.11Å
212	T	94.6	Very high	79.7	Confident	3 Å²	3	90.6 Å²	90.6	2%	0.018	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	136	166	59.9	0	0	0	0	109.7	V168 A180 F183 E184 R203 S204 F205	V168-T212 HydrophobicContact CG1-CG2 3.95Å; V168-T212 HydrophobicContact CG2-CG2 4.39Å; A180-T212 HydrophobicContact CB-CG2 4.36Å; F183-T212 HydrophobicContact CD1-CG2 3.98Å; F183-T212 WeakPolarHBondContact CD1-OG1 3.4Å; F183-T212 WeakPolarHBondContact CE1-OG1 3.25Å; E184-T212 HydrophobicContact CG-CG2 4.02Å; E184-T212 WeakPolarHBondContact OE1-CB 3.43Å; E184-T212 WeakPolarHBondContact OE1-CG2 2.95Å; E184-T212 PolarHBondContact OE1-OG1 2.95Å; R203-T212 PolarHBondContact NE-OG1 3.33Å; R203-T212 VanDerWaalsContact NE-OG1 3.14Å; R203-T212 PolarHBondContact NH2-O 3.24Å; S204-T212 CarbonylContact O-C 3.45Å; S204-T212 WeakPolarHBondContact O-CA 3.23Å; F205-T212 HydrophobicContact CD2-CG2 4.27Å
213	V	93.1	Very high	79.3	Confident	59 Å²	59	95.2 Å²	95.2	36%	0.358	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	141.1	177.5	-65.2	0	0	0	0	109.7	R203 S204 M215	R203-V213 CarbonylContact C-O 3.54Å; R203-V213 VanDerWaalsContact CA-O 3.23Å; R203-V213 WeakPolarHBondContact CA-O 3.48Å; R203-V213 WeakPolarHBondContact CB-O 3.27Å; S204-V213 PolarHBondContact N-O 2.76Å; S204-V213 WeakPolarHBondContact O-CG2 3.34Å; S204-V213 PolarHBondContact O-N 3.17Å; V213-M215 PolarHBondContact O-N 3.28Å
214	P	91.1	Very high	78.8	Confident	78 Å²	78	96.7 Å²	96.7	51%	0.506	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	134.5	175.6	27.5	-31.9	0	0	0	109.4
215	M	84.6	Confident	78.6	Confident	57 Å²	57	102 Å²	102	28%	0.281	48%	0.481	S	S	.	.			trans	-83	155.5	165.3	-62.1	-158	-64.4	0	0	108.6	K169 T202 V213 D217	K169-M215 HydrophobicContact CB-CE 4.19Å; K169-M215 HydrophobicContact CD-CE 3.67Å; K169-M215 HydrophobicContact CG-CE 4.01Å; T202-M215 HydrophobicContact CG2-CE 3.24Å; T202-M215 WeakPolarHBondContact O-CB 3.36Å; T202-M215 PolarHBondContact O-N 3.12Å; V213-M215 PolarHBondContact O-N 3.28Å; M215-D217 PolarHBondContact O-N 2.93Å; M215-D217 VanDerWaalsContact O-N 3.14Å
216	R	68.3	Low	78.5	Confident	246 Å²	246	104 Å²	104	93%	0.928	49%	0.488	S	S	*	.	S	Bend	trans	-42.4	124.2	176.4	-177.4	176.5	-177.3	167.5	1.9	110.2	K218	R216-K218 PolarHBondContact O-N 3.09Å; R216-K218 VanDerWaalsContact O-N 3.14Å
217	D	53.9	Low	78.5	Confident	107 Å²	107	106 Å²	106	57%	0.572	50%	0.499	S	S	*	.			trans	-52.6	119.8	-172.3	-75.3	-49	0	0	0	110.8	M215 E219	M215-D217 PolarHBondContact O-N 2.93Å; M215-D217 VanDerWaalsContact O-N 3.14Å; D217-E219 HydrophobicContact CB-CG 3.61Å; D217-E219 PolarHBondContact O-N 3.48Å
218	K	52.5	Low	78.9	Confident	112 Å²	112	103.8 Å²	103.8	49%	0.487	50%	0.497	S	S	.	.			trans	-77.2	74.3	158.5	-67.6	-171.3	177.4	-165.2	0	106.3	R216 V220	R216-K218 PolarHBondContact O-N 3.09Å; R216-K218 VanDerWaalsContact O-N 3.14Å; K218-V220 PolarHBondContact O-N 3.39Å
219	E	42	Very low	79	Confident	175 Å²	175	96 Å²	96	82%	0.818	46%	0.463	S	S	*	.			trans	-57	-6.5	-177.4	-68.7	-174.7	155.6	0	0	114	D217	D217-E219 HydrophobicContact CB-CG 3.61Å; D217-E219 PolarHBondContact O-N 3.48Å
220	V	50.3	Low	79.1	Confident	111 Å²	111	98 Å²	98	67%	0.673	48%	0.475	S	S	*	.	S	Bend	trans	-132.6	126	177.1	-171.8	0	0	0	0	109.2	K218 Q222	K218-V220 PolarHBondContact O-N 3.39Å; V220-Q222 PolarHBondContact O-N 3.29Å
221	R	58.9	Low	79.1	Confident	246 Å²	246	102.8 Å²	102.8	93%	0.928	50%	0.496	S	S	*	.			trans	-52	106.5	165.8	-168.3	-176.3	-164.9	-176.9	4.7	107.1	D223	R221-D223 PolarHBondContact O-N 3.36Å
222	Q	65.2	Low	79	Confident	93 Å²	93	101.4 Å²	101.4	44%	0.435	49%	0.492	S	S	.	.			trans	-65.1	112.6	-174.8	-71.2	179.9	-27.1	0	0	108.7	V220 Y224	V220-Q222 PolarHBondContact O-N 3.29Å; Q222-Y224 HydrophobicContact CB-CE1 4.2Å; Q222-Y224 HydrophobicContact CB-CE2 4.36Å; Q222-Y224 WeakPolarHBondContact O-CD2 3.29Å; Q222-Y224 PolarHBondContact O-N 2.94Å; Q222-Y224 VanDerWaalsContact O-N 3.16Å; Q222-Y224 PolarHBondContact OE1-OH 3.22Å
223	D	82.3	Confident	78.9	Confident	126 Å²	126	106.2 Å²	106.2	67%	0.674	52%	0.523	S	S	*	.			trans	-74.9	101.1	169.6	-177.9	4.2	0	0	0	108.6	R221 R225	R221-D223 PolarHBondContact O-N 3.36Å; D223-R225 PolarHBondContact O-N 3.09Å; D223-R225 PolarHBondContact OD1-N 2.92Å
224	Y	83.7	Confident	78.9	Confident	60 Å²	60	106.3 Å²	106.3	24%	0.235	53%	0.525	C	S	.	.			trans	-74.2	-2.4	179.3	-65.3	-68.9	0	0	0	113.5	K14 H15 Y16 Q222 Y226	K14-Y224 HydrophobicContact CD-CD1 4.41Å; K14-Y224 HydrophobicContact CG-CD1 3.84Å; K14-Y224 HydrophobicContact CG-CG 3.83Å; H15-Y224 WeakPolarHBondContact CA-O 3.48Å; H15-Y224 WeakPolarHBondContact CB-O 3.29Å; H15-Y224 PolarHBondContact N-O 3.46Å; H15-Y224 WeakPolarHBondContact O-CA 3.39Å; Y16-Y224 HydrophobicContact CD1-CD1 4.16Å; Y16-Y224 HydrophobicContact CD1-CE1 4.28Å; Y16-Y224 HydrophobicContact CG-CE1 4.42Å; Q222-Y224 HydrophobicContact CB-CE1 4.2Å; Q222-Y224 HydrophobicContact CB-CE2 4.36Å; Q222-Y224 WeakPolarHBondContact O-CD2 3.29Å; Q222-Y224 PolarHBondContact O-N 2.94Å; Q222-Y224 VanDerWaalsContact O-N 3.16Å; Q222-Y224 PolarHBondContact OE1-OH 3.22Å; Y224-Y226 HydrophobicContact CD2-CE2 4.37Å; Y224-Y226 PolarHBondContact O-N 3.22Å
225	R	89.9	Confident	79	Confident	132 Å²	132	104.8 Å²	104.8	50%	0.498	51%	0.512	S	S	.	.			trans	44.9	61.3	176.6	-62.7	177.9	-68.1	168	1.2	112.6	H15 D223 L227	H15-R225 HydrophobicContact CB-CB 4.45Å; H15-R225 PolarHBondContact CE1-O 3.48Å; H15-R225 PolarHBondContact ND1-O 3.48Å; D223-R225 PolarHBondContact O-N 3.09Å; D223-R225 PolarHBondContact OD1-N 2.92Å; R225-L227 PolarHBondContact O-N 2.95Å
226	Y	91.5	Very high	79.4	Confident	53 Å²	53	108.6 Å²	108.6	21%	0.208	52%	0.523	C	S	.	.			trans	-59.5	130.9	179	-74.3	-84.1	0	0	0	110.9	R13 K14 T41 Y43 Y44 Y224	R13-Y226 WeakPolarHBondContact O-CA 3.5Å; K14-Y226 HydrophobicContact CB-CD1 4.3Å; K14-Y226 HydrophobicContact CB-CE1 3.7Å; K14-Y226 HydrophobicContact CD-CE1 4.4Å; K14-Y226 HydrophobicContact CG-CE1 3.88Å; T41-Y226 HydrophobicContact CG2-CE1 3.96Å; Y43-Y226 HydrophobicContact CD1-CD1 4.23Å; Y43-Y226 HydrophobicContact CD1-CD2 4.3Å; Y43-Y226 AromaticContact CD1-CG 3.97Å; Y43-Y226 HydrophobicContact CD1-CG 3.97Å; Y43-Y226 HydrophobicContact CD2-CD1 4.13Å; Y43-Y226 HydrophobicContact CD2-CD2 4.18Å; Y43-Y226 AromaticContact CD2-CE1 3.85Å; Y43-Y226 HydrophobicContact CD2-CE1 3.85Å; Y43-Y226 AromaticContact CD2-CE2 3.93Å; Y43-Y226 HydrophobicContact CD2-CE2 3.93Å; Y43-Y226 HydrophobicContact CD2-CG 4.27Å; Y43-Y226 AromaticContact CD2-CZ 3.74Å; Y43-Y226 HydrophobicContact CE1-CD2 4.36Å; Y43-Y226 HydrophobicContact CE1-CG 4.43Å; Y43-Y226 HydrophobicContact CE2-CD2 4.25Å; Y43-Y226 AromaticContact CE2-CE2 4Å; Y43-Y226 HydrophobicContact CE2-CE2 4Å; Y43-Y226 AromaticContact CG-CD1 3.72Å; Y43-Y226 HydrophobicContact CG-CD1 3.72Å; Y43-Y226 HydrophobicContact CG-CD2 4.21Å; Y43-Y226 AromaticContact CG-CE1 3.88Å; Y43-Y226 HydrophobicContact CG-CE1 3.88Å; Y43-Y226 HydrophobicContact CG-CE2 4.37Å; Y43-Y226 AromaticContact CG-CG 3.88Å; Y43-Y226 HydrophobicContact CG-CG 3.88Å; Y44-Y226 PolarHBondContact OH-O 2.98Å; Y224-Y226 HydrophobicContact CD2-CE2 4.37Å; Y224-Y226 PolarHBondContact O-N 3.22Å
227	L	93.6	Very high	80.6	Confident	95 Å²	95	97.5 Å²	97.5	50%	0.497	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	142.2	176.1	-71.2	164.5	0	0	0	108.5	D12 R13 R225 E229	D12-L227 CarbonylContact C-O 3.54Å; D12-L227 WeakPolarHBondContact CA-O 3.4Å; R13-L227 PolarHBondContact N-O 2.6Å; R13-L227 PolarHBondContact O-N 2.98Å; R225-L227 PolarHBondContact O-N 2.95Å; L227-E229 PolarHBondContact O-N 3.35Å
228	P	94.9	Very high	82.5	Confident	82 Å²	82	93.4 Å²	93.4	53%	0.532	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53	140	172.1	-26.3	35.4	0	0	0	111.5	D12 Y44 P230	D12-P228 WeakPolarHBondContact OD1-CA 3.45Å; Y44-P228 HydrophobicContact CE2-CG 4.5Å; P228-P230 WeakPolarHBondContact O-CD 3.21Å
229	E	93.3	Very high	84.4	Confident	9 Å²	9	89.2 Å²	89.2	4%	0.042	44%	0.442	C	S	.	.			trans	-78.7	106.5	175.6	173.5	52.8	-102.6	0	0	109.8	F11 R13 I40 L227 N231 L232	F11-E229 HydrophobicContact CB-CB 3.95Å; F11-E229 HydrophobicContact CB-CG 4.45Å; F11-E229 WeakPolarHBondContact O-CB 3.3Å; F11-E229 PolarHBondContact O-N 3.47Å; R13-E229 HydrophobicContact CG-CB 4.36Å; R13-E229 WeakPolarHBondContact CG-OE2 2.9Å; R13-E229 IonicContact CZ-OE1 2.7Å; R13-E229 IonicContact CZ-OE2 3.77Å; R13-E229 IonicContact NE-OE1 3.68Å; R13-E229 PolarHBondContact NE-OE1 3.49Å; R13-E229 IonicContact NE-OE2 2.8Å; R13-E229 PolarHBondContact NE-OE2 3.22Å; R13-E229 IonicContact NH2-OE1 3.28Å; R13-E229 PolarHBondContact NH2-OE1 2.56Å; R13-E229 IonicContact NH2-OE2 3.84Å; R13-E229 PolarHBondContact NH2-OE2 3.23Å; I40-E229 HydrophobicContact CD1-CG 4.4Å; L227-E229 PolarHBondContact O-N 3.35Å; E229-N231 VanDerWaalsContact C-N 3.28Å; E229-N231 PolarHBondContact O-N 3.22Å; E229-N231 VanDerWaalsContact OE1-CB 3.23Å; E229-N231 WeakPolarHBondContact OE1-CB 3.43Å; E229-N231 PolarHBondContact OE1-N 3.22Å; E229-N231 PolarHBondContact OE1-ND2 3.26Å; E229-L232 HydrophobicContact CG-CB 3.97Å; E229-L232 HydrophobicContact CG-CD1 4.05Å; E229-L232 HydrophobicContact CG-CG 3.87Å
230	P	92.2	Very high	86.7	Confident	99 Å²	99	88.4 Å²	88.4	64%	0.643	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-21.7	-176.5	30.2	-39	0	0	0	113.8	P228	P228-P230 WeakPolarHBondContact O-CD 3.21Å
231	N	91.1	Very high	88.4	Confident	118 Å²	118	88.6 Å²	88.6	63%	0.631	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-12.7	-174	-61.6	-28.6	0	0	0	113.3	R13 E229	R13-N231 PolarHBondContact NH2-ND2 3.42Å; E229-N231 VanDerWaalsContact C-N 3.28Å; E229-N231 PolarHBondContact O-N 3.22Å; E229-N231 VanDerWaalsContact OE1-CB 3.23Å; E229-N231 WeakPolarHBondContact OE1-CB 3.43Å; E229-N231 PolarHBondContact OE1-N 3.22Å; E229-N231 PolarHBondContact OE1-ND2 3.26Å
232	L	91.4	Very high	89.8	Confident	69 Å²	69	79.7 Å²	79.7	36%	0.361	41%	0.414	S	S	.	.	S	Bend	trans	-110.2	119.8	178.5	-66.6	179.9	0	0	0	109.7	F11 I40 E229	F11-L232 HydrophobicContact CB-CB 4.39Å; F11-L232 HydrophobicContact CB-CD1 3.94Å; F11-L232 HydrophobicContact CD1-CD1 4.29Å; F11-L232 HydrophobicContact CD2-CB 4Å; F11-L232 HydrophobicContact CD2-CD1 3.82Å; F11-L232 HydrophobicContact CE2-CD1 4.4Å; F11-L232 HydrophobicContact CG-CB 4.47Å; F11-L232 HydrophobicContact CG-CD1 3.75Å; I40-L232 HydrophobicContact CD1-CD1 4.2Å; I40-L232 HydrophobicContact CG2-CD1 3.86Å; E229-L232 HydrophobicContact CG-CB 3.97Å; E229-L232 HydrophobicContact CG-CD1 4.05Å; E229-L232 HydrophobicContact CG-CG 3.87Å
233	P	92.4	Very high	90.9	Very high	103 Å²	103	78.6 Å²	78.6	67%	0.669	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-64.2	155.7	173.7	28.5	-33.9	0	0	0	110.3	L235	P233-L235 PolarHBondContact O-N 3.13Å
234	P	93.2	Very high	91.1	Very high	62 Å²	62	74.8 Å²	74.8	40%	0.403	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-55.5	133.9	174.7	-24.6	33.6	0	0	0	111.7	V8 S9 T10 R236	V8-P234 HydrophobicContact CG1-CB 3.79Å; S9-P234 CarbonylContact O-C 3.56Å; S9-P234 WeakPolarHBondContact O-CA 3.43Å; T10-P234 HydrophobicContact CG2-CB 4.18Å; T10-P234 HydrophobicContact CG2-CG 4.33Å; P234-R236 PolarHBondContact O-N 2.87Å
235	L	93.7	Very high	91.3	Very high	46 Å²	46	75 Å²	75	24%	0.241	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	117.5	172.2	179.2	60.7	0	0	0	109	V8 S9 F11 I47 P233 L237 I254	V8-L235 CarbonylContact C-O 3.59Å; V8-L235 WeakPolarHBondContact CA-O 3.22Å; S9-L235 PolarHBondContact N-O 3.21Å; S9-L235 PolarHBondContact O-N 3.44Å; F11-L235 HydrophobicContact CE2-CB 4.4Å; I47-L235 HydrophobicContact CD1-CD2 3.67Å; P233-L235 PolarHBondContact O-N 3.13Å; L235-L237 HydrophobicContact CD1-CD2 4.43Å; L235-L237 HydrophobicContact CG-CD2 4.23Å; L235-I254 HydrophobicContact CD1-CD1 4.03Å
236	R	93.4	Very high	91.1	Very high	137 Å²	137	74.3 Å²	74.3	52%	0.517	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.9	179.4	-64	-179.2	179.6	-86.2	0.1	110	R7 V8 P234 Y238	R7-R236 WeakPolarHBondContact O-CA 3.36Å; V8-R236 HydrophobicContact CG2-CG 4.46Å; P234-R236 PolarHBondContact O-N 2.87Å; R236-Y238 HydrophobicContact CB-CE2 4.21Å
237	L	93.9	Very high	91	Very high	12 Å²	12	78.5 Å²	78.5	6%	0.063	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	142	176.6	-56.1	-174.9	0	0	0	109.9	I5 R7 I47 L235 N242 I254 I256	I5-L237 HydrophobicContact CG2-CD1 3.42Å; I5-L237 VanDerWaalsContact CG2-CD1 3.42Å; R7-L237 PolarHBondContact O-N 2.63Å; I47-L237 HydrophobicContact CD1-CD1 3.69Å; I47-L237 HydrophobicContact CD1-CG 4.36Å; I47-L237 HydrophobicContact CG1-CD1 4.41Å; L235-L237 HydrophobicContact CD1-CD2 4.43Å; L235-L237 HydrophobicContact CG-CD2 4.23Å; L237-N242 PolarHBondContact O-ND2 2.93Å; L237-I254 HydrophobicContact CD2-CB 3.68Å; L237-I254 HydrophobicContact CD2-CD1 4.02Å; L237-I254 HydrophobicContact CD2-CG1 4.4Å; L237-I254 HydrophobicContact CD2-CG2 3.7Å; L237-I256 HydrophobicContact CB-CD1 3.88Å; L237-I256 HydrophobicContact CB-CG1 4.15Å; L237-I256 HydrophobicContact CD1-CD1 4.3Å; L237-I256 HydrophobicContact CD1-CG1 4.49Å
238	Y	94.1	Very high	90.6	Very high	21 Å²	21	76.5 Å²	76.5	8%	0.082	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	149.8	-175.1	-58.4	-78.5	0	0	0	110.6	R236 N242 P244 L248 I254 F255 I256	R236-Y238 HydrophobicContact CB-CE2 4.21Å; Y238-N242 WeakPolarHBondContact CA-O 3.49Å; Y238-N242 WeakPolarHBondContact CB-O 3.32Å; Y238-N242 WeakPolarHBondContact CD1-O 3.24Å; Y238-P244 VanDerWaalsContact CD1-CA 3.46Å; Y238-P244 HydrophobicContact CD1-CB 3.93Å; Y238-P244 HydrophobicContact CD2-CB 4.04Å; Y238-P244 HydrophobicContact CE1-CB 4.04Å; Y238-P244 HydrophobicContact CE2-CB 4.14Å; Y238-P244 HydrophobicContact CG-CB 3.92Å; Y238-L248 HydrophobicContact CE2-CD2 3.66Å; Y238-L248 WeakPolarHBondContact OH-CD2 3.37Å; Y238-I254 PolarHBondContact N-O 2.99Å; Y238-F255 CarbonylContact O-C 3.57Å; Y238-F255 WeakPolarHBondContact O-CA 3.3Å; Y238-I256 WeakPolarHBondContact O-CG1 3.19Å; Y238-I256 PolarHBondContact O-N 3.47Å
239	D	92.4	Very high	90.1	Very high	24 Å²	24	75.5 Å²	75.5	13%	0.128	44%	0.443	C	S	.	.	B	Isolated β-bridge	trans	-143.3	175.2	178.2	62.2	37.9	0	0	0	108.8	R7 C241 N242 A243 F255 I256 D257	R7-D239 IonicContact CZ-OD2 2.86Å; R7-D239 IonicContact NE-OD2 3.45Å; R7-D239 PolarHBondContact NE-OD2 2.63Å; R7-D239 IonicContact NH2-OD1 3.92Å; R7-D239 PolarHBondContact NH2-OD1 3.38Å; R7-D239 IonicContact NH2-OD2 3.86Å; R7-D239 PolarHBondContact NH2-OD2 2.7Å; D239-C241 PolarHBondContact O-N 2.7Å; D239-C241 VanDerWaalsContact O-N 3.13Å; D239-C241 VanDerWaalsContact OD1-C 3.31Å; D239-C241 VanDerWaalsContact OD1-CA 3.29Å; D239-C241 WeakPolarHBondContact OD1-CA 3.4Å; D239-C241 VanDerWaalsContact OD1-CB 3.32Å; D239-C241 WeakPolarHBondContact OD1-CB 3.28Å; D239-C241 PolarHBondContact OD1-N 3.41Å; D239-N242 PolarHBondContact N-O 2.7Å; D239-N242 CarbonylContact O-C 3.59Å; D239-N242 PolarHBondContact O-N 2.87Å; D239-N242 VanDerWaalsContact O-O 3.12Å; D239-N242 WeakPolarHBondContact OD1-CB 3.37Å; D239-N242 PolarHBondContact OD1-N 2.93Å; D239-A243 PolarHBondContact O-N 2.8Å; D239-F255 VanDerWaalsContact C-CE2 3.48Å; D239-F255 WeakPolarHBondContact O-CE2 3.42Å; D239-I256 HydrophobicContact CB-CB 4.48Å; D239-D257 WeakPolarHBondContact CA-OD2 3.47Å; D239-D257 WeakPolarHBondContact CB-OD2 3.46Å
240	E	88.4	Confident	89.6	Confident	159 Å²	159	80.3 Å²	80.3	74%	0.743	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.4	178.1	-74.1	179.2	-179.1	0	0	113.6	F255 D257	E240-F255 HydrophobicContact CG-CE1 4.43Å; E240-F255 HydrophobicContact CG-CZ 4.14Å; E240-D257 PolarHBondContact N-OD2 3.16Å
241	C	87.8	Confident	89.2	Confident	115 Å²	115	82 Å²	82	78%	0.777	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-11.5	178.6	-63.5	0	0	0	0	113.6	D239	D239-C241 PolarHBondContact O-N 2.7Å; D239-C241 VanDerWaalsContact O-N 3.13Å; D239-C241 VanDerWaalsContact OD1-C 3.31Å; D239-C241 VanDerWaalsContact OD1-CA 3.29Å; D239-C241 WeakPolarHBondContact OD1-CA 3.4Å; D239-C241 VanDerWaalsContact OD1-CB 3.32Å; D239-C241 WeakPolarHBondContact OD1-CB 3.28Å; D239-C241 PolarHBondContact OD1-N 3.41Å
242	N	87.7	Confident	88.8	Confident	58 Å²	58	82.4 Å²	82.4	31%	0.31	48%	0.48	S	S	.	.	B	Isolated β-bridge	trans	-141.4	76.7	-178.1	-178.2	54.7	0	0	0	108.6	L237 Y238 D239	L237-N242 PolarHBondContact O-ND2 2.93Å; Y238-N242 WeakPolarHBondContact CA-O 3.49Å; Y238-N242 WeakPolarHBondContact CB-O 3.32Å; Y238-N242 WeakPolarHBondContact CD1-O 3.24Å; D239-N242 PolarHBondContact N-O 2.7Å; D239-N242 CarbonylContact O-C 3.59Å; D239-N242 PolarHBondContact O-N 2.87Å; D239-N242 VanDerWaalsContact O-O 3.12Å; D239-N242 WeakPolarHBondContact OD1-CB 3.37Å; D239-N242 PolarHBondContact OD1-N 2.93Å
243	A	87.2	Confident	88.5	Confident	70 Å²	70	80.6 Å²	80.6	58%	0.579	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-67.6	150.1	-178.8	0	0	0	0	0	112.1	D239	D239-A243 PolarHBondContact O-N 2.8Å
244	P	87.8	Confident	88.4	Confident	47 Å²	47	79 Å²	79	31%	0.305	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-66.4	152	175.1	28.3	-33.7	0	0	0	111.7	Y238 L248	Y238-P244 VanDerWaalsContact CD1-CA 3.46Å; Y238-P244 HydrophobicContact CD1-CB 3.93Å; Y238-P244 HydrophobicContact CD2-CB 4.04Å; Y238-P244 HydrophobicContact CE1-CB 4.04Å; Y238-P244 HydrophobicContact CE2-CB 4.14Å; Y238-P244 HydrophobicContact CG-CB 3.92Å; P244-L248 HydrophobicContact CB-CD2 4.29Å
245	P	87.9	Confident	88.4	Confident	63 Å²	63	79.2 Å²	79.2	41%	0.409	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-55.4	142.5	169.6	-23.8	34.2	0	0	0	111.6	N247 L248	P245-N247 VanDerWaalsContact CB-OD1 3.24Å; P245-N247 WeakPolarHBondContact CB-OD1 3.4Å; P245-N247 PolarHBondContact O-N 3.43Å; P245-L248 WeakPolarHBondContact O-CB 3.38Å; P245-L248 PolarHBondContact O-N 2.91Å
246	A	85.8	Confident	88.3	Confident	118 Å²	118	77.7 Å²	77.7	98%	0.975	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-20.1	-175.8	0	0	0	0	0	114.6
247	N	87.8	Confident	88.3	Confident	142 Å²	142	72.3 Å²	72.3	76%	0.759	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-0	-179.8	64.3	-31.9	0	0	0	114.1	P245	P245-N247 VanDerWaalsContact CB-OD1 3.24Å; P245-N247 WeakPolarHBondContact CB-OD1 3.4Å; P245-N247 PolarHBondContact O-N 3.43Å
248	L	85.3	Confident	88.1	Confident	53 Å²	53	78 Å²	78	28%	0.277	45%	0.449	S	S	.	.	S	Bend	trans	-81.5	125.7	179.8	-168.4	65.4	0	0	0	110.1	Y238 P244 P245 Q252 C253	Y238-L248 HydrophobicContact CE2-CD2 3.66Å; Y238-L248 WeakPolarHBondContact OH-CD2 3.37Å; P244-L248 HydrophobicContact CB-CD2 4.29Å; P245-L248 WeakPolarHBondContact O-CB 3.38Å; P245-L248 PolarHBondContact O-N 2.91Å; L248-Q252 HydrophobicContact CD1-CB 4.34Å; L248-C253 WeakPolarHBondContact CD2-SG 3.37Å; L248-C253 VanDerWaalsContact CG-SG 3.54Å
249	P	84.9	Confident	88	Confident	60 Å²	60	81.8 Å²	81.8	39%	0.39	47%	0.471	S	S	.	.			trans	-57	139.1	175.2	-27.2	37.5	0	0	0	112	D251 Q252 C253	P249-D251 WeakPolarHBondContact CB-OD1 3.25Å; P249-D251 PolarHBondContact O-N 3.04Å; P249-Q252 HydrophobicContact CB-CG 4.27Å; P249-Q252 PolarHBondContact O-N 3.5Å; P249-C253 PolarHBondContact O-N 2.95Å; P249-C253 PolarHBondContact O-SG 3.27Å
250	S	82.2	Confident	87.9	Confident	110 Å²	110	87.4 Å²	87.4	77%	0.769	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-64.5	-26.6	-175.4	56.2	0	0	0	0	113.6	Q252 C253	S250-Q252 VanDerWaalsContact C-N 3.31Å; S250-C253 PolarHBondContact O-N 3.04Å
251	D	84.4	Confident	88.1	Confident	135 Å²	135	87 Å²	87	72%	0.722	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-75	-18.4	174.6	64.3	-29.9	0	0	0	113.3	P249	P249-D251 WeakPolarHBondContact CB-OD1 3.25Å; P249-D251 PolarHBondContact O-N 3.04Å
252	Q	82.9	Confident	88.2	Confident	127 Å²	127	86.8 Å²	86.8	59%	0.593	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-94.3	-1.3	171.9	-61.6	-173.9	20.4	0	0	112.8	L248 P249 S250	L248-Q252 HydrophobicContact CD1-CB 4.34Å; P249-Q252 HydrophobicContact CB-CG 4.27Å; P249-Q252 PolarHBondContact O-N 3.5Å; S250-Q252 VanDerWaalsContact C-N 3.31Å
253	C	85.9	Confident	88.3	Confident	30 Å²	30	88.2 Å²	88.2	20%	0.203	49%	0.489	C	S	.	.			trans	-98.1	120.3	-179.5	-65.3	0	0	0	0	111	L248 P249 S250	L248-C253 WeakPolarHBondContact CD2-SG 3.37Å; L248-C253 VanDerWaalsContact CG-SG 3.54Å; P249-C253 PolarHBondContact O-N 2.95Å; P249-C253 PolarHBondContact O-SG 3.27Å; S250-C253 PolarHBondContact O-N 3.04Å
254	I	90.3	Very high	88.3	Confident	69 Å²	69	87.2 Å²	87.2	35%	0.354	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	107.9	168.3	-54.7	179.9	0	0	0	108.5	L235 L237 Y238 L259	L235-I254 HydrophobicContact CD1-CD1 4.03Å; L237-I254 HydrophobicContact CD2-CB 3.68Å; L237-I254 HydrophobicContact CD2-CD1 4.02Å; L237-I254 HydrophobicContact CD2-CG1 4.4Å; L237-I254 HydrophobicContact CD2-CG2 3.7Å; Y238-I254 PolarHBondContact N-O 2.99Å; I254-L259 HydrophobicContact CG2-CD1 3.76Å
255	F	92	Very high	88.2	Confident	68 Å²	68	88.6 Å²	88.6	30%	0.298	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	112.6	-179.5	-158.9	-104	0	0	0	110.8	Y238 D239 E240 D257 K258 L259	Y238-F255 CarbonylContact O-C 3.57Å; Y238-F255 WeakPolarHBondContact O-CA 3.3Å; D239-F255 VanDerWaalsContact C-CE2 3.48Å; D239-F255 WeakPolarHBondContact O-CE2 3.42Å; E240-F255 HydrophobicContact CG-CE1 4.43Å; E240-F255 HydrophobicContact CG-CZ 4.14Å; F255-D257 HydrophobicContact CD1-CB 4.21Å; F255-D257 HydrophobicContact CE1-CB 3.83Å; F255-D257 PolarHBondContact O-N 2.9Å; F255-K258 HydrophobicContact CB-CB 4.3Å; F255-K258 HydrophobicContact CD1-CB 4.01Å; F255-K258 PolarHBondContact O-N 3.28Å; F255-L259 PolarHBondContact O-N 3.44Å
256	I	93.2	Very high	88.2	Confident	13 Å²	13	86.3 Å²	86.3	7%	0.067	47%	0.47	C	S	.	.	H	α-helix	trans	-61.7	-44.1	-171.6	-65.2	170.6	0	0	0	111.2	I5 L237 Y238 D239 K258 L259 R260	I5-I256 HydrophobicContact CB-CD1 4.32Å; I5-I256 HydrophobicContact CD1-CD1 4.47Å; I5-I256 HydrophobicContact CD1-CG2 3.93Å; I5-I256 HydrophobicContact CG2-CD1 3.78Å; L237-I256 HydrophobicContact CB-CD1 3.88Å; L237-I256 HydrophobicContact CB-CG1 4.15Å; L237-I256 HydrophobicContact CD1-CD1 4.3Å; L237-I256 HydrophobicContact CD1-CG1 4.49Å; Y238-I256 WeakPolarHBondContact O-CG1 3.19Å; Y238-I256 PolarHBondContact O-N 3.47Å; D239-I256 HydrophobicContact CB-CB 4.48Å; I256-K258 VanDerWaalsContact C-N 3.32Å; I256-K258 PolarHBondContact O-N 2.76Å; I256-L259 PolarHBondContact O-N 2.77Å; I256-R260 HydrophobicContact CG2-CG 4.38Å; I256-R260 WeakPolarHBondContact O-CG 3.42Å; I256-R260 PolarHBondContact O-N 2.89Å
257	D	91.4	Very high	88.3	Confident	24 Å²	24	80.7 Å²	80.7	13%	0.128	42%	0.424	C	S	.	.	H	α-helix	trans	-69.4	-32.4	-174.3	-59.1	-49.7	0	0	0	112.2	D239 E240 F255 R260 L261	D239-D257 WeakPolarHBondContact CA-OD2 3.47Å; D239-D257 WeakPolarHBondContact CB-OD2 3.46Å; E240-D257 PolarHBondContact N-OD2 3.16Å; F255-D257 HydrophobicContact CD1-CB 4.21Å; F255-D257 HydrophobicContact CE1-CB 3.83Å; F255-D257 PolarHBondContact O-N 2.9Å; D257-R260 WeakPolarHBondContact O-CB 3.3Å; D257-R260 PolarHBondContact O-N 3.46Å; D257-R260 IonicContact OD1-CZ 3.17Å; D257-R260 IonicContact OD1-NH1 2.7Å; D257-R260 PolarHBondContact OD1-NH1 3.41Å; D257-L261 WeakPolarHBondContact O-CG 3.38Å; D257-L261 PolarHBondContact O-N 3.11Å
258	K	90.7	Very high	88.3	Confident	131 Å²	131	76.4 Å²	76.4	57%	0.57	40%	0.399	S	S	*	.	H	α-helix	trans	-63	-47	170.9	-175.8	179.2	178.2	-176.1	0	111.1	F255 I256 R260 L261 D262	F255-K258 HydrophobicContact CB-CB 4.3Å; F255-K258 HydrophobicContact CD1-CB 4.01Å; F255-K258 PolarHBondContact O-N 3.28Å; I256-K258 VanDerWaalsContact C-N 3.32Å; I256-K258 PolarHBondContact O-N 2.76Å; K258-R260 PolarHBondContact O-N 2.91Å; K258-L261 PolarHBondContact O-N 3.4Å; K258-L261 VanDerWaalsContact O-N 3.14Å; K258-D262 PolarHBondContact O-N 3.39Å
259	L	91.8	Very high	88.5	Confident	101 Å²	101	78 Å²	78	53%	0.529	41%	0.407	S	S	.	.	H	α-helix	trans	-62.7	-31.2	176.5	-67	176	0	0	0	112.8	I254 F255 I256 M263	I254-L259 HydrophobicContact CG2-CD1 3.76Å; F255-L259 PolarHBondContact O-N 3.44Å; I256-L259 PolarHBondContact O-N 2.77Å; L259-M263 PolarHBondContact O-N 3.42Å
260	R	91.2	Very high	88.7	Confident	143 Å²	143	76 Å²	76	54%	0.54	39%	0.393	S	S	.	.	H	α-helix	trans	-68.3	-41.4	173.5	-72.4	173.7	178.1	159	-4.4	111.8	I256 D257 K258 M263	I256-R260 HydrophobicContact CG2-CG 4.38Å; I256-R260 WeakPolarHBondContact O-CG 3.42Å; I256-R260 PolarHBondContact O-N 2.89Å; D257-R260 WeakPolarHBondContact O-CB 3.3Å; D257-R260 PolarHBondContact O-N 3.46Å; D257-R260 IonicContact OD1-CZ 3.17Å; D257-R260 IonicContact OD1-NH1 2.7Å; D257-R260 PolarHBondContact OD1-NH1 3.41Å; K258-R260 PolarHBondContact O-N 2.91Å; R260-M263 VanDerWaalsContact O-CB 3.29Å; R260-M263 WeakPolarHBondContact O-CB 3.45Å; R260-M263 PolarHBondContact O-N 3Å
261	L	91.3	Very high	89.1	Confident	149 Å²	149	71.5 Å²	71.5	78%	0.78	36%	0.359	S	S	*	.	H	α-helix	trans	-67.6	-40.2	177.5	-70.6	169.7	0	0	0	112.1	D257 K258 M263	D257-L261 WeakPolarHBondContact O-CG 3.38Å; D257-L261 PolarHBondContact O-N 3.11Å; K258-L261 PolarHBondContact O-N 3.4Å; K258-L261 VanDerWaalsContact O-N 3.14Å; L261-M263 PolarHBondContact O-N 3.46Å
262	D	90.3	Very high	89.5	Confident	112 Å²	112	71.9 Å²	71.9	60%	0.599	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-1.8	179.6	-65	-21.1	0	0	0	112.7	K258	K258-D262 PolarHBondContact O-N 3.39Å
263	M	89.6	Confident	89.9	Confident	87 Å²	87	72.1 Å²	72.1	43%	0.429	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-69.4	128.5	-174.7	-166	170.3	-65.5	0	0	111.2	L259 R260 L261 L266	L259-M263 PolarHBondContact O-N 3.42Å; R260-M263 VanDerWaalsContact O-CB 3.29Å; R260-M263 WeakPolarHBondContact O-CB 3.45Å; R260-M263 PolarHBondContact O-N 3Å; L261-M263 PolarHBondContact O-N 3.46Å; M263-L266 HydrophobicContact CG-CD2 4.35Å; M263-L266 HydrophobicContact SD-CD1 3.8Å; M263-L266 HydrophobicContact SD-CD2 4.21Å; M263-L266 HydrophobicContact SD-CG 4.19Å
264	P	87.8	Confident	90.3	Very high	50 Å²	50	70.7 Å²	70.7	33%	0.325	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-65.7	158.6	176.4	27.2	-34.4	0	0	0	111.3	A133 L266	A133-P264 WeakPolarHBondContact O-CG 3.45Å; P264-L266 PolarHBondContact O-N 3.16Å
265	P	85.6	Confident	90.4	Very high	75 Å²	75	68.8 Å²	68.8	49%	0.487	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-59.2	117.6	178.8	23.7	-33.7	0	0	0	111	Q270 R303	P265-Q270 HydrophobicContact CB-CG 4.07Å; P265-R303 PolarHBondContact O-NH2 2.82Å
266	L	88.8	Confident	90.5	Very high	15 Å²	15	69.7 Å²	69.7	8%	0.079	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-76.8	155.2	-178.9	-61.2	-179.9	0	0	0	111.8	I134 M263 P264 H268 I269 Q270	I134-L266 HydrophobicContact CD1-CD2 4.07Å; I134-L266 HydrophobicContact CG1-CD2 3.67Å; M263-L266 HydrophobicContact CG-CD2 4.35Å; M263-L266 HydrophobicContact SD-CD1 3.8Å; M263-L266 HydrophobicContact SD-CD2 4.21Å; M263-L266 HydrophobicContact SD-CG 4.19Å; P264-L266 PolarHBondContact O-N 3.16Å; L266-H268 VanDerWaalsContact C-N 3.29Å; L266-H268 PolarHBondContact O-N 3.46Å; L266-I269 HydrophobicContact CB-CD1 4.26Å; L266-I269 HydrophobicContact CB-CG1 4.31Å; L266-I269 WeakPolarHBondContact O-CB 3.43Å; L266-I269 PolarHBondContact O-N 2.74Å; L266-Q270 PolarHBondContact O-N 3.2Å
267	P	87.1	Confident	90.5	Very high	1 Å²	1	72.8 Å²	72.8	1%	0.006	37%	0.37	C	S	.	.	H	α-helix	trans	-53	-40.8	-177.8	-27.7	34	0	0	0	114.6	A129 A133 Q270 R271	A129-P267 HydrophobicContact CB-CG 4.04Å; A133-P267 HydrophobicContact CB-CG 4.36Å; P267-Q270 PolarHBondContact O-N 3.45Å; P267-R271 WeakPolarHBondContact O-CB 3.25Å; P267-R271 PolarHBondContact O-N 2.93Å
268	H	88.4	Confident	90.5	Very high	51 Å²	51	74.1 Å²	74.1	24%	0.236	39%	0.39	C	S	.	.	H	α-helix	trans	-68.7	-34.4	179.3	72.9	-87.5	0	0	0	112.9	L266 R271 K272	L266-H268 VanDerWaalsContact C-N 3.29Å; L266-H268 PolarHBondContact O-N 3.46Å; H268-R271 PolarHBondContact O-N 2.97Å; H268-K272 WeakPolarHBondContact O-CG 3.45Å; H268-K272 PolarHBondContact O-N 3.38Å
269	I	89.6	Confident	90.5	Very high	87 Å²	87	68.5 Å²	68.5	45%	0.446	37%	0.366	S	S	.	.	H	α-helix	trans	-66.5	-46.3	175.8	-59.4	179.6	0	0	0	109.1	L266 R271 K272 R273	L266-I269 HydrophobicContact CB-CD1 4.26Å; L266-I269 HydrophobicContact CB-CG1 4.31Å; L266-I269 WeakPolarHBondContact O-CB 3.43Å; L266-I269 PolarHBondContact O-N 2.74Å; I269-R271 VanDerWaalsContact C-N 3.32Å; I269-R271 PolarHBondContact O-N 3.41Å; I269-K272 PolarHBondContact O-N 3.13Å; I269-R273 PolarHBondContact O-N 3.25Å
270	Q	89.2	Confident	90.4	Very high	18 Å²	18	67.3 Å²	67.3	8%	0.084	36%	0.364	C	S	.	.	H	α-helix	trans	-64	-38.4	176.4	-69.4	-172.5	-18.9	0	0	112.4	P265 L266 P267 K272 R273 W274 L288 R303	P265-Q270 HydrophobicContact CB-CG 4.07Å; L266-Q270 PolarHBondContact O-N 3.2Å; P267-Q270 PolarHBondContact O-N 3.45Å; Q270-K272 VanDerWaalsContact C-N 3.35Å; Q270-K272 PolarHBondContact O-N 3.3Å; Q270-R273 PolarHBondContact O-N 2.92Å; Q270-W274 HydrophobicContact CB-CZ2 4.49Å; Q270-W274 WeakPolarHBondContact O-CB 2.73Å; Q270-W274 PolarHBondContact O-N 3.33Å; Q270-L288 HydrophobicContact CB-CD2 3.88Å; Q270-R303 VanDerWaalsContact NE2-NH2 3.11Å
271	R	90.4	Very high	90.2	Very high	16 Å²	16	65 Å²	65	6%	0.06	36%	0.36	C	S	.	.	H	α-helix	trans	-57.8	-47.1	174.2	-163.5	179.2	-63.7	136	6.7	111.6	Y56 E126 P267 H268 I269 G275 L284 L288	Y56-R271 VanDerWaalsContact CD2-NH1 3.34Å; E126-R271 VanDerWaalsContact CD-NH2 3.28Å; E126-R271 IonicContact OE1-CZ 2.73Å; E126-R271 IonicContact OE1-NH1 3.39Å; E126-R271 PolarHBondContact OE1-NH1 3.11Å; E126-R271 IonicContact OE1-NH2 3.03Å; E126-R271 PolarHBondContact OE1-NH2 3.47Å; E126-R271 IonicContact OE2-NH2 2.77Å; E126-R271 PolarHBondContact OE2-NH2 3.36Å; P267-R271 WeakPolarHBondContact O-CB 3.25Å; P267-R271 PolarHBondContact O-N 2.93Å; H268-R271 PolarHBondContact O-N 2.97Å; I269-R271 VanDerWaalsContact C-N 3.32Å; I269-R271 PolarHBondContact O-N 3.41Å; R271-G275 PolarHBondContact O-N 3.05Å; R271-L284 HydrophobicContact CG-CB 4.13Å; R271-L284 HydrophobicContact CG-CD1 4.09Å; R271-L288 HydrophobicContact CB-CD1 3.47Å; R271-L288 VanDerWaalsContact CB-CD1 3.47Å; R271-L288 HydrophobicContact CG-CD1 3.8Å
272	K	91.4	Very high	90	Very high	142 Å²	142	59.8 Å²	59.8	62%	0.617	34%	0.336	S	S	*	.	H	α-helix	trans	-62.4	-46.5	176.5	-72.1	-179.9	-179.1	-178.2	0	111.4	H268 I269 Q270 G275 A276	H268-K272 WeakPolarHBondContact O-CG 3.45Å; H268-K272 PolarHBondContact O-N 3.38Å; I269-K272 PolarHBondContact O-N 3.13Å; Q270-K272 VanDerWaalsContact C-N 3.35Å; Q270-K272 PolarHBondContact O-N 3.3Å; K272-G275 PolarHBondContact O-N 3.34Å; K272-A276 PolarHBondContact O-N 3.32Å
273	R	92.1	Very high	89.8	Confident	132 Å²	132	55.1 Å²	55.1	50%	0.498	31%	0.311	S	S	.	.	H	α-helix	trans	-58.4	-52	177.7	179.4	-178.9	167.7	170.8	-1.4	112	I269 Q270 A276 D311	I269-R273 PolarHBondContact O-N 3.25Å; Q270-R273 PolarHBondContact O-N 2.92Å; R273-A276 WeakPolarHBondContact O-CB 2.84Å; R273-A276 PolarHBondContact O-N 3.48Å; R273-D311 VanDerWaalsContact CZ-CG 3.42Å; R273-D311 IonicContact CZ-OD1 2.78Å; R273-D311 IonicContact CZ-OD2 2.77Å; R273-D311 IonicContact NE-OD1 2.64Å; R273-D311 PolarHBondContact NE-OD1 3.5Å; R273-D311 IonicContact NH1-OD1 3.92Å; R273-D311 VanDerWaalsContact NH2-CB 3.34Å; R273-D311 IonicContact NH2-OD1 2.79Å; R273-D311 PolarHBondContact NH2-OD1 3.03Å; R273-D311 IonicContact NH2-OD2 3.93Å
274	W	93.4	Very high	89.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-74.7	-26.1	-178.1	-61.5	-18.5	0	0	0	113	Q270 A276 F277 L284 I287 L288 R303 Y306 A307 D311	Q270-W274 HydrophobicContact CB-CZ2 4.49Å; Q270-W274 WeakPolarHBondContact O-CB 2.73Å; Q270-W274 PolarHBondContact O-N 3.33Å; W274-A276 PolarHBondContact O-N 3.18Å; W274-F277 HydrophobicContact CB-CD2 4.24Å; W274-F277 AromaticContact CD1-CE2 3.71Å; W274-F277 HydrophobicContact CG-CE2 4.42Å; W274-F277 WeakPolarHBondContact O-CB 3.47Å; W274-F277 PolarHBondContact O-N 2.89Å; W274-F277 VanDerWaalsContact O-N 3.14Å; W274-L284 HydrophobicContact CB-CD2 3.54Å; W274-L284 HydrophobicContact CE3-CD2 4.43Å; W274-I287 HydrophobicContact CE3-CG2 4.27Å; W274-I287 HydrophobicContact CH2-CG2 4.24Å; W274-I287 HydrophobicContact CZ3-CB 4.43Å; W274-I287 HydrophobicContact CZ3-CG2 3.57Å; W274-L288 HydrophobicContact CE3-CD1 4.42Å; W274-L288 HydrophobicContact CE3-CD2 3.92Å; W274-L288 HydrophobicContact CE3-CG 4.04Å; W274-L288 HydrophobicContact CH2-CD2 3.94Å; W274-L288 HydrophobicContact CZ3-CD2 3.31Å; W274-L288 HydrophobicContact CZ3-CG 3.7Å; W274-R303 HydrophobicContact CH2-CG 3.95Å; W274-R303 HydrophobicContact CZ3-CG 4.49Å; W274-Y306 HydrophobicContact CB-CE1 4.45Å; W274-Y306 AromaticContact CD2-CD1 3.75Å; W274-Y306 HydrophobicContact CD2-CD1 3.75Å; W274-Y306 AromaticContact CD2-CE1 3.51Å; W274-Y306 HydrophobicContact CD2-CE1 3.51Å; W274-Y306 AromaticContact CE2-CD1 3.64Å; W274-Y306 AromaticContact CE2-CE1 3.66Å; W274-Y306 AromaticContact CE3-CD1 3.81Å; W274-Y306 HydrophobicContact CE3-CD1 3.81Å; W274-Y306 AromaticContact CE3-CE1 3.87Å; W274-Y306 HydrophobicContact CE3-CE1 3.87Å; W274-Y306 HydrophobicContact CG-CD1 4.48Å; W274-Y306 AromaticContact CG-CE1 3.78Å; W274-Y306 HydrophobicContact CG-CE1 3.78Å; W274-Y306 AromaticContact CH2-CD1 3.68Å; W274-Y306 HydrophobicContact CH2-CD1 3.68Å; W274-Y306 HydrophobicContact CH2-CE1 4.44Å; W274-Y306 AromaticContact CZ2-CD1 3.63Å; W274-Y306 HydrophobicContact CZ2-CD1 3.63Å; W274-Y306 HydrophobicContact CZ2-CE1 4.16Å; W274-Y306 AromaticContact CZ3-CD1 3.77Å; W274-Y306 HydrophobicContact CZ3-CD1 3.77Å; W274-Y306 HydrophobicContact CZ3-CE1 4.31Å; W274-Y306 AromaticContact NE1-CE1 3.95Å; W274-A307 HydrophobicContact CH2-CB 4.4Å; W274-A307 HydrophobicContact CZ2-CB 3.89Å; W274-D311 PolarHBondContact NE1-OD1 3.45Å; W274-D311 PolarHBondContact NE1-OD2 3.43Å
275	G	92.4	Very high	89.6	Confident	29 Å²	29	48.9 Å²	48.9	30%	0.299	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-29.8	170.1	0	0	0	0	0	113	R271 K272 F277 G278	R271-G275 PolarHBondContact O-N 3.05Å; K272-G275 PolarHBondContact O-N 3.34Å; G275-F277 PolarHBondContact O-N 2.72Å; G275-G278 PolarHBondContact O-N 3.03Å
276	A	94.2	Very high	89.5	Confident	87 Å²	87	46.6 Å²	46.6	72%	0.719	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.9	173.9	0	0	0	0	0	113.5	K272 R273 W274 G278	K272-A276 PolarHBondContact O-N 3.32Å; R273-A276 WeakPolarHBondContact O-CB 2.84Å; R273-A276 PolarHBondContact O-N 3.48Å; W274-A276 PolarHBondContact O-N 3.18Å; A276-G278 PolarHBondContact O-N 3.39Å
277	F	93.1	Very high	89.3	Confident	78 Å²	78	45.9 Å²	45.9	34%	0.342	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-2.1	171.1	-55.3	-45.3	0	0	0	113.4	W274 G275 V310 P317 H318	W274-F277 HydrophobicContact CB-CD2 4.24Å; W274-F277 AromaticContact CD1-CE2 3.71Å; W274-F277 HydrophobicContact CG-CE2 4.42Å; W274-F277 WeakPolarHBondContact O-CB 3.47Å; W274-F277 PolarHBondContact O-N 2.89Å; W274-F277 VanDerWaalsContact O-N 3.14Å; G275-F277 PolarHBondContact O-N 2.72Å; F277-V310 HydrophobicContact CD2-CG1 4.4Å; F277-V310 HydrophobicContact CE2-CG1 3.68Å; F277-V310 HydrophobicContact CZ-CG1 4.12Å; F277-P317 HydrophobicContact CB-CB 3.79Å; F277-P317 HydrophobicContact CB-CG 4.01Å; F277-P317 HydrophobicContact CD1-CG 3.99Å; F277-P317 HydrophobicContact CD2-CB 3.72Å; F277-P317 HydrophobicContact CD2-CG 3.77Å; F277-P317 HydrophobicContact CE1-CG 4.38Å; F277-P317 HydrophobicContact CE2-CB 4.44Å; F277-P317 HydrophobicContact CE2-CG 4.17Å; F277-P317 HydrophobicContact CG-CB 3.82Å; F277-P317 HydrophobicContact CG-CG 3.67Å; F277-P317 HydrophobicContact CZ-CG 4.46Å; F277-H318 PolarHBondContact O-NE2 2.97Å
278	G	92.9	Very high	89.1	Confident	53 Å²	53	45.8 Å²	45.8	55%	0.546	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	15.4	-178.3	0	0	0	0	0	114.3	G275 A276 H318	G275-G278 PolarHBondContact O-N 3.03Å; A276-G278 PolarHBondContact O-N 3.39Å; G278-H318 PolarHBondContact O-CE1 3.16Å
279	L	90.9	Very high	88.4	Confident	12 Å²	12	43.6 Å²	43.6	6%	0.063	25%	0.246	C	C	.	.			trans	-67.8	137.8	174.8	-76.5	175	0	0	0	111.4	L284 Y306 A321	L279-L284 HydrophobicContact CB-CD2 3.96Å; L279-L284 HydrophobicContact CB-CG 4.15Å; L279-L284 HydrophobicContact CD1-CD2 3.83Å; L279-Y306 HydrophobicContact CD1-CE2 4.39Å; L279-Y306 WeakPolarHBondContact CD1-OH 3.27Å; L279-A321 HydrophobicContact CD1-CB 4.37Å; L279-A321 HydrophobicContact CD2-CB 3.76Å
280	P	88.8	Confident	87.3	Confident	76 Å²	76	42.3 Å²	42.3	49%	0.494	24%	0.235	S	C	.	.			trans	-58.3	144.3	173.8	-24	33.4	0	0	0	112.3	S282 C283 L284	P280-S282 PolarHBondContact O-N 2.94Å; P280-S282 VanDerWaalsContact O-N 3.16Å; P280-C283 HydrophobicContact CB-CB 4.36Å; P280-C283 WeakPolarHBondContact O-CA 3.34Å; P280-C283 WeakPolarHBondContact O-CB 3.47Å; P280-C283 PolarHBondContact O-N 3.3Å; P280-L284 PolarHBondContact O-N 3.3Å; P280-L284 VanDerWaalsContact O-N 3.13Å
281	E	87.5	Confident	85.7	Confident	96 Å²	96	43.9 Å²	43.9	45%	0.449	24%	0.244	S	C	.	.	H	α-helix	trans	-57.7	-34.5	178.7	-67.3	-178.1	163.7	0	0	112.8	Y56 P66 C283 L284 C285	Y56-E281 HydrophobicContact CE1-CB 4.39Å; Y56-E281 HydrophobicContact CE1-CG 4.44Å; Y56-E281 WeakPolarHBondContact CE1-OE2 3.5Å; Y56-E281 PolarHBondContact OH-OE1 3.32Å; P66-E281 HydrophobicContact CG-CB 4.42Å; E281-C283 VanDerWaalsContact C-N 3.25Å; E281-C283 PolarHBondContact O-N 3.06Å; E281-L284 PolarHBondContact O-N 3.47Å; E281-C285 WeakPolarHBondContact O-CB 3.19Å; E281-C285 PolarHBondContact O-N 3.37Å; E281-C285 PolarHBondContact O-SG 2.76Å
282	S	85.8	Confident	83.7	Confident	39 Å²	39	45.5 Å²	45.5	27%	0.273	25%	0.254	S	S	.	.	H	α-helix	trans	-62.8	-32.4	175.2	63	0	0	0	0	112.7	P280 Q286	P280-S282 PolarHBondContact O-N 2.94Å; P280-S282 VanDerWaalsContact O-N 3.16Å; S282-Q286 VanDerWaalsContact O-CG 3.27Å; S282-Q286 WeakPolarHBondContact O-CG 3.49Å; S282-Q286 PolarHBondContact O-N 3.4Å; S282-Q286 PolarHBondContact O-NE2 2.82Å
283	C	87.4	Confident	81.4	Confident	13 Å²	13	41 Å²	41	9%	0.088	25%	0.248	C	C	.	.	H	α-helix	trans	-72.2	-45.8	174.5	180	0	0	0	0	110.5	P280 E281 C285 Q286 I287 A321 L325	P280-C283 HydrophobicContact CB-CB 4.36Å; P280-C283 WeakPolarHBondContact O-CA 3.34Å; P280-C283 WeakPolarHBondContact O-CB 3.47Å; P280-C283 PolarHBondContact O-N 3.3Å; E281-C283 VanDerWaalsContact C-N 3.25Å; E281-C283 PolarHBondContact O-N 3.06Å; C283-C285 PolarHBondContact O-N 3.34Å; C283-Q286 WeakPolarHBondContact O-CA 3.43Å; C283-Q286 WeakPolarHBondContact O-CB 3.28Å; C283-Q286 PolarHBondContact O-N 2.85Å; C283-I287 WeakPolarHBondContact O-CG1 3.43Å; C283-I287 PolarHBondContact O-N 3.36Å; C283-A321 VanDerWaalsContact SG-CB 3.57Å; C283-L325 HydrophobicContact CB-CD1 4.23Å; C283-L325 WeakPolarHBondContact SG-CD1 3.39Å
284	L	88.9	Confident	78.9	Confident	6 Å²	6	42 Å²	42	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-42.2	178.6	-62.2	174	0	0	0	112.6	R271 W274 L279 P280 E281 Q286 I287 L288	R271-L284 HydrophobicContact CG-CB 4.13Å; R271-L284 HydrophobicContact CG-CD1 4.09Å; W274-L284 HydrophobicContact CB-CD2 3.54Å; W274-L284 HydrophobicContact CE3-CD2 4.43Å; L279-L284 HydrophobicContact CB-CD2 3.96Å; L279-L284 HydrophobicContact CB-CG 4.15Å; L279-L284 HydrophobicContact CD1-CD2 3.83Å; P280-L284 PolarHBondContact O-N 3.3Å; P280-L284 VanDerWaalsContact O-N 3.13Å; E281-L284 PolarHBondContact O-N 3.47Å; L284-Q286 PolarHBondContact O-N 3.37Å; L284-I287 PolarHBondContact O-N 2.9Å; L284-L288 VanDerWaalsContact O-CB 3.32Å; L284-L288 WeakPolarHBondContact O-CB 3.31Å; L284-L288 WeakPolarHBondContact O-CG 3.3Å; L284-L288 PolarHBondContact O-N 2.95Å
285	C	84.6	Confident	76.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.6	-37	173.2	-69.2	0	0	0	0	111.2	Y56 Y58 E281 C283 I289 R290	Y56-C285 VanDerWaalsContact CB-SG 3.59Å; Y58-C285 HydrophobicContact CD1-CB 4.2Å; Y58-C285 HydrophobicContact CE1-CB 4.3Å; Y58-C285 HydrophobicContact CG-CB 4.39Å; E281-C285 WeakPolarHBondContact O-CB 3.19Å; E281-C285 PolarHBondContact O-N 3.37Å; E281-C285 PolarHBondContact O-SG 2.76Å; C283-C285 PolarHBondContact O-N 3.34Å; C285-I289 HydrophobicContact CB-CD1 4.47Å; C285-I289 WeakPolarHBondContact O-CB 3.39Å; C285-I289 PolarHBondContact O-N 2.9Å; C285-R290 PolarHBondContact O-N 3.4Å
286	Q	83.1	Confident	74.1	Confident	27 Å²	27	43.8 Å²	43.8	13%	0.126	25%	0.253	C	S	.	.	H	α-helix	trans	-67.9	-54.1	175.7	-71.4	176.6	78.9	0	0	112	Y60 S282 C283 L284 L288 R290 L325	Y60-Q286 HydrophobicContact CE1-CG 4.44Å; Y60-Q286 WeakPolarHBondContact OH-CG 3.48Å; Y60-Q286 PolarHBondContact OH-NE2 2.96Å; S282-Q286 VanDerWaalsContact O-CG 3.27Å; S282-Q286 WeakPolarHBondContact O-CG 3.49Å; S282-Q286 PolarHBondContact O-N 3.4Å; S282-Q286 PolarHBondContact O-NE2 2.82Å; C283-Q286 WeakPolarHBondContact O-CA 3.43Å; C283-Q286 WeakPolarHBondContact O-CB 3.28Å; C283-Q286 PolarHBondContact O-N 2.85Å; L284-Q286 PolarHBondContact O-N 3.37Å; Q286-L288 VanDerWaalsContact C-N 3.3Å; Q286-L288 PolarHBondContact O-N 3.42Å; Q286-R290 HydrophobicContact CB-CB 4.38Å; Q286-R290 WeakPolarHBondContact O-CA 3.39Å; Q286-R290 WeakPolarHBondContact O-CB 3.37Å; Q286-R290 PolarHBondContact O-N 2.75Å; Q286-L325 HydrophobicContact CB-CD1 4.03Å; Q286-L325 HydrophobicContact CB-CD2 3.42Å; Q286-L325 VanDerWaalsContact CB-CD2 3.42Å; Q286-L325 HydrophobicContact CB-CG 4.4Å; Q286-L325 HydrophobicContact CG-CD2 4.37Å
287	I	85	Confident	71.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-42.4	-174.3	-63.5	165.3	0	0	0	110.9	W274 C283 L284 R303 Y306 A321 L325	W274-I287 HydrophobicContact CE3-CG2 4.27Å; W274-I287 HydrophobicContact CH2-CG2 4.24Å; W274-I287 HydrophobicContact CZ3-CB 4.43Å; W274-I287 HydrophobicContact CZ3-CG2 3.57Å; C283-I287 WeakPolarHBondContact O-CG1 3.43Å; C283-I287 PolarHBondContact O-N 3.36Å; L284-I287 PolarHBondContact O-N 2.9Å; I287-R303 PolarHBondContact O-N 2.94Å; I287-Y306 HydrophobicContact CD1-CD2 3.72Å; I287-Y306 HydrophobicContact CD1-CE2 3.82Å; I287-Y306 HydrophobicContact CD1-CG 4.17Å; I287-Y306 HydrophobicContact CG1-CD2 4.5Å; I287-Y306 HydrophobicContact CG2-CD1 4.02Å; I287-Y306 HydrophobicContact CG2-CD2 4.23Å; I287-Y306 HydrophobicContact CG2-CG 3.64Å; I287-A321 HydrophobicContact CD1-CB 3.83Å; I287-L325 HydrophobicContact CD1-CD1 4.45Å; I287-L325 HydrophobicContact CG1-CD1 4.15Å; I287-L325 HydrophobicContact CG1-CD2 4.01Å; I287-L325 HydrophobicContact CG1-CG 4.15Å
288	L	82.7	Confident	69.5	Low	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-81.9	-45.2	-173.7	-71.1	165.5	0	0	0	113.9	Q270 R271 W274 L284 Q286 R303	Q270-L288 HydrophobicContact CB-CD2 3.88Å; R271-L288 HydrophobicContact CB-CD1 3.47Å; R271-L288 VanDerWaalsContact CB-CD1 3.47Å; R271-L288 HydrophobicContact CG-CD1 3.8Å; W274-L288 HydrophobicContact CE3-CD1 4.42Å; W274-L288 HydrophobicContact CE3-CD2 3.92Å; W274-L288 HydrophobicContact CE3-CG 4.04Å; W274-L288 HydrophobicContact CH2-CD2 3.94Å; W274-L288 HydrophobicContact CZ3-CD2 3.31Å; W274-L288 HydrophobicContact CZ3-CG 3.7Å; L284-L288 VanDerWaalsContact O-CB 3.32Å; L284-L288 WeakPolarHBondContact O-CB 3.31Å; L284-L288 WeakPolarHBondContact O-CG 3.3Å; L284-L288 PolarHBondContact O-N 2.95Å; Q286-L288 VanDerWaalsContact C-N 3.3Å; Q286-L288 PolarHBondContact O-N 3.42Å; L288-R303 HydrophobicContact CD2-CG 4.14Å
289	I	72.1	Confident	67.5	Low	5 Å²	5	45.2 Å²	45.2	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-110	-20.4	-165	-45.6	166.6	0	0	0	110.9	Y58 K125 E126 C285 N291	Y58-I289 HydrophobicContact CE1-CD1 4.04Å; Y58-I289 HydrophobicContact CE1-CG2 4.44Å; Y58-I289 WeakPolarHBondContact OH-CG2 3.16Å; K125-I289 HydrophobicContact CB-CG2 4.03Å; K125-I289 HydrophobicContact CD-CG2 3.58Å; K125-I289 WeakPolarHBondContact CE-O 3.22Å; K125-I289 HydrophobicContact CG-CG2 3.5Å; K125-I289 VanDerWaalsContact CG-CG2 3.5Å; K125-I289 PolarHBondContact NZ-O 3.29Å; E126-I289 WeakPolarHBondContact OE2-CD1 3.29Å; E126-I289 WeakPolarHBondContact OE2-CG1 3.48Å; C285-I289 HydrophobicContact CB-CD1 4.47Å; C285-I289 WeakPolarHBondContact O-CB 3.39Å; C285-I289 PolarHBondContact O-N 2.9Å; I289-N291 VanDerWaalsContact C-N 3.34Å; I289-N291 PolarHBondContact O-N 3.18Å
290	R	67.9	Low	66	Low	60 Å²	60	45.1 Å²	45.1	23%	0.226	24%	0.235	C	C	.	.			trans	-65.9	93.5	-174.2	-169.7	169.4	172.6	-170.6	-12.4	111.7	C285 Q286 D292	C285-R290 PolarHBondContact O-N 3.4Å; Q286-R290 HydrophobicContact CB-CB 4.38Å; Q286-R290 WeakPolarHBondContact O-CA 3.39Å; Q286-R290 WeakPolarHBondContact O-CB 3.37Å; Q286-R290 PolarHBondContact O-N 2.75Å; R290-D292 VanDerWaalsContact C-N 3.32Å; R290-D292 WeakPolarHBondContact CD-OD1 3.42Å; R290-D292 WeakPolarHBondContact CG-OD1 3.48Å; R290-D292 IonicContact CZ-OD1 3.92Å; R290-D292 IonicContact CZ-OD2 2.79Å; R290-D292 IonicContact NE-OD1 3.32Å; R290-D292 PolarHBondContact NE-OD1 3.11Å; R290-D292 IonicContact NE-OD2 3.33Å; R290-D292 PolarHBondContact NE-OD2 3.41Å; R290-D292 IonicContact NH2-OD1 2.82Å; R290-D292 IonicContact NH2-OD2 3.53Å; R290-D292 PolarHBondContact NH2-OD2 3.45Å; R290-D292 PolarHBondContact O-N 3.21Å
291	N	55.7	Low	65.2	Low	51 Å²	51	42.6 Å²	42.6	27%	0.273	22%	0.217	S	C	.	.			trans	-91.2	76.1	163.9	-153.1	-3.9	0	0	0	107.7	I289 G293	I289-N291 VanDerWaalsContact C-N 3.34Å; I289-N291 PolarHBondContact O-N 3.18Å; N291-G293 PolarHBondContact O-N 2.86Å
292	D	47.9	Very low	64.8	Low	49 Å²	49	38.9 Å²	38.9	26%	0.262	20%	0.2	S	C	.	.			trans	-65.1	99.1	161.4	-66.6	-2.5	0	0	0	105.1	R290 Y294 F295	R290-D292 VanDerWaalsContact C-N 3.32Å; R290-D292 WeakPolarHBondContact CD-OD1 3.42Å; R290-D292 WeakPolarHBondContact CG-OD1 3.48Å; R290-D292 IonicContact CZ-OD1 3.92Å; R290-D292 IonicContact CZ-OD2 2.79Å; R290-D292 IonicContact NE-OD1 3.32Å; R290-D292 PolarHBondContact NE-OD1 3.11Å; R290-D292 IonicContact NE-OD2 3.33Å; R290-D292 PolarHBondContact NE-OD2 3.41Å; R290-D292 IonicContact NH2-OD1 2.82Å; R290-D292 IonicContact NH2-OD2 3.53Å; R290-D292 PolarHBondContact NH2-OD2 3.45Å; R290-D292 PolarHBondContact O-N 3.21Å; D292-Y294 PolarHBondContact O-N 3.11Å; D292-F295 HydrophobicContact CB-CD2 4.35Å; D292-F295 PolarHBondContact O-N 2.84Å
293	G	43.2	Very low	64.7	Low	48 Å²	48	38.2 Å²	38.2	50%	0.495	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	13	172.2	0	0	0	0	0	114.3	N291 R336	N291-G293 PolarHBondContact O-N 2.86Å; G293-R336 PolarHBondContact O-NH2 2.82Å
294	Y	40.4	Very low	64.5	Low	152 Å²	152	40.1 Å²	40.1	60%	0.596	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-26	179.2	-75.3	-93.1	0	0	0	113.5	D292 R336	D292-Y294 PolarHBondContact O-N 3.11Å; Y294-R336 VanDerWaalsContact CE1-NH1 3.29Å; Y294-R336 PolarHBondContact O-NE 3.22Å; Y294-R336 VanDerWaalsContact O-NE 3.09Å
295	F	39.7	Very low	64.4	Low	40 Å²	40	40 Å²	40	18%	0.175	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-35.1	-168	-63.5	-62.7	0	0	0	116.2	D292 L332 K333 L352	D292-F295 HydrophobicContact CB-CD2 4.35Å; D292-F295 PolarHBondContact O-N 2.84Å; F295-L332 HydrophobicContact CB-CD1 4.11Å; F295-L332 HydrophobicContact CD1-CB 3.32Å; F295-L332 HydrophobicContact CD1-CD1 4.22Å; F295-L332 HydrophobicContact CD1-CG 4.4Å; F295-L332 HydrophobicContact CE1-CB 3.53Å; F295-L332 WeakPolarHBondContact CE1-O 3.39Å; F295-L332 HydrophobicContact CG-CB 4.05Å; F295-L332 HydrophobicContact CG-CD1 4.22Å; F295-L332 HydrophobicContact CZ-CB 4.37Å; F295-K333 HydrophobicContact CE1-CB 4.35Å; F295-K333 HydrophobicContact CZ-CB 3.85Å; F295-K333 HydrophobicContact CZ-CG 4.35Å; F295-L352 WeakPolarHBondContact O-CD2 3.46Å
296	F	44.5	Very low	64.7	Low	28 Å²	28	40 Å²	40	12%	0.123	20%	0.204	C	C	.	.			trans	-136.1	110.7	-179.8	-57	-66.2	0	0	0	108.2	D298 K301 Y305 L332	F296-D298 PolarHBondContact O-N 2.71Å; F296-K301 HydrophobicContact CB-CB 4.36Å; F296-K301 HydrophobicContact CB-CD 4.12Å; F296-K301 HydrophobicContact CB-CG 3.97Å; F296-K301 HydrophobicContact CD1-CB 4.26Å; F296-K301 HydrophobicContact CD1-CD 3.41Å; F296-K301 VanDerWaalsContact CD1-CD 3.41Å; F296-K301 HydrophobicContact CD1-CG 4.05Å; F296-K301 HydrophobicContact CD2-CB 4.01Å; F296-K301 HydrophobicContact CD2-CG 4.47Å; F296-K301 HydrophobicContact CE1-CD 3.88Å; F296-K301 HydrophobicContact CE2-CB 4.34Å; F296-K301 HydrophobicContact CG-CB 3.94Å; F296-K301 HydrophobicContact CG-CD 3.8Å; F296-K301 HydrophobicContact CG-CG 3.9Å; F296-Y305 HydrophobicContact CE2-CE2 4.22Å; F296-Y305 AromaticContact CZ-CE2 3.9Å; F296-Y305 HydrophobicContact CZ-CE2 3.9Å; F296-L332 HydrophobicContact CE1-CD1 4.47Å; F296-L332 HydrophobicContact CE2-CD1 3.85Å; F296-L332 HydrophobicContact CZ-CD1 3.57Å
297	K	45.9	Very low	65	Low	128 Å²	128	39.6 Å²	39.6	56%	0.557	21%	0.205	S	C	*	.	S	Bend	trans	-77.5	-5.9	177.6	-63.6	-175	171.7	-175.8	0	112.9	L352	K297-L352 HydrophobicContact CB-CD1 3.77Å; K297-L352 HydrophobicContact CD-CD1 4.45Å; K297-L352 HydrophobicContact CG-CD1 4.14Å
298	D	44.4	Very low	65.3	Low	52 Å²	52	43 Å²	43	28%	0.278	22%	0.218	S	C	.	.	S	Bend	trans	-133.6	110.9	-171.1	-43.7	-48.6	0	0	0	108.1	R140 F296 K301 L352	R140-D298 IonicContact CZ-OD1 2.91Å; R140-D298 IonicContact NH1-OD1 3.28Å; R140-D298 PolarHBondContact NH1-OD1 3.09Å; R140-D298 IonicContact NH2-OD1 3.52Å; R140-D298 PolarHBondContact NH2-OD1 2.95Å; F296-D298 PolarHBondContact O-N 2.71Å; D298-K301 VanDerWaalsContact O-CE 3.29Å; D298-K301 WeakPolarHBondContact O-CE 3.5Å; D298-K301 WeakPolarHBondContact O-CG 3.29Å; D298-L352 VanDerWaalsContact OD2-CD1 3.32Å; D298-L352 WeakPolarHBondContact OD2-CD1 3.45Å
299	V	50.3	Low	65.8	Low	68 Å²	68	43 Å²	43	41%	0.412	22%	0.218	S	C	.	.	S	Bend	trans	65.6	148.8	177.1	-170.2	0	0	0	0	113.4	I132 K301	I132-V299 HydrophobicContact CG2-CG1 4.37Å; I132-V299 HydrophobicContact CG2-CG2 4.46Å; V299-K301 PolarHBondContact O-N 3.16Å
300	P	59.7	Low	66.9	Low	9 Å²	9	43.3 Å²	43.3	6%	0.058	22%	0.22	C	C	.	.			trans	-65.1	79.6	165.3	-13.7	28.2	0	0	0	108.8	L302 R303 S304	P300-L302 PolarHBondContact O-N 2.93Å; P300-R303 HydrophobicContact CB-CB 4.03Å; P300-R303 WeakPolarHBondContact O-CA 3.31Å; P300-R303 VanDerWaalsContact O-CB 3.22Å; P300-R303 WeakPolarHBondContact O-CB 3.45Å; P300-R303 PolarHBondContact O-N 2.89Å; P300-S304 PolarHBondContact O-N 3.12Å
301	K	71.6	Confident	68	Low	24 Å²	24	42.2 Å²	42.2	10%	0.104	22%	0.219	C	C	.	.	H	α-helix	trans	-56.2	-28.9	-178.8	-64.4	-163.2	-165.2	171	0	111.5	F296 D298 V299 R303 S304 Y305 P354	F296-K301 HydrophobicContact CB-CB 4.36Å; F296-K301 HydrophobicContact CB-CD 4.12Å; F296-K301 HydrophobicContact CB-CG 3.97Å; F296-K301 HydrophobicContact CD1-CB 4.26Å; F296-K301 HydrophobicContact CD1-CD 3.41Å; F296-K301 VanDerWaalsContact CD1-CD 3.41Å; F296-K301 HydrophobicContact CD1-CG 4.05Å; F296-K301 HydrophobicContact CD2-CB 4.01Å; F296-K301 HydrophobicContact CD2-CG 4.47Å; F296-K301 HydrophobicContact CE1-CD 3.88Å; F296-K301 HydrophobicContact CE2-CB 4.34Å; F296-K301 HydrophobicContact CG-CB 3.94Å; F296-K301 HydrophobicContact CG-CD 3.8Å; F296-K301 HydrophobicContact CG-CG 3.9Å; D298-K301 VanDerWaalsContact O-CE 3.29Å; D298-K301 WeakPolarHBondContact O-CE 3.5Å; D298-K301 WeakPolarHBondContact O-CG 3.29Å; V299-K301 PolarHBondContact O-N 3.16Å; K301-R303 VanDerWaalsContact C-N 3.32Å; K301-R303 PolarHBondContact O-N 3.21Å; K301-S304 PolarHBondContact O-N 3.16Å; K301-S304 VanDerWaalsContact O-N 3.16Å; K301-Y305 HydrophobicContact CB-CD2 4.3Å; K301-Y305 HydrophobicContact CB-CE1 4.42Å; K301-Y305 HydrophobicContact CB-CE2 3.72Å; K301-Y305 WeakPolarHBondContact O-CB 3.45Å; K301-Y305 WeakPolarHBondContact O-CD2 3.47Å; K301-Y305 PolarHBondContact O-N 3.04Å; K301-P354 HydrophobicContact CD-CB 4.26Å; K301-P354 VanDerWaalsContact NZ-CB 3.31Å
302	L	80	Confident	69.8	Low	18 Å²	18	45.3 Å²	45.3	9%	0.094	24%	0.235	C	C	.	.	H	α-helix	trans	-54.5	-44.8	171.4	-173.1	64.1	0	0	0	112.8	P300 Y305 Y306 L324 L325	P300-L302 PolarHBondContact O-N 2.93Å; L302-Y305 PolarHBondContact O-N 3.19Å; L302-Y306 WeakPolarHBondContact O-CB 3.48Å; L302-Y306 PolarHBondContact O-N 3.13Å; L302-L324 HydrophobicContact CD1-CB 3.69Å; L302-L325 HydrophobicContact CD2-CD2 3.73Å
303	R	84.4	Confident	72.1	Confident	25 Å²	25	45.1 Å²	45.1	9%	0.094	24%	0.237	C	C	.	.	H	α-helix	trans	-60.1	-47.7	174.4	177	-174.7	173.5	-170.5	-3.1	110.9	P265 Q270 W274 I287 L288 P300 K301 Y306 A307	P265-R303 PolarHBondContact O-NH2 2.82Å; Q270-R303 VanDerWaalsContact NE2-NH2 3.11Å; W274-R303 HydrophobicContact CH2-CG 3.95Å; W274-R303 HydrophobicContact CZ3-CG 4.49Å; I287-R303 PolarHBondContact O-N 2.94Å; L288-R303 HydrophobicContact CD2-CG 4.14Å; P300-R303 HydrophobicContact CB-CB 4.03Å; P300-R303 WeakPolarHBondContact O-CA 3.31Å; P300-R303 VanDerWaalsContact O-CB 3.22Å; P300-R303 WeakPolarHBondContact O-CB 3.45Å; P300-R303 PolarHBondContact O-N 2.89Å; K301-R303 VanDerWaalsContact C-N 3.32Å; K301-R303 PolarHBondContact O-N 3.21Å; R303-Y306 PolarHBondContact O-N 2.82Å; R303-A307 VanDerWaalsContact O-CB 3.29Å; R303-A307 WeakPolarHBondContact O-CB 3.39Å; R303-A307 PolarHBondContact O-N 2.72Å
304	S	82	Confident	74.5	Confident	52 Å²	52	45.8 Å²	45.8	36%	0.364	25%	0.245	S	C	.	.	H	α-helix	trans	-66.2	-39.2	179.5	-56.1	0	0	0	0	112.5	P300 K301 Y308	P300-S304 PolarHBondContact O-N 3.12Å; K301-S304 PolarHBondContact O-N 3.16Å; K301-S304 VanDerWaalsContact O-N 3.16Å; S304-Y308 VanDerWaalsContact O-CB 3.28Å; S304-Y308 WeakPolarHBondContact O-CB 3.08Å; S304-Y308 PolarHBondContact O-N 2.81Å
305	Y	86.6	Confident	77.2	Confident	5 Å²	5	39.9 Å²	39.9	2%	0.02	22%	0.223	C	C	.	.	H	α-helix	trans	-65.2	-45.7	175.8	-65.7	-27.1	0	0	0	111.7	F296 K301 L302 Y308 C309 L328 L355 I360	F296-Y305 HydrophobicContact CE2-CE2 4.22Å; F296-Y305 AromaticContact CZ-CE2 3.9Å; F296-Y305 HydrophobicContact CZ-CE2 3.9Å; K301-Y305 HydrophobicContact CB-CD2 4.3Å; K301-Y305 HydrophobicContact CB-CE1 4.42Å; K301-Y305 HydrophobicContact CB-CE2 3.72Å; K301-Y305 WeakPolarHBondContact O-CB 3.45Å; K301-Y305 WeakPolarHBondContact O-CD2 3.47Å; K301-Y305 PolarHBondContact O-N 3.04Å; L302-Y305 PolarHBondContact O-N 3.19Å; Y305-Y308 PolarHBondContact O-N 3.28Å; Y305-C309 WeakPolarHBondContact O-CB 3.3Å; Y305-C309 PolarHBondContact O-N 3.37Å; Y305-C309 PolarHBondContact O-SG 2.71Å; Y305-L328 HydrophobicContact CD2-CD2 4.07Å; Y305-L328 HydrophobicContact CE2-CD2 4.29Å; Y305-L355 VanDerWaalsContact CE1-O 3.27Å; Y305-L355 WeakPolarHBondContact CE1-O 3.39Å; Y305-L355 VanDerWaalsContact CZ-O 3.24Å; Y305-L355 PolarHBondContact OH-O 3.15Å; Y305-I360 HydrophobicContact CD1-CB 4.13Å; Y305-I360 HydrophobicContact CD1-CG1 3.73Å; Y305-I360 HydrophobicContact CD1-CG2 4.33Å; Y305-I360 HydrophobicContact CD2-CD1 4.35Å; Y305-I360 HydrophobicContact CD2-CG1 4Å; Y305-I360 HydrophobicContact CD2-CG2 4.45Å; Y305-I360 HydrophobicContact CE1-CB 4.49Å; Y305-I360 HydrophobicContact CE1-CG1 3.68Å; Y305-I360 HydrophobicContact CE2-CD1 4.22Å; Y305-I360 HydrophobicContact CE2-CG1 3.98Å; Y305-I360 HydrophobicContact CG-CB 4.27Å; Y305-I360 HydrophobicContact CG-CG1 3.9Å; Y305-I360 HydrophobicContact CG-CG2 4Å
306	Y	91.1	Very high	79.8	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64	-47.2	177.9	-175.3	-87.6	0	0	0	111	W274 L279 I287 L302 R303 Y308 C309 V310 P317 C320 A321 L324	W274-Y306 HydrophobicContact CB-CE1 4.45Å; W274-Y306 AromaticContact CD2-CD1 3.75Å; W274-Y306 HydrophobicContact CD2-CD1 3.75Å; W274-Y306 AromaticContact CD2-CE1 3.51Å; W274-Y306 HydrophobicContact CD2-CE1 3.51Å; W274-Y306 AromaticContact CE2-CD1 3.64Å; W274-Y306 AromaticContact CE2-CE1 3.66Å; W274-Y306 AromaticContact CE3-CD1 3.81Å; W274-Y306 HydrophobicContact CE3-CD1 3.81Å; W274-Y306 AromaticContact CE3-CE1 3.87Å; W274-Y306 HydrophobicContact CE3-CE1 3.87Å; W274-Y306 HydrophobicContact CG-CD1 4.48Å; W274-Y306 AromaticContact CG-CE1 3.78Å; W274-Y306 HydrophobicContact CG-CE1 3.78Å; W274-Y306 AromaticContact CH2-CD1 3.68Å; W274-Y306 HydrophobicContact CH2-CD1 3.68Å; W274-Y306 HydrophobicContact CH2-CE1 4.44Å; W274-Y306 AromaticContact CZ2-CD1 3.63Å; W274-Y306 HydrophobicContact CZ2-CD1 3.63Å; W274-Y306 HydrophobicContact CZ2-CE1 4.16Å; W274-Y306 AromaticContact CZ3-CD1 3.77Å; W274-Y306 HydrophobicContact CZ3-CD1 3.77Å; W274-Y306 HydrophobicContact CZ3-CE1 4.31Å; W274-Y306 AromaticContact NE1-CE1 3.95Å; L279-Y306 HydrophobicContact CD1-CE2 4.39Å; L279-Y306 WeakPolarHBondContact CD1-OH 3.27Å; I287-Y306 HydrophobicContact CD1-CD2 3.72Å; I287-Y306 HydrophobicContact CD1-CE2 3.82Å; I287-Y306 HydrophobicContact CD1-CG 4.17Å; I287-Y306 HydrophobicContact CG1-CD2 4.5Å; I287-Y306 HydrophobicContact CG2-CD1 4.02Å; I287-Y306 HydrophobicContact CG2-CD2 4.23Å; I287-Y306 HydrophobicContact CG2-CG 3.64Å; L302-Y306 WeakPolarHBondContact O-CB 3.48Å; L302-Y306 PolarHBondContact O-N 3.13Å; R303-Y306 PolarHBondContact O-N 2.82Å; Y306-Y308 PolarHBondContact O-N 2.77Å; Y306-C309 PolarHBondContact O-N 2.88Å; Y306-V310 HydrophobicContact CD1-CG2 4.34Å; Y306-V310 HydrophobicContact CD2-CG2 4.22Å; Y306-V310 HydrophobicContact CE1-CB 4.11Å; Y306-V310 HydrophobicContact CE1-CG1 4.38Å; Y306-V310 HydrophobicContact CE1-CG2 3.92Å; Y306-V310 HydrophobicContact CE2-CG2 3.78Å; Y306-V310 HydrophobicContact CG-CG2 4.47Å; Y306-V310 WeakPolarHBondContact O-CB 3.37Å; Y306-V310 PolarHBondContact O-N 2.88Å; Y306-P317 WeakPolarHBondContact OH-CB 3.32Å; Y306-P317 PolarHBondContact OH-O 3.24Å; Y306-C320 HydrophobicContact CD2-CB 4.27Å; Y306-C320 HydrophobicContact CE2-CB 4.05Å; Y306-A321 HydrophobicContact CE2-CB 3.89Å; Y306-L324 HydrophobicContact CD2-CD1 4.09Å
307	A	90.4	Very high	82.2	Confident	17 Å²	17	41.7 Å²	41.7	14%	0.14	24%	0.237	C	C	.	.	H	α-helix	trans	-56.2	-48.7	174.5	0	0	0	0	0	111.3	W274 R303 C309 V310 D311 D312	W274-A307 HydrophobicContact CH2-CB 4.4Å; W274-A307 HydrophobicContact CZ2-CB 3.89Å; R303-A307 VanDerWaalsContact O-CB 3.29Å; R303-A307 WeakPolarHBondContact O-CB 3.39Å; R303-A307 PolarHBondContact O-N 2.72Å; A307-C309 PolarHBondContact O-N 3.05Å; A307-V310 PolarHBondContact O-N 3.33Å; A307-D311 VanDerWaalsContact O-CA 3.3Å; A307-D311 WeakPolarHBondContact O-CA 3.13Å; A307-D311 WeakPolarHBondContact O-CB 3.42Å; A307-D311 PolarHBondContact O-N 3.06Å; A307-D312 PolarHBondContact O-N 3.04Å
308	Y	90.3	Very high	84.6	Confident	71 Å²	71	39.7 Å²	39.7	28%	0.278	23%	0.23	S	C	.	.	I	π-helix	trans	-62.4	-43.2	179	-174.1	-102.1	0	0	0	112.6	S304 Y305 Y306 D312 C313 S357 F361	S304-Y308 VanDerWaalsContact O-CB 3.28Å; S304-Y308 WeakPolarHBondContact O-CB 3.08Å; S304-Y308 PolarHBondContact O-N 2.81Å; Y305-Y308 PolarHBondContact O-N 3.28Å; Y306-Y308 PolarHBondContact O-N 2.77Å; Y308-D312 HydrophobicContact CD2-CB 4.04Å; Y308-D312 VanDerWaalsContact CD2-OD2 3.3Å; Y308-D312 WeakPolarHBondContact CD2-OD2 3.5Å; Y308-D312 HydrophobicContact CE2-CB 4.44Å; Y308-D312 WeakPolarHBondContact O-CB 3.38Å; Y308-D312 PolarHBondContact O-N 3.38Å; Y308-C313 WeakPolarHBondContact O-CB 3.14Å; Y308-C313 PolarHBondContact O-N 3.32Å; Y308-C313 PolarHBondContact O-SG 3.19Å; Y308-S357 VanDerWaalsContact CD1-O 3.29Å; Y308-S357 WeakPolarHBondContact CD1-O 3.4Å; Y308-S357 WeakPolarHBondContact CE1-O 3.5Å; Y308-F361 HydrophobicContact CD1-CB 3.9Å; Y308-F361 HydrophobicContact CE1-CB 3.64Å; Y308-F361 HydrophobicContact CE1-CG 4.2Å
309	C	93.3	Very high	86.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.22	C	C	.	.	I	π-helix	trans	-66.7	-44.6	179.8	-69.1	0	0	0	0	112.3	Y305 Y306 A307 C313 G314 L315	Y305-C309 WeakPolarHBondContact O-CB 3.3Å; Y305-C309 PolarHBondContact O-N 3.37Å; Y305-C309 PolarHBondContact O-SG 2.71Å; Y306-C309 PolarHBondContact O-N 2.88Å; A307-C309 PolarHBondContact O-N 3.05Å; C309-C313 CarbonylContact O-C 3.54Å; C309-C313 WeakPolarHBondContact O-CB 3.01Å; C309-G314 PolarHBondContact O-N 3.42Å; C309-L315 HydrophobicContact CB-CD1 4.06Å; C309-L315 VanDerWaalsContact O-CB 3.3Å; C309-L315 WeakPolarHBondContact O-CB 3.41Å; C309-L315 WeakPolarHBondContact O-CG 3.09Å; C309-L315 PolarHBondContact O-N 3.19Å
310	V	94.9	Very high	89	Confident	12 Å²	12	34.4 Å²	34.4	7%	0.073	20%	0.201	C	C	.	.	I	π-helix	trans	-94	-50.9	-170.8	176.9	0	0	0	0	111.9	F277 Y306 A307 G314 P317 C320	F277-V310 HydrophobicContact CD2-CG1 4.4Å; F277-V310 HydrophobicContact CE2-CG1 3.68Å; F277-V310 HydrophobicContact CZ-CG1 4.12Å; Y306-V310 HydrophobicContact CD1-CG2 4.34Å; Y306-V310 HydrophobicContact CD2-CG2 4.22Å; Y306-V310 HydrophobicContact CE1-CB 4.11Å; Y306-V310 HydrophobicContact CE1-CG1 4.38Å; Y306-V310 HydrophobicContact CE1-CG2 3.92Å; Y306-V310 HydrophobicContact CE2-CG2 3.78Å; Y306-V310 HydrophobicContact CG-CG2 4.47Å; Y306-V310 WeakPolarHBondContact O-CB 3.37Å; Y306-V310 PolarHBondContact O-N 2.88Å; A307-V310 PolarHBondContact O-N 3.33Å; V310-G314 WeakPolarHBondContact O-CA 3.47Å; V310-G314 PolarHBondContact O-N 2.99Å; V310-P317 HydrophobicContact CG1-CB 4.3Å; V310-P317 HydrophobicContact CG1-CG 3.93Å; V310-C320 HydrophobicContact CG2-CB 3.82Å
311	D	92.8	Very high	90.6	Very high	38 Å²	38	34.1 Å²	34.1	20%	0.203	20%	0.199	C	C	.	.	I	π-helix	trans	-79	-42.3	-175.4	-60.9	-37.8	0	0	0	112	R273 W274 A307	R273-D311 VanDerWaalsContact CZ-CG 3.42Å; R273-D311 IonicContact CZ-OD1 2.78Å; R273-D311 IonicContact CZ-OD2 2.77Å; R273-D311 IonicContact NE-OD1 2.64Å; R273-D311 PolarHBondContact NE-OD1 3.5Å; R273-D311 IonicContact NH1-OD1 3.92Å; R273-D311 VanDerWaalsContact NH2-CB 3.34Å; R273-D311 IonicContact NH2-OD1 2.79Å; R273-D311 PolarHBondContact NH2-OD1 3.03Å; R273-D311 IonicContact NH2-OD2 3.93Å; W274-D311 PolarHBondContact NE1-OD1 3.45Å; W274-D311 PolarHBondContact NE1-OD2 3.43Å; A307-D311 VanDerWaalsContact O-CA 3.3Å; A307-D311 WeakPolarHBondContact O-CA 3.13Å; A307-D311 WeakPolarHBondContact O-CB 3.42Å; A307-D311 PolarHBondContact O-N 3.06Å
312	D	93.1	Very high	91.5	Very high	115 Å²	115	38.8 Å²	38.8	62%	0.615	22%	0.222	S	C	*	.	I	π-helix	trans	-90.1	-35	-176	-55.6	-19.1	0	0	0	112.7	A307 Y308	A307-D312 PolarHBondContact O-N 3.04Å; Y308-D312 HydrophobicContact CD2-CB 4.04Å; Y308-D312 VanDerWaalsContact CD2-OD2 3.3Å; Y308-D312 WeakPolarHBondContact CD2-OD2 3.5Å; Y308-D312 HydrophobicContact CE2-CB 4.44Å; Y308-D312 WeakPolarHBondContact O-CB 3.38Å; Y308-D312 PolarHBondContact O-N 3.38Å
313	C	95	Very high	92	Very high	45 Å²	45	38.2 Å²	38.2	30%	0.304	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-7.6	-174.6	-57.1	0	0	0	0	114.9	Y308 C309 L315 F361	Y308-C313 WeakPolarHBondContact O-CB 3.14Å; Y308-C313 PolarHBondContact O-N 3.32Å; Y308-C313 PolarHBondContact O-SG 3.19Å; C309-C313 CarbonylContact O-C 3.54Å; C309-C313 WeakPolarHBondContact O-CB 3.01Å; C313-L315 PolarHBondContact O-N 2.87Å; C313-F361 HydrophobicContact CB-CD2 3.55Å; C313-F361 HydrophobicContact CB-CE2 3.32Å; C313-F361 HydrophobicContact CB-CG 4.49Å; C313-F361 HydrophobicContact CB-CZ 4.11Å
314	G	94.7	Very high	92.2	Very high	63 Å²	63	37 Å²	37	65%	0.649	21%	0.214	S	C	*	.			trans	68.9	28.1	175.3	0	0	0	0	0	115.6	C309 V310	C309-G314 PolarHBondContact O-N 3.42Å; V310-G314 WeakPolarHBondContact O-CA 3.47Å; V310-G314 PolarHBondContact O-N 2.99Å
315	L	95.5	Very high	92.3	Very high	27 Å²	27	35.3 Å²	35.3	14%	0.141	20%	0.201	C	C	.	.			trans	-73.8	158.7	173.8	-64.1	-174.5	0	0	0	112.3	C309 C313 P317 C320 F361 V364 K365 L368	C309-L315 HydrophobicContact CB-CD1 4.06Å; C309-L315 VanDerWaalsContact O-CB 3.3Å; C309-L315 WeakPolarHBondContact O-CB 3.41Å; C309-L315 WeakPolarHBondContact O-CG 3.09Å; C309-L315 PolarHBondContact O-N 3.19Å; C313-L315 PolarHBondContact O-N 2.87Å; L315-P317 WeakPolarHBondContact O-CD 3.38Å; L315-C320 WeakPolarHBondContact CB-SG 3.47Å; L315-F361 HydrophobicContact CD1-CD2 3.6Å; L315-F361 HydrophobicContact CD1-CE2 3.72Å; L315-F361 HydrophobicContact CD2-CE2 3.87Å; L315-F361 HydrophobicContact CG-CD2 4.07Å; L315-F361 HydrophobicContact CG-CE2 3.77Å; L315-V364 HydrophobicContact CD1-CB 4.42Å; L315-V364 HydrophobicContact CD1-CG1 3.98Å; L315-K365 HydrophobicContact CD1-CB 4.19Å; L315-K365 HydrophobicContact CD2-CB 4.31Å; L315-K365 HydrophobicContact CD2-CG 4.29Å; L315-L368 HydrophobicContact CB-CD1 4.2Å; L315-L368 HydrophobicContact CD1-CD1 4.22Å
316	D	95.3	Very high	92.2	Very high	84 Å²	84	38.4 Å²	38.4	45%	0.449	22%	0.217	S	C	.	.			trans	-55.8	119.5	178	173.2	50.8	0	0	0	111.9	H318 G319 C320	D316-H318 PolarHBondContact O-N 3.13Å; D316-G319 WeakPolarHBondContact OD2-CA 3.5Å; D316-G319 PolarHBondContact OD2-N 3Å; D316-C320 VanDerWaalsContact O-CB 3.25Å; D316-C320 WeakPolarHBondContact O-CB 3.32Å; D316-C320 PolarHBondContact O-N 3.16Å; D316-C320 PolarHBondContact O-SG 2.99Å
317	P	95.6	Very high	91.9	Very high	22 Å²	22	39 Å²	39	14%	0.143	22%	0.221	C	C	.	.	H	α-helix	trans	-57.3	-43.9	-177.8	-28	35.3	0	0	0	114.3	F277 Y306 V310 L315 A321	F277-P317 HydrophobicContact CB-CB 3.79Å; F277-P317 HydrophobicContact CB-CG 4.01Å; F277-P317 HydrophobicContact CD1-CG 3.99Å; F277-P317 HydrophobicContact CD2-CB 3.72Å; F277-P317 HydrophobicContact CD2-CG 3.77Å; F277-P317 HydrophobicContact CE1-CG 4.38Å; F277-P317 HydrophobicContact CE2-CB 4.44Å; F277-P317 HydrophobicContact CE2-CG 4.17Å; F277-P317 HydrophobicContact CG-CB 3.82Å; F277-P317 HydrophobicContact CG-CG 3.67Å; F277-P317 HydrophobicContact CZ-CG 4.46Å; Y306-P317 WeakPolarHBondContact OH-CB 3.32Å; Y306-P317 PolarHBondContact OH-O 3.24Å; V310-P317 HydrophobicContact CG1-CB 4.3Å; V310-P317 HydrophobicContact CG1-CG 3.93Å; L315-P317 WeakPolarHBondContact O-CD 3.38Å; P317-A321 WeakPolarHBondContact O-CB 3.28Å; P317-A321 PolarHBondContact O-N 3.39Å
318	H	95	Very high	91.4	Very high	87 Å²	87	38.4 Å²	38.4	40%	0.403	22%	0.215	S	C	.	.	H	α-helix	trans	-69.6	-50.8	-174.6	-79	-85.2	0	0	0	111.8	F277 G278 D316 C320 A321 E322	F277-H318 PolarHBondContact O-NE2 2.97Å; G278-H318 PolarHBondContact O-CE1 3.16Å; D316-H318 PolarHBondContact O-N 3.13Å; H318-C320 VanDerWaalsContact C-N 3.35Å; H318-C320 PolarHBondContact O-N 3.37Å; H318-A321 WeakPolarHBondContact O-CB 3.39Å; H318-A321 PolarHBondContact O-N 3.04Å; H318-E322 PolarHBondContact O-N 3.25Å
319	G	94.2	Very high	90.7	Very high	8 Å²	8	36.2 Å²	36.2	8%	0.082	21%	0.21	C	C	.	.	H	α-helix	trans	-64.8	-38.1	177.7	0	0	0	0	0	112.3	D316 A321 E322 I323	D316-G319 WeakPolarHBondContact OD2-CA 3.5Å; D316-G319 PolarHBondContact OD2-N 3Å; G319-A321 PolarHBondContact O-N 3.08Å; G319-E322 PolarHBondContact O-N 3.43Å; G319-I323 WeakPolarHBondContact O-CB 3.25Å; G319-I323 WeakPolarHBondContact O-CD1 3.44Å; G319-I323 VanDerWaalsContact O-CG1 3.25Å; G319-I323 WeakPolarHBondContact O-CG1 3.39Å; G319-I323 PolarHBondContact O-N 3.39Å
320	C	94.3	Very high	89.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-47.8	173.2	-75.4	0	0	0	0	111.5	Y306 V310 L315 D316 H318 E322 I323 L324 V364	Y306-C320 HydrophobicContact CD2-CB 4.27Å; Y306-C320 HydrophobicContact CE2-CB 4.05Å; V310-C320 HydrophobicContact CG2-CB 3.82Å; L315-C320 WeakPolarHBondContact CB-SG 3.47Å; D316-C320 VanDerWaalsContact O-CB 3.25Å; D316-C320 WeakPolarHBondContact O-CB 3.32Å; D316-C320 PolarHBondContact O-N 3.16Å; D316-C320 PolarHBondContact O-SG 2.99Å; H318-C320 VanDerWaalsContact C-N 3.35Å; H318-C320 PolarHBondContact O-N 3.37Å; C320-E322 PolarHBondContact O-N 3.44Å; C320-I323 PolarHBondContact O-N 3.07Å; C320-L324 VanDerWaalsContact O-CB 3.24Å; C320-L324 WeakPolarHBondContact O-CB 3.31Å; C320-L324 VanDerWaalsContact O-CG 3.23Å; C320-L324 WeakPolarHBondContact O-CG 3.32Å; C320-L324 PolarHBondContact O-N 3.49Å; C320-V364 HydrophobicContact CB-CG1 4.41Å
321	A	92.4	Very high	88.7	Confident	3 Å²	3	42.7 Å²	42.7	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-59.8	-46.2	177.5	0	0	0	0	0	111.8	L279 C283 I287 Y306 P317 H318 G319 L324 L325	L279-A321 HydrophobicContact CD1-CB 4.37Å; L279-A321 HydrophobicContact CD2-CB 3.76Å; C283-A321 VanDerWaalsContact SG-CB 3.57Å; I287-A321 HydrophobicContact CD1-CB 3.83Å; Y306-A321 HydrophobicContact CE2-CB 3.89Å; P317-A321 WeakPolarHBondContact O-CB 3.28Å; P317-A321 PolarHBondContact O-N 3.39Å; H318-A321 WeakPolarHBondContact O-CB 3.39Å; H318-A321 PolarHBondContact O-N 3.04Å; G319-A321 PolarHBondContact O-N 3.08Å; A321-L324 PolarHBondContact O-N 3.06Å; A321-L325 WeakPolarHBondContact O-CB 3.46Å; A321-L325 WeakPolarHBondContact O-CG 3.39Å; A321-L325 PolarHBondContact O-N 3.41Å
322	E	91	Very high	87.5	Confident	123 Å²	123	42.3 Å²	42.3	58%	0.575	23%	0.231	S	C	*	.	H	α-helix	trans	-59.1	-50.4	178.8	-170.5	-172.9	169.2	0	0	111.7	H318 G319 C320 L325 N326	H318-E322 PolarHBondContact O-N 3.25Å; G319-E322 PolarHBondContact O-N 3.43Å; C320-E322 PolarHBondContact O-N 3.44Å; E322-L325 PolarHBondContact O-N 3.24Å; E322-N326 VanDerWaalsContact O-CB 3.22Å; E322-N326 WeakPolarHBondContact O-CB 3.43Å; E322-N326 PolarHBondContact O-N 3.18Å; E322-N326 PolarHBondContact O-ND2 3.42Å
323	I	90.7	Very high	86.2	Confident	6 Å²	6	44.5 Å²	44.5	3%	0.031	24%	0.235	C	C	.	.	I	π-helix	trans	-63.7	-47	-178.6	-67	163.3	0	0	0	110.5	G319 C320 L325 D327 L328 V364 R367 L368 F377	G319-I323 WeakPolarHBondContact O-CB 3.25Å; G319-I323 WeakPolarHBondContact O-CD1 3.44Å; G319-I323 VanDerWaalsContact O-CG1 3.25Å; G319-I323 WeakPolarHBondContact O-CG1 3.39Å; G319-I323 PolarHBondContact O-N 3.39Å; C320-I323 PolarHBondContact O-N 3.07Å; I323-L325 PolarHBondContact O-N 3.14Å; I323-D327 HydrophobicContact CG2-CB 4.31Å; I323-D327 WeakPolarHBondContact O-CA 3.33Å; I323-D327 WeakPolarHBondContact O-CB 3.05Å; I323-D327 PolarHBondContact O-N 2.77Å; I323-L328 PolarHBondContact O-N 3.29Å; I323-L328 VanDerWaalsContact O-N 3.09Å; I323-V364 HydrophobicContact CD1-CG1 4.16Å; I323-V364 HydrophobicContact CG2-CG2 4.07Å; I323-R367 HydrophobicContact CD1-CB 3.88Å; I323-R367 HydrophobicContact CD1-CG 3.53Å; I323-R367 HydrophobicContact CG1-CG 3.76Å; I323-R367 HydrophobicContact CG2-CG 4.22Å; I323-L368 HydrophobicContact CD1-CD2 3.56Å; I323-L368 HydrophobicContact CD1-CG 3.63Å; I323-F377 HydrophobicContact CG2-CD2 4.35Å; I323-F377 HydrophobicContact CG2-CE1 4.32Å; I323-F377 HydrophobicContact CG2-CE2 3.69Å; I323-F377 HydrophobicContact CG2-CZ 3.69Å
324	L	87.7	Confident	84.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.253	C	S	.	.	I	π-helix	trans	-70.7	-29	-176.7	-70.4	176.4	0	0	0	113	L302 Y306 C320 A321 L328 P329 I360 V364	L302-L324 HydrophobicContact CD1-CB 3.69Å; Y306-L324 HydrophobicContact CD2-CD1 4.09Å; C320-L324 VanDerWaalsContact O-CB 3.24Å; C320-L324 WeakPolarHBondContact O-CB 3.31Å; C320-L324 VanDerWaalsContact O-CG 3.23Å; C320-L324 WeakPolarHBondContact O-CG 3.32Å; C320-L324 PolarHBondContact O-N 3.49Å; A321-L324 PolarHBondContact O-N 3.06Å; L324-L328 HydrophobicContact CD2-CD2 3.85Å; L324-P329 WeakPolarHBondContact O-CD 3.32Å; L324-I360 HydrophobicContact CD2-CG2 3.82Å; L324-V364 HydrophobicContact CD2-CG2 3.89Å; L324-V364 HydrophobicContact CG-CG2 4.25Å
325	L	84.7	Confident	82.5	Confident	16 Å²	16	52.9 Å²	52.9	8%	0.084	24%	0.244	C	C	.	.	I	π-helix	trans	-87.4	-30	177.9	-68.5	-178.9	0	0	0	114	C283 Q286 I287 L302 A321 E322 I323 P329	C283-L325 HydrophobicContact CB-CD1 4.23Å; C283-L325 WeakPolarHBondContact SG-CD1 3.39Å; Q286-L325 HydrophobicContact CB-CD1 4.03Å; Q286-L325 HydrophobicContact CB-CD2 3.42Å; Q286-L325 VanDerWaalsContact CB-CD2 3.42Å; Q286-L325 HydrophobicContact CB-CG 4.4Å; Q286-L325 HydrophobicContact CG-CD2 4.37Å; I287-L325 HydrophobicContact CD1-CD1 4.45Å; I287-L325 HydrophobicContact CG1-CD1 4.15Å; I287-L325 HydrophobicContact CG1-CD2 4.01Å; I287-L325 HydrophobicContact CG1-CG 4.15Å; L302-L325 HydrophobicContact CD2-CD2 3.73Å; A321-L325 WeakPolarHBondContact O-CB 3.46Å; A321-L325 WeakPolarHBondContact O-CG 3.39Å; A321-L325 PolarHBondContact O-N 3.41Å; E322-L325 PolarHBondContact O-N 3.24Å; I323-L325 PolarHBondContact O-N 3.14Å; L325-P329 WeakPolarHBondContact O-CG 3.48Å
326	N	84.4	Confident	80.4	Confident	69 Å²	69	56 Å²	56	37%	0.369	25%	0.254	S	S	.	.	I	π-helix	trans	-105.6	-52.6	-174.4	-64	-46.4	0	0	0	112.8	E322 R330	E322-N326 VanDerWaalsContact O-CB 3.22Å; E322-N326 WeakPolarHBondContact O-CB 3.43Å; E322-N326 PolarHBondContact O-N 3.18Å; E322-N326 PolarHBondContact O-ND2 3.42Å; N326-R330 WeakPolarHBondContact O-CD 3.24Å; N326-R330 WeakPolarHBondContact O-CG 3.33Å
327	D	84.8	Confident	78.4	Confident	14 Å²	14	60.2 Å²	60.2	8%	0.075	27%	0.271	C	S	.	.	I	π-helix	trans	-80.5	-43.4	-171.1	-73.1	-7.8	0	0	0	111.4	I323 R330 A331 R367 F377	I323-D327 HydrophobicContact CG2-CB 4.31Å; I323-D327 WeakPolarHBondContact O-CA 3.33Å; I323-D327 WeakPolarHBondContact O-CB 3.05Å; I323-D327 PolarHBondContact O-N 2.77Å; D327-R330 PolarHBondContact O-N 3.41Å; D327-A331 PolarHBondContact O-N 3.14Å; D327-R367 IonicContact OD2-CZ 2.73Å; D327-R367 IonicContact OD2-NE 3.75Å; D327-R367 PolarHBondContact OD2-NE 3.46Å; D327-R367 IonicContact OD2-NH2 2.94Å; D327-F377 HydrophobicContact CB-CD1 3.79Å; D327-F377 HydrophobicContact CB-CE1 3.8Å
328	L	80.4	Confident	76.4	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-62.3	-50.9	-178.8	178.4	66.5	0	0	0	113	Y305 I323 L324 R330 A331 L332 L355 I360 F377	Y305-L328 HydrophobicContact CD2-CD2 4.07Å; Y305-L328 HydrophobicContact CE2-CD2 4.29Å; I323-L328 PolarHBondContact O-N 3.29Å; I323-L328 VanDerWaalsContact O-N 3.09Å; L324-L328 HydrophobicContact CD2-CD2 3.85Å; L328-R330 VanDerWaalsContact C-N 3.27Å; L328-R330 PolarHBondContact O-N 2.84Å; L328-A331 WeakPolarHBondContact O-CB 3.16Å; L328-A331 PolarHBondContact O-N 3.42Å; L328-A331 VanDerWaalsContact O-N 3.12Å; L328-L332 HydrophobicContact CD1-CD1 3.93Å; L328-L332 HydrophobicContact CD1-CG 4.16Å; L328-L332 HydrophobicContact CG-CD1 4.06Å; L328-L332 WeakPolarHBondContact O-CG 3.34Å; L328-L332 PolarHBondContact O-N 3.27Å; L328-L332 VanDerWaalsContact O-N 3.07Å; L328-L355 HydrophobicContact CD1-CD1 3.96Å; L328-I360 HydrophobicContact CD1-CD1 4.09Å; L328-I360 HydrophobicContact CD2-CD1 4.47Å; L328-F377 HydrophobicContact CB-CE1 4.31Å; L328-F377 HydrophobicContact CB-CZ 4.46Å
329	P	74.2	Confident	74.4	Confident	25 Å²	25	62 Å²	62	16%	0.162	28%	0.282	C	S	.	.	H	α-helix	trans	-63.6	-33.9	179.1	-24.6	37.7	0	0	0	112.4	L324 L325 L332 K333	L324-P329 WeakPolarHBondContact O-CD 3.32Å; L325-P329 WeakPolarHBondContact O-CG 3.48Å; P329-L332 PolarHBondContact O-N 2.84Å; P329-K333 WeakPolarHBondContact O-CB 3.28Å; P329-K333 PolarHBondContact O-N 2.95Å
330	R	74.7	Confident	72.6	Confident	144 Å²	144	69 Å²	69	54%	0.543	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-39.3	174.8	-72.9	175.2	-173	178.1	2.3	112	N326 D327 L328 L332	N326-R330 WeakPolarHBondContact O-CD 3.24Å; N326-R330 WeakPolarHBondContact O-CG 3.33Å; D327-R330 PolarHBondContact O-N 3.41Å; L328-R330 VanDerWaalsContact C-N 3.27Å; L328-R330 PolarHBondContact O-N 2.84Å; R330-L332 VanDerWaalsContact C-N 3.32Å
331	A	72.1	Confident	71.1	Confident	3 Å²	3	77.4 Å²	77.4	3%	0.025	34%	0.342	C	S	.	.	H	α-helix	trans	-60.1	-45.6	174.6	0	0	0	0	0	111	D327 L328 R378 C381 S382	D327-A331 PolarHBondContact O-N 3.14Å; L328-A331 WeakPolarHBondContact O-CB 3.16Å; L328-A331 PolarHBondContact O-N 3.42Å; L328-A331 VanDerWaalsContact O-N 3.12Å; A331-R378 HydrophobicContact CB-CB 4.09Å; A331-R378 HydrophobicContact CB-CG 3.89Å; A331-C381 HydrophobicContact CB-CB 3.46Å; A331-C381 VanDerWaalsContact CB-CB 3.46Å; A331-S382 PolarHBondContact O-OG 2.91Å
332	L	68	Low	69.4	Low	31 Å²	31	80.9 Å²	80.9	16%	0.162	35%	0.354	C	S	.	.	H	α-helix	trans	-77.4	-27.7	-174.1	-59.4	174.7	0	0	0	113.3	F295 F296 L328 P329 R330 R334 L355	F295-L332 HydrophobicContact CB-CD1 4.11Å; F295-L332 HydrophobicContact CD1-CB 3.32Å; F295-L332 HydrophobicContact CD1-CD1 4.22Å; F295-L332 HydrophobicContact CD1-CG 4.4Å; F295-L332 HydrophobicContact CE1-CB 3.53Å; F295-L332 WeakPolarHBondContact CE1-O 3.39Å; F295-L332 HydrophobicContact CG-CB 4.05Å; F295-L332 HydrophobicContact CG-CD1 4.22Å; F295-L332 HydrophobicContact CZ-CB 4.37Å; F296-L332 HydrophobicContact CE1-CD1 4.47Å; F296-L332 HydrophobicContact CE2-CD1 3.85Å; F296-L332 HydrophobicContact CZ-CD1 3.57Å; L328-L332 HydrophobicContact CD1-CD1 3.93Å; L328-L332 HydrophobicContact CD1-CG 4.16Å; L328-L332 HydrophobicContact CG-CD1 4.06Å; L328-L332 WeakPolarHBondContact O-CG 3.34Å; L328-L332 PolarHBondContact O-N 3.27Å; L328-L332 VanDerWaalsContact O-N 3.07Å; P329-L332 PolarHBondContact O-N 2.84Å; R330-L332 VanDerWaalsContact C-N 3.32Å; L332-R334 VanDerWaalsContact C-N 3.3Å; L332-R334 PolarHBondContact O-N 3.42Å; L332-L355 HydrophobicContact CD2-CD1 4.16Å
333	K	65.2	Low	67.9	Low	160 Å²	160	75.3 Å²	75.3	70%	0.696	33%	0.328	S	S	*	.	H	α-helix	trans	-62.3	-31.7	-177.5	-169	174.4	-179.6	179.9	0	113.8	F295 P329 K335	F295-K333 HydrophobicContact CE1-CB 4.35Å; F295-K333 HydrophobicContact CZ-CB 3.85Å; F295-K333 HydrophobicContact CZ-CG 4.35Å; P329-K333 WeakPolarHBondContact O-CB 3.28Å; P329-K333 PolarHBondContact O-N 2.95Å; K333-K335 PolarHBondContact O-N 3.18Å
334	R	55.5	Low	66.6	Low	177 Å²	177	78.7 Å²	78.7	67%	0.668	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-12	-157	-150.4	172	167.5	-172.2	-6	115.9	L332 E375	L332-R334 VanDerWaalsContact C-N 3.3Å; L332-R334 PolarHBondContact O-N 3.42Å; R334-E375 IonicContact NH1-OE1 3.87Å; R334-E375 PolarHBondContact NH1-OE1 3.42Å
335	K	56.2	Low	65.7	Low	107 Å²	107	84.5 Å²	84.5	47%	0.465	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	8.1	-177.5	-73.1	-163.9	168.9	-169.7	0	116.3	K333 Q337 L339 T386	K333-K335 PolarHBondContact O-N 3.18Å; K335-Q337 PolarHBondContact O-N 2.72Å; K335-L339 HydrophobicContact CB-CD1 3.86Å; K335-L339 WeakPolarHBondContact O-CD1 3.45Å; K335-L339 PolarHBondContact O-N 2.91Å; K335-T386 HydrophobicContact CB-CG2 4.14Å; K335-T386 HydrophobicContact CD-CG2 3.72Å
336	R	51.9	Low	64.7	Low	93 Å²	93	89.7 Å²	89.7	35%	0.351	41%	0.406	S	S	.	.	H	α-helix	trans	-66.4	-32.4	-170.2	-169	177.6	-177.7	-133.3	10.2	115	G293 Y294 K340	G293-R336 PolarHBondContact O-NH2 2.82Å; Y294-R336 VanDerWaalsContact CE1-NH1 3.29Å; Y294-R336 PolarHBondContact O-NE 3.22Å; Y294-R336 VanDerWaalsContact O-NE 3.09Å; R336-K340 PolarHBondContact O-N 3.27Å
337	Q	54.2	Low	63.8	Low	173 Å²	173	91.9 Å²	91.9	81%	0.808	43%	0.427	S	S	*	.	H	α-helix	trans	-73.6	-45.5	-175.9	-75.6	177.9	-17.4	0	0	112	K335 L339 R341	K335-Q337 PolarHBondContact O-N 2.72Å; Q337-L339 VanDerWaalsContact C-N 3.33Å; Q337-L339 PolarHBondContact O-N 2.85Å; Q337-R341 PolarHBondContact O-N 3.36Å
338	D	54	Low	62.2	Low	120 Å²	120	94.7 Å²	94.7	64%	0.642	44%	0.441	S	S	*	.	H	α-helix	trans	-65.1	-38.3	179.3	-55.3	-30.3	0	0	0	111.7	R341 W342	D338-R341 PolarHBondContact O-N 2.88Å; D338-W342 PolarHBondContact O-N 3.08Å
339	L	52.5	Low	60.6	Low	25 Å²	25	99.8 Å²	99.8	13%	0.131	48%	0.475	C	S	.	.	H	α-helix	trans	-69.5	-44.4	-179.8	-82.6	148.5	0	0	0	113.1	K335 Q337 R341 W342 Y343 Y350 T386 S387	K335-L339 HydrophobicContact CB-CD1 3.86Å; K335-L339 WeakPolarHBondContact O-CD1 3.45Å; K335-L339 PolarHBondContact O-N 2.91Å; Q337-L339 VanDerWaalsContact C-N 3.33Å; Q337-L339 PolarHBondContact O-N 2.85Å; L339-R341 PolarHBondContact O-N 3.45Å; L339-W342 PolarHBondContact O-N 3.42Å; L339-Y343 HydrophobicContact CD2-CE2 4.16Å; L339-Y343 VanDerWaalsContact O-CD2 3.3Å; L339-Y343 WeakPolarHBondContact O-CD2 3.36Å; L339-Y343 PolarHBondContact O-N 2.85Å; L339-Y350 HydrophobicContact CB-CE2 4.3Å; L339-T386 HydrophobicContact CD1-CG2 3.61Å; L339-S387 VanDerWaalsContact CD2-CB 3.5Å
340	K	57	Low	59.3	Low	156 Å²	156	103.2 Å²	103.2	68%	0.678	49%	0.485	S	S	*	.	H	α-helix	trans	-59.7	-38.4	178.4	-167.6	-177.3	179.3	-169.6	0	110.5	R336 A344	R336-K340 PolarHBondContact O-N 3.27Å; K340-A344 WeakPolarHBondContact O-CB 3.35Å; K340-A344 PolarHBondContact O-N 3.37Å
341	R	60.9	Low	57.9	Low	176 Å²	176	98.4 Å²	98.4	66%	0.664	47%	0.472	S	S	*	.	H	α-helix	trans	-65.8	-48.9	175.2	-174.6	175.7	178.6	165.6	6	111.6	Q337 D338 L339 Y343 A344 E345	Q337-R341 PolarHBondContact O-N 3.36Å; D338-R341 PolarHBondContact O-N 2.88Å; L339-R341 PolarHBondContact O-N 3.45Å; R341-Y343 PolarHBondContact O-N 3.44Å; R341-A344 PolarHBondContact O-N 2.98Å; R341-E345 HydrophobicContact CG-CG 4.41Å; R341-E345 VanDerWaalsContact CG-OE1 3.23Å; R341-E345 WeakPolarHBondContact CG-OE1 3.49Å; R341-E345 IonicContact CZ-OE1 3.85Å; R341-E345 IonicContact NE-OE1 2.71Å; R341-E345 PolarHBondContact NE-OE1 3.4Å; R341-E345 IonicContact NH2-OE1 3.7Å; R341-E345 WeakPolarHBondContact O-CB 3.21Å; R341-E345 VanDerWaalsContact O-CG 3.32Å; R341-E345 WeakPolarHBondContact O-CG 3.45Å; R341-E345 PolarHBondContact O-N 2.92Å
342	W	57.8	Low	56.6	Low	76 Å²	76	100.3 Å²	100.3	29%	0.288	48%	0.482	S	S	.	.	H	α-helix	trans	-60	-42.9	179.5	-171.8	90.1	0	0	0	113.5	D338 L339 E345 K346 L348 V391	D338-W342 PolarHBondContact O-N 3.08Å; L339-W342 PolarHBondContact O-N 3.42Å; W342-E345 PolarHBondContact O-N 2.77Å; W342-K346 HydrophobicContact CD2-CG 4.1Å; W342-K346 HydrophobicContact CE3-CG 4.27Å; W342-K346 HydrophobicContact CH2-CG 4.05Å; W342-K346 HydrophobicContact CZ2-CG 3.9Å; W342-K346 HydrophobicContact CZ3-CG 4.24Å; W342-K346 WeakPolarHBondContact O-CB 3.41Å; W342-K346 WeakPolarHBondContact O-CG 3.49Å; W342-K346 PolarHBondContact O-N 3.49Å; W342-L348 HydrophobicContact CH2-CD1 4.12Å; W342-L348 HydrophobicContact CZ3-CD1 4.05Å; W342-V391 HydrophobicContact CE3-CG2 4.41Å; W342-V391 HydrophobicContact CH2-CB 4.47Å; W342-V391 HydrophobicContact CH2-CG1 4.25Å; W342-V391 HydrophobicContact CH2-CG2 3.37Å; W342-V391 HydrophobicContact CZ2-CG1 4.31Å; W342-V391 HydrophobicContact CZ2-CG2 4.03Å; W342-V391 HydrophobicContact CZ3-CG2 3.58Å
343	Y	59.8	Low	55.8	Low	7 Å²	7	100 Å²	100	3%	0.027	49%	0.487	C	S	.	.	H	α-helix	trans	-65.3	-41.9	175.9	-85.8	-73.9	0	0	0	113.2	L339 R341 E345 K346 S347 L348 Y350 P351 S387	L339-Y343 HydrophobicContact CD2-CE2 4.16Å; L339-Y343 VanDerWaalsContact O-CD2 3.3Å; L339-Y343 WeakPolarHBondContact O-CD2 3.36Å; L339-Y343 PolarHBondContact O-N 2.85Å; R341-Y343 PolarHBondContact O-N 3.44Å; Y343-E345 VanDerWaalsContact C-N 3.31Å; Y343-K346 PolarHBondContact O-N 3.01Å; Y343-S347 PolarHBondContact O-N 3.37Å; Y343-L348 HydrophobicContact CD1-CB 3.63Å; Y343-L348 WeakPolarHBondContact CD1-O 3.5Å; Y343-L348 HydrophobicContact CE1-CB 3.96Å; Y343-L348 PolarHBondContact O-N 2.99Å; Y343-Y350 AromaticContact CD2-CD2 3.33Å; Y343-Y350 HydrophobicContact CD2-CD2 3.33Å; Y343-Y350 AromaticContact CD2-CE2 3.82Å; Y343-Y350 HydrophobicContact CD2-CE2 3.82Å; Y343-Y350 HydrophobicContact CD2-CG 4.27Å; Y343-Y350 AromaticContact CE2-CD2 3.86Å; Y343-Y350 HydrophobicContact CE2-CD2 3.86Å; Y343-Y350 HydrophobicContact CE2-CE2 4.11Å; Y343-Y350 AromaticContact CG-CD2 3.85Å; Y343-Y350 HydrophobicContact CG-CD2 3.85Å; Y343-P351 HydrophobicContact CE1-CG 3.85Å; Y343-P351 WeakPolarHBondContact OH-CD 3.34Å; Y343-P351 WeakPolarHBondContact OH-CG 3.34Å; Y343-S387 WeakPolarHBondContact CE2-OG 3.46Å; Y343-S387 WeakPolarHBondContact OH-CB 3.35Å; Y343-S387 PolarHBondContact OH-OG 2.96Å
344	A	62.6	Low	55.5	Low	77 Å²	77	95.5 Å²	95.5	64%	0.636	47%	0.474	S	S	*	.	H	α-helix	trans	-62.1	-41.5	175.2	0	0	0	0	0	111	K340 R341 K346 S347	K340-A344 WeakPolarHBondContact O-CB 3.35Å; K340-A344 PolarHBondContact O-N 3.37Å; R341-A344 PolarHBondContact O-N 2.98Å; A344-K346 VanDerWaalsContact C-N 3.28Å; A344-K346 PolarHBondContact O-N 3.3Å; A344-S347 PolarHBondContact O-N 3.41Å
345	E	68.8	Low	56.1	Low	122 Å²	122	87.2 Å²	87.2	57%	0.57	44%	0.442	S	S	*	.	H	α-helix	trans	-66.1	-26.5	176	-73.9	171.3	-176.4	0	0	113.1	R341 W342 Y343	R341-E345 HydrophobicContact CG-CG 4.41Å; R341-E345 VanDerWaalsContact CG-OE1 3.23Å; R341-E345 WeakPolarHBondContact CG-OE1 3.49Å; R341-E345 IonicContact CZ-OE1 3.85Å; R341-E345 IonicContact NE-OE1 2.71Å; R341-E345 PolarHBondContact NE-OE1 3.4Å; R341-E345 IonicContact NH2-OE1 3.7Å; R341-E345 WeakPolarHBondContact O-CB 3.21Å; R341-E345 VanDerWaalsContact O-CG 3.32Å; R341-E345 WeakPolarHBondContact O-CG 3.45Å; R341-E345 PolarHBondContact O-N 2.92Å; W342-E345 PolarHBondContact O-N 2.77Å; Y343-E345 VanDerWaalsContact C-N 3.31Å
346	K	64.9	Low	56.9	Low	124 Å²	124	85.6 Å²	85.6	54%	0.539	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	1	-179.9	-66.3	-63.5	-176.6	-174.4	0	114.7	W342 Y343 A344 L348	W342-K346 HydrophobicContact CD2-CG 4.1Å; W342-K346 HydrophobicContact CE3-CG 4.27Å; W342-K346 HydrophobicContact CH2-CG 4.05Å; W342-K346 HydrophobicContact CZ2-CG 3.9Å; W342-K346 HydrophobicContact CZ3-CG 4.24Å; W342-K346 WeakPolarHBondContact O-CB 3.41Å; W342-K346 WeakPolarHBondContact O-CG 3.49Å; W342-K346 PolarHBondContact O-N 3.49Å; Y343-K346 PolarHBondContact O-N 3.01Å; A344-K346 VanDerWaalsContact C-N 3.28Å; A344-K346 PolarHBondContact O-N 3.3Å; K346-L348 HydrophobicContact CB-CB 4.46Å; K346-L348 HydrophobicContact CB-CD1 3.9Å; K346-L348 HydrophobicContact CB-CG 4.12Å; K346-L348 PolarHBondContact O-N 3.24Å
347	S	64.2	Low	58.3	Low	115 Å²	115	83.1 Å²	83.1	80%	0.804	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	26.8	-174.1	-58.5	0	0	0	0	114	Y343 A344	Y343-S347 PolarHBondContact O-N 3.37Å; A344-S347 PolarHBondContact O-N 3.41Å
348	L	51.7	Low	59.8	Low	73 Å²	73	77.8 Å²	77.8	38%	0.382	42%	0.418	S	S	.	.			trans	-92.9	137.1	179.9	-76.4	168.6	0	0	0	108.9	W342 Y343 K346 Y350	W342-L348 HydrophobicContact CH2-CD1 4.12Å; W342-L348 HydrophobicContact CZ3-CD1 4.05Å; Y343-L348 HydrophobicContact CD1-CB 3.63Å; Y343-L348 WeakPolarHBondContact CD1-O 3.5Å; Y343-L348 HydrophobicContact CE1-CB 3.96Å; Y343-L348 PolarHBondContact O-N 2.99Å; K346-L348 HydrophobicContact CB-CB 4.46Å; K346-L348 HydrophobicContact CB-CD1 3.9Å; K346-L348 HydrophobicContact CB-CG 4.12Å; K346-L348 PolarHBondContact O-N 3.24Å; L348-Y350 PolarHBondContact O-N 2.94Å; L348-Y350 VanDerWaalsContact O-N 3.16Å
349	P	46.1	Very low	61.1	Low	112 Å²	112	72.3 Å²	72.3	73%	0.727	39%	0.388	S	S	*	.			trans	-61	123.9	171.9	25.7	-31.3	0	0	0	107.5	P351	P349-P351 WeakPolarHBondContact O-CD 3.44Å
350	Y	48	Very low	62.7	Low	96 Å²	96	71.1 Å²	71.1	38%	0.376	38%	0.382	S	S	.	.			trans	-55.4	102.7	177.9	-174.9	-88.5	0	0	0	109.3	L339 Y343 L348 L352	L339-Y350 HydrophobicContact CB-CE2 4.3Å; Y343-Y350 AromaticContact CD2-CD2 3.33Å; Y343-Y350 HydrophobicContact CD2-CD2 3.33Å; Y343-Y350 AromaticContact CD2-CE2 3.82Å; Y343-Y350 HydrophobicContact CD2-CE2 3.82Å; Y343-Y350 HydrophobicContact CD2-CG 4.27Å; Y343-Y350 AromaticContact CE2-CD2 3.86Å; Y343-Y350 HydrophobicContact CE2-CD2 3.86Å; Y343-Y350 HydrophobicContact CE2-CE2 4.11Å; Y343-Y350 AromaticContact CG-CD2 3.85Å; Y343-Y350 HydrophobicContact CG-CD2 3.85Å; L348-Y350 PolarHBondContact O-N 2.94Å; L348-Y350 VanDerWaalsContact O-N 3.16Å; Y350-L352 HydrophobicContact CD1-CG 4.38Å; Y350-L352 HydrophobicContact CE1-CD2 4.3Å; Y350-L352 HydrophobicContact CE1-CG 4.28Å; Y350-L352 PolarHBondContact O-N 3.35Å
351	P	44.8	Very low	64.3	Low	43 Å²	43	65.7 Å²	65.7	28%	0.279	36%	0.359	S	S	.	.			trans	-80.5	112.7	177.4	29.3	-17.8	0	0	0	105.5	Y343 P349 G353 V390	Y343-P351 HydrophobicContact CE1-CG 3.85Å; Y343-P351 WeakPolarHBondContact OH-CD 3.34Å; Y343-P351 WeakPolarHBondContact OH-CG 3.34Å; P349-P351 WeakPolarHBondContact O-CD 3.44Å; P351-G353 PolarHBondContact O-N 2.86Å; P351-V390 HydrophobicContact CB-CG1 4.21Å; P351-V390 HydrophobicContact CG-CB 4.21Å; P351-V390 HydrophobicContact CG-CG1 3.56Å; P351-V390 HydrophobicContact CG-CG2 4.27Å
352	L	45.7	Very low	65.7	Low	44 Å²	44	58.2 Å²	58.2	23%	0.23	33%	0.332	C	S	.	.			trans	-61.5	86.9	160.3	-80.5	153.8	0	0	0	106.5	F295 K297 D298 Y350 P354	F295-L352 WeakPolarHBondContact O-CD2 3.46Å; K297-L352 HydrophobicContact CB-CD1 3.77Å; K297-L352 HydrophobicContact CD-CD1 4.45Å; K297-L352 HydrophobicContact CG-CD1 4.14Å; D298-L352 VanDerWaalsContact OD2-CD1 3.32Å; D298-L352 WeakPolarHBondContact OD2-CD1 3.45Å; Y350-L352 HydrophobicContact CD1-CG 4.38Å; Y350-L352 HydrophobicContact CE1-CD2 4.3Å; Y350-L352 HydrophobicContact CE1-CG 4.28Å; Y350-L352 PolarHBondContact O-N 3.35Å; L352-P354 WeakPolarHBondContact O-CD 3.31Å; L352-P354 WeakPolarHBondContact O-CG 3.23Å
353	G	50.9	Low	67.3	Low	25 Å²	25	54.6 Å²	54.6	26%	0.258	32%	0.319	S	S	.	.			trans	-65.3	101.5	165.5	0	0	0	0	0	106.7	P351 L355	P351-G353 PolarHBondContact O-N 2.86Å; G353-L355 PolarHBondContact O-N 3.4Å
354	P	58	Low	68.8	Low	65 Å²	65	54.2 Å²	54.2	42%	0.422	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-76.3	134	-179.6	-5	26.2	0	0	0	105.7	K301 L352 N356	K301-P354 HydrophobicContact CD-CB 4.26Å; K301-P354 VanDerWaalsContact NZ-CB 3.31Å; L352-P354 WeakPolarHBondContact O-CD 3.31Å; L352-P354 WeakPolarHBondContact O-CG 3.23Å; P354-N356 PolarHBondContact O-N 3.17Å
355	L	67.4	Low	70.3	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.01	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-48.5	117.7	147.9	-72.4	147.5	0	0	0	106.3	Y305 L328 L332 G353 D359 I360 L363 C381 I384	Y305-L355 VanDerWaalsContact CE1-O 3.27Å; Y305-L355 WeakPolarHBondContact CE1-O 3.39Å; Y305-L355 VanDerWaalsContact CZ-O 3.24Å; Y305-L355 PolarHBondContact OH-O 3.15Å; L328-L355 HydrophobicContact CD1-CD1 3.96Å; L332-L355 HydrophobicContact CD2-CD1 4.16Å; G353-L355 PolarHBondContact O-N 3.4Å; L355-D359 HydrophobicContact CD2-CB 4.4Å; L355-I360 HydrophobicContact CB-CD1 3.5Å; L355-I360 VanDerWaalsContact CB-CD1 3.5Å; L355-I360 HydrophobicContact CB-CG1 3.71Å; L355-I360 HydrophobicContact CD1-CD1 3.74Å; L355-I360 HydrophobicContact CD2-CD1 4.12Å; L355-I360 HydrophobicContact CG-CD1 3.98Å; L355-L363 HydrophobicContact CD2-CD1 4.07Å; L355-C381 HydrophobicContact CD1-CB 4.43Å; L355-I384 HydrophobicContact CD2-CB 3.61Å; L355-I384 HydrophobicContact CD2-CD1 3.79Å; L355-I384 HydrophobicContact CD2-CG1 4.31Å; L355-I384 HydrophobicContact CD2-CG2 3.43Å; L355-I384 VanDerWaalsContact CD2-CG2 3.43Å; L355-I384 HydrophobicContact CG-CB 4.43Å; L355-I384 HydrophobicContact CG-CG2 4Å
356	N	74.1	Confident	71.5	Confident	74 Å²	74	49 Å²	49	40%	0.396	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-72.9	164.4	175.5	61.6	56.7	0	0	0	108.5	P354 S358 D359 I360	P354-N356 PolarHBondContact O-N 3.17Å; N356-S358 PolarHBondContact O-N 3.41Å; N356-S358 WeakPolarHBondContact OD1-CA 3.39Å; N356-S358 WeakPolarHBondContact OD1-CB 3.29Å; N356-S358 PolarHBondContact OD1-N 2.9Å; N356-S358 VanDerWaalsContact OD1-N 3.12Å; N356-D359 PolarHBondContact ND2-OD2 2.77Å; N356-D359 PolarHBondContact O-N 2.98Å; N356-D359 PolarHBondContact OD1-N 2.78Å; N356-I360 PolarHBondContact O-N 3.33Å
357	S	81.9	Confident	72.8	Confident	41 Å²	41	45.4 Å²	45.4	29%	0.287	26%	0.263	S	S	.	.	H	α-helix	trans	-60.3	-31.3	-177	-53.4	0	0	0	0	112.7	Y308 I360 F361	Y308-S357 VanDerWaalsContact CD1-O 3.29Å; Y308-S357 WeakPolarHBondContact CD1-O 3.4Å; Y308-S357 WeakPolarHBondContact CE1-O 3.5Å; S357-I360 PolarHBondContact O-N 2.77Å; S357-F361 WeakPolarHBondContact O-CB 3.47Å; S357-F361 PolarHBondContact O-N 2.94Å
358	S	84	Confident	74.2	Confident	60 Å²	60	42.9 Å²	42.9	42%	0.42	24%	0.24	S	C	.	.	H	α-helix	trans	-68.4	-46.5	176.9	175.7	0	0	0	0	112.4	N356 I360 F361 T362	N356-S358 PolarHBondContact O-N 3.41Å; N356-S358 WeakPolarHBondContact OD1-CA 3.39Å; N356-S358 WeakPolarHBondContact OD1-CB 3.29Å; N356-S358 PolarHBondContact OD1-N 2.9Å; N356-S358 VanDerWaalsContact OD1-N 3.12Å; S358-I360 VanDerWaalsContact C-N 3.3Å; S358-I360 PolarHBondContact O-N 3.46Å; S358-F361 PolarHBondContact O-N 3.36Å; S358-T362 PolarHBondContact O-N 2.85Å; S358-T362 PolarHBondContact O-OG1 3.46Å
359	D	83.1	Confident	76.2	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.027	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-40.2	175.5	-79.5	-36.4	0	0	0	110.7	L355 N356 L363 I384 R389 A403	L355-D359 HydrophobicContact CD2-CB 4.4Å; N356-D359 PolarHBondContact ND2-OD2 2.77Å; N356-D359 PolarHBondContact O-N 2.98Å; N356-D359 PolarHBondContact OD1-N 2.78Å; D359-L363 WeakPolarHBondContact O-CB 3.23Å; D359-L363 WeakPolarHBondContact O-CD1 3.16Å; D359-L363 WeakPolarHBondContact O-CG 3.2Å; D359-L363 PolarHBondContact O-N 2.91Å; D359-L363 VanDerWaalsContact O-N 3.11Å; D359-I384 HydrophobicContact CB-CD1 4.26Å; D359-R389 IonicContact OD2-CZ 2.93Å; D359-R389 IonicContact OD2-NH1 3.87Å; D359-R389 PolarHBondContact OD2-NH1 2.76Å; D359-R389 IonicContact OD2-NH2 3.36Å; D359-A403 HydrophobicContact CB-CB 4.36Å; D359-A403 PolarHBondContact OD1-N 3.17Å
360	I	85.7	Confident	78.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.9	-47.8	174	-67.9	-63.5	0	0	0	111.2	Y305 L324 L328 L355 N356 S357 S358 T362 L363 V364	Y305-I360 HydrophobicContact CD1-CB 4.13Å; Y305-I360 HydrophobicContact CD1-CG1 3.73Å; Y305-I360 HydrophobicContact CD1-CG2 4.33Å; Y305-I360 HydrophobicContact CD2-CD1 4.35Å; Y305-I360 HydrophobicContact CD2-CG1 4Å; Y305-I360 HydrophobicContact CD2-CG2 4.45Å; Y305-I360 HydrophobicContact CE1-CB 4.49Å; Y305-I360 HydrophobicContact CE1-CG1 3.68Å; Y305-I360 HydrophobicContact CE2-CD1 4.22Å; Y305-I360 HydrophobicContact CE2-CG1 3.98Å; Y305-I360 HydrophobicContact CG-CB 4.27Å; Y305-I360 HydrophobicContact CG-CG1 3.9Å; Y305-I360 HydrophobicContact CG-CG2 4Å; L324-I360 HydrophobicContact CD2-CG2 3.82Å; L328-I360 HydrophobicContact CD1-CD1 4.09Å; L328-I360 HydrophobicContact CD2-CD1 4.47Å; L355-I360 HydrophobicContact CB-CD1 3.5Å; L355-I360 VanDerWaalsContact CB-CD1 3.5Å; L355-I360 HydrophobicContact CB-CG1 3.71Å; L355-I360 HydrophobicContact CD1-CD1 3.74Å; L355-I360 HydrophobicContact CD2-CD1 4.12Å; L355-I360 HydrophobicContact CG-CD1 3.98Å; N356-I360 PolarHBondContact O-N 3.33Å; S357-I360 PolarHBondContact O-N 2.77Å; S358-I360 VanDerWaalsContact C-N 3.3Å; S358-I360 PolarHBondContact O-N 3.46Å; I360-T362 PolarHBondContact O-N 2.73Å; I360-L363 PolarHBondContact O-N 3.1Å; I360-V364 HydrophobicContact CG2-CG2 3.85Å; I360-V364 WeakPolarHBondContact O-CB 3.37Å; I360-V364 VanDerWaalsContact O-CG2 3.27Å; I360-V364 WeakPolarHBondContact O-CG2 3.36Å; I360-V364 PolarHBondContact O-N 3.27Å
361	F	91.1	Very high	80.2	Confident	43 Å²	43	39.2 Å²	39.2	19%	0.189	23%	0.226	C	C	.	.	H	α-helix	trans	-55.8	-49.7	178.2	163.4	-103.3	0	0	0	111.5	Y308 C313 L315 S357 S358 L363 V364 K365	Y308-F361 HydrophobicContact CD1-CB 3.9Å; Y308-F361 HydrophobicContact CE1-CB 3.64Å; Y308-F361 HydrophobicContact CE1-CG 4.2Å; C313-F361 HydrophobicContact CB-CD2 3.55Å; C313-F361 HydrophobicContact CB-CE2 3.32Å; C313-F361 HydrophobicContact CB-CG 4.49Å; C313-F361 HydrophobicContact CB-CZ 4.11Å; L315-F361 HydrophobicContact CD1-CD2 3.6Å; L315-F361 HydrophobicContact CD1-CE2 3.72Å; L315-F361 HydrophobicContact CD2-CE2 3.87Å; L315-F361 HydrophobicContact CG-CD2 4.07Å; L315-F361 HydrophobicContact CG-CE2 3.77Å; S357-F361 WeakPolarHBondContact O-CB 3.47Å; S357-F361 PolarHBondContact O-N 2.94Å; S358-F361 PolarHBondContact O-N 3.36Å; F361-L363 VanDerWaalsContact C-N 3.3Å; F361-L363 PolarHBondContact O-N 2.96Å; F361-V364 PolarHBondContact O-N 3.25Å; F361-K365 HydrophobicContact CE1-CD 4.33Å; F361-K365 HydrophobicContact CE2-CB 4.49Å; F361-K365 HydrophobicContact CE2-CD 4.33Å; F361-K365 HydrophobicContact CZ-CD 3.83Å; F361-K365 WeakPolarHBondContact O-CB 3.23Å; F361-K365 PolarHBondContact O-N 3.49Å
362	T	90.1	Very high	82.4	Confident	18 Å²	18	37.3 Å²	37.3	11%	0.11	21%	0.213	C	C	.	.	H	α-helix	trans	-55.5	-46.1	176.7	-68.4	0	0	0	0	111.6	S358 I360 A366 A403 D404	S358-T362 PolarHBondContact O-N 2.85Å; S358-T362 PolarHBondContact O-OG1 3.46Å; I360-T362 PolarHBondContact O-N 2.73Å; T362-A366 VanDerWaalsContact O-CB 3.3Å; T362-A366 WeakPolarHBondContact O-CB 3.28Å; T362-A366 PolarHBondContact O-N 3.37Å; T362-A403 HydrophobicContact CG2-CB 3.65Å; T362-D404 HydrophobicContact CG2-CB 4.3Å; T362-D404 WeakPolarHBondContact CG2-OD1 3.33Å; T362-D404 WeakPolarHBondContact CG2-OD2 3.41Å
363	L	89.7	Confident	84.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-68.9	-43	-179	-70.4	170.7	0	0	0	113.1	L355 D359 I360 F361 R367 I372 F377 V380 I384 A403 I407	L355-L363 HydrophobicContact CD2-CD1 4.07Å; D359-L363 WeakPolarHBondContact O-CB 3.23Å; D359-L363 WeakPolarHBondContact O-CD1 3.16Å; D359-L363 WeakPolarHBondContact O-CG 3.2Å; D359-L363 PolarHBondContact O-N 2.91Å; D359-L363 VanDerWaalsContact O-N 3.11Å; I360-L363 PolarHBondContact O-N 3.1Å; F361-L363 VanDerWaalsContact C-N 3.3Å; F361-L363 PolarHBondContact O-N 2.96Å; L363-R367 VanDerWaalsContact O-CB 3.24Å; L363-R367 WeakPolarHBondContact O-CB 3.25Å; L363-R367 PolarHBondContact O-N 3.49Å; L363-I372 HydrophobicContact CD2-CD1 4.16Å; L363-F377 HydrophobicContact CB-CD2 3.85Å; L363-F377 HydrophobicContact CB-CE2 3.56Å; L363-V380 HydrophobicContact CD1-CG1 4.27Å; L363-V380 HydrophobicContact CD2-CB 3.73Å; L363-V380 HydrophobicContact CD2-CG1 3.57Å; L363-V380 HydrophobicContact CD2-CG2 4.36Å; L363-V380 HydrophobicContact CG-CG1 4.47Å; L363-I384 HydrophobicContact CD1-CD1 4.12Å; L363-A403 HydrophobicContact CD1-CB 4.24Å; L363-A403 HydrophobicContact CD2-CB 3.91Å; L363-A403 HydrophobicContact CG-CB 3.68Å; L363-I407 HydrophobicContact CD2-CD1 4.2Å
364	V	92.4	Very high	86.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65	-46.9	178.4	172.8	0	0	0	0	109.4	L315 C320 I323 L324 I360 F361 A366 R367 L368 F377	L315-V364 HydrophobicContact CD1-CB 4.42Å; L315-V364 HydrophobicContact CD1-CG1 3.98Å; C320-V364 HydrophobicContact CB-CG1 4.41Å; I323-V364 HydrophobicContact CD1-CG1 4.16Å; I323-V364 HydrophobicContact CG2-CG2 4.07Å; L324-V364 HydrophobicContact CD2-CG2 3.89Å; L324-V364 HydrophobicContact CG-CG2 4.25Å; I360-V364 HydrophobicContact CG2-CG2 3.85Å; I360-V364 WeakPolarHBondContact O-CB 3.37Å; I360-V364 VanDerWaalsContact O-CG2 3.27Å; I360-V364 WeakPolarHBondContact O-CG2 3.36Å; I360-V364 PolarHBondContact O-N 3.27Å; F361-V364 PolarHBondContact O-N 3.25Å; V364-A366 PolarHBondContact O-N 2.96Å; V364-R367 PolarHBondContact O-N 2.91Å; V364-R367 VanDerWaalsContact O-N 3.16Å; V364-L368 HydrophobicContact CG1-CD1 3.98Å; V364-L368 HydrophobicContact CG1-CG 4.32Å; V364-L368 WeakPolarHBondContact O-CG 3.38Å; V364-L368 PolarHBondContact O-N 2.96Å; V364-F377 HydrophobicContact CG2-CE2 4.39Å
365	K	94.7	Very high	87.5	Confident	82 Å²	82	33.5 Å²	33.5	36%	0.357	19%	0.187	S	C	.	.	H	α-helix	trans	-56.6	-52.2	175.6	-177.9	176.7	175.7	179.8	0	111.7	L315 F361 R367 L368 E369	L315-K365 HydrophobicContact CD1-CB 4.19Å; L315-K365 HydrophobicContact CD2-CB 4.31Å; L315-K365 HydrophobicContact CD2-CG 4.29Å; F361-K365 HydrophobicContact CE1-CD 4.33Å; F361-K365 HydrophobicContact CE2-CB 4.49Å; F361-K365 HydrophobicContact CE2-CD 4.33Å; F361-K365 HydrophobicContact CZ-CD 3.83Å; F361-K365 WeakPolarHBondContact O-CB 3.23Å; F361-K365 PolarHBondContact O-N 3.49Å; K365-R367 PolarHBondContact O-N 3.21Å; K365-L368 PolarHBondContact O-N 2.79Å; K365-E369 WeakPolarHBondContact CE-OE1 3.33Å; K365-E369 HydrophobicContact CG-CG 4.47Å; K365-E369 WeakPolarHBondContact CG-OE1 3.38Å; K365-E369 IonicContact NZ-OE1 2.96Å; K365-E369 WeakPolarHBondContact O-CG 3.44Å; K365-E369 PolarHBondContact O-N 3.33Å
366	A	92.5	Very high	88.5	Confident	7 Å²	7	33.4 Å²	33.4	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-32.2	178.8	0	0	0	0	0	112.7	T362 V364 G370 T371 I372 I407	T362-A366 VanDerWaalsContact O-CB 3.3Å; T362-A366 WeakPolarHBondContact O-CB 3.28Å; T362-A366 PolarHBondContact O-N 3.37Å; V364-A366 PolarHBondContact O-N 2.96Å; A366-G370 PolarHBondContact O-N 3.26Å; A366-T371 WeakPolarHBondContact O-CA 3.5Å; A366-T371 WeakPolarHBondContact O-CB 3.41Å; A366-T371 PolarHBondContact O-N 2.86Å; A366-I372 HydrophobicContact CB-CD1 3.94Å; A366-I372 HydrophobicContact CB-CG1 3.91Å; A366-I372 HydrophobicContact CB-CG2 4.43Å; A366-I372 PolarHBondContact O-N 3.06Å; A366-I407 HydrophobicContact CB-CD1 4.17Å
367	R	93.3	Very high	89.1	Confident	49 Å²	49	29.9 Å²	29.9	19%	0.185	17%	0.167	C	C	.	.	H	α-helix	trans	-75.5	-36.6	177.5	178.6	64	-174.3	92.3	1.4	112.4	I323 D327 L363 V364 K365 G370 I372 F377	I323-R367 HydrophobicContact CD1-CB 3.88Å; I323-R367 HydrophobicContact CD1-CG 3.53Å; I323-R367 HydrophobicContact CG1-CG 3.76Å; I323-R367 HydrophobicContact CG2-CG 4.22Å; D327-R367 IonicContact OD2-CZ 2.73Å; D327-R367 IonicContact OD2-NE 3.75Å; D327-R367 PolarHBondContact OD2-NE 3.46Å; D327-R367 IonicContact OD2-NH2 2.94Å; L363-R367 VanDerWaalsContact O-CB 3.24Å; L363-R367 WeakPolarHBondContact O-CB 3.25Å; L363-R367 PolarHBondContact O-N 3.49Å; V364-R367 PolarHBondContact O-N 2.91Å; V364-R367 VanDerWaalsContact O-N 3.16Å; K365-R367 PolarHBondContact O-N 3.21Å; R367-G370 PolarHBondContact O-N 2.94Å; R367-I372 HydrophobicContact CB-CD1 4.46Å; R367-I372 HydrophobicContact CB-CG1 4.16Å; R367-I372 WeakPolarHBondContact CD-O 3.36Å; R367-F377 HydrophobicContact CB-CD2 3.98Å; R367-F377 HydrophobicContact CG-CD2 4.32Å
368	L	93.2	Very high	89.2	Confident	61 Å²	61	31.3 Å²	31.3	32%	0.319	17%	0.166	S	C	.	.	H	α-helix	trans	-66.7	-43.5	174.3	-73.2	173.3	0	0	0	111.8	L315 I323 V364 K365 G370	L315-L368 HydrophobicContact CB-CD1 4.2Å; L315-L368 HydrophobicContact CD1-CD1 4.22Å; I323-L368 HydrophobicContact CD1-CD2 3.56Å; I323-L368 HydrophobicContact CD1-CG 3.63Å; V364-L368 HydrophobicContact CG1-CD1 3.98Å; V364-L368 HydrophobicContact CG1-CG 4.32Å; V364-L368 WeakPolarHBondContact O-CG 3.38Å; V364-L368 PolarHBondContact O-N 2.96Å; K365-L368 PolarHBondContact O-N 2.79Å; L368-G370 PolarHBondContact O-N 3.46Å
369	E	92.6	Very high	89	Confident	122 Å²	122	31.8 Å²	31.8	57%	0.57	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-7.5	178.4	-67.9	171.7	171.2	0	0	113	K365 T371	K365-E369 WeakPolarHBondContact CE-OE1 3.33Å; K365-E369 HydrophobicContact CG-CG 4.47Å; K365-E369 WeakPolarHBondContact CG-OE1 3.38Å; K365-E369 IonicContact NZ-OE1 2.96Å; K365-E369 WeakPolarHBondContact O-CG 3.44Å; K365-E369 PolarHBondContact O-N 3.33Å; E369-T371 PolarHBondContact O-N 3.41Å
370	G	89.7	Confident	88.9	Confident	27 Å²	27	31.6 Å²	31.6	28%	0.278	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	7.1	-176.3	0	0	0	0	0	114.3	A366 R367 L368 I372 S414	A366-G370 PolarHBondContact O-N 3.26Å; R367-G370 PolarHBondContact O-N 2.94Å; L368-G370 PolarHBondContact O-N 3.46Å; G370-I372 PolarHBondContact O-N 3.19Å; G370-S414 VanDerWaalsContact O-CB 3.22Å; G370-S414 WeakPolarHBondContact O-CB 3.43Å
371	T	90.4	Very high	88.5	Confident	56 Å²	56	31.6 Å²	31.6	34%	0.344	16%	0.16	S	C	.	.	S	Bend	trans	-60.3	-32	176.2	-55.5	0	0	0	0	111.7	A366 E369 I413 S414	A366-T371 WeakPolarHBondContact O-CA 3.5Å; A366-T371 WeakPolarHBondContact O-CB 3.41Å; A366-T371 PolarHBondContact O-N 2.86Å; E369-T371 PolarHBondContact O-N 3.41Å; T371-I413 WeakPolarHBondContact O-CA 3.47Å; T371-S414 WeakPolarHBondContact O-CB 3.37Å; T371-S414 PolarHBondContact O-N 2.91Å
372	I	90.3	Very high	87.5	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-128.6	144.4	174	63	176.2	0	0	0	111.7	L363 A366 R367 G370 F377 I407	L363-I372 HydrophobicContact CD2-CD1 4.16Å; A366-I372 HydrophobicContact CB-CD1 3.94Å; A366-I372 HydrophobicContact CB-CG1 3.91Å; A366-I372 HydrophobicContact CB-CG2 4.43Å; A366-I372 PolarHBondContact O-N 3.06Å; R367-I372 HydrophobicContact CB-CD1 4.46Å; R367-I372 HydrophobicContact CB-CG1 4.16Å; R367-I372 WeakPolarHBondContact CD-O 3.36Å; G370-I372 PolarHBondContact O-N 3.19Å; I372-F377 HydrophobicContact CD1-CB 3.98Å; I372-F377 HydrophobicContact CD1-CD2 4.21Å; I372-I407 HydrophobicContact CD1-CD1 4.25Å; I372-I407 HydrophobicContact CG2-CD1 4.04Å; I372-I407 HydrophobicContact CG2-CG1 4.1Å; I372-I407 HydrophobicContact CG2-CG2 3.75Å
373	S	89	Confident	86.6	Confident	5 Å²	5	31.1 Å²	31.1	4%	0.035	16%	0.164	C	C	.	.			trans	-71.7	164	171.8	79.2	0	0	0	0	111.4	E375 S376 F377 Q460	S373-E375 PolarHBondContact O-N 3.28Å; S373-E375 PolarHBondContact OG-N 3.07Å; S373-S376 WeakPolarHBondContact O-CB 3.46Å; S373-S376 PolarHBondContact O-N 3.16Å; S373-S376 VanDerWaalsContact O-N 3.16Å; S373-S376 PolarHBondContact OG-N 3.07Å; S373-S376 PolarHBondContact OG-OG 3.04Å; S373-F377 PolarHBondContact O-N 2.89Å; S373-Q460 PolarHBondContact OG-O 2.81Å
374	A	87.6	Confident	85.5	Confident	26 Å²	26	31.3 Å²	31.3	22%	0.215	17%	0.165	C	C	.	.	H	α-helix	trans	-58.4	-32.7	172.5	0	0	0	0	0	112.5	R378	A374-R378 VanDerWaalsContact O-CG 3.3Å; A374-R378 WeakPolarHBondContact O-CG 3.15Å; A374-R378 PolarHBondContact O-N 3.3Å
375	E	85.9	Confident	84	Confident	24 Å²	24	32.4 Å²	32.4	11%	0.112	18%	0.176	C	C	.	.	H	α-helix	trans	-72.5	-41.5	175.4	-173.6	64.6	-169.4	0	0	111.9	R334 S373 F377 R378 K379 Q460	R334-E375 IonicContact NH1-OE1 3.87Å; R334-E375 PolarHBondContact NH1-OE1 3.42Å; S373-E375 PolarHBondContact O-N 3.28Å; S373-E375 PolarHBondContact OG-N 3.07Å; E375-F377 VanDerWaalsContact C-N 3.34Å; E375-F377 PolarHBondContact O-N 3.45Å; E375-R378 PolarHBondContact O-N 3.3Å; E375-R378 IonicContact OE2-CZ 3.62Å; E375-R378 IonicContact OE2-NE 3.97Å; E375-R378 PolarHBondContact OE2-NE 3.47Å; E375-R378 IonicContact OE2-NH2 3.33Å; E375-R378 PolarHBondContact OE2-NH2 2.96Å; E375-K379 HydrophobicContact CG-CD 4.37Å; E375-K379 WeakPolarHBondContact O-CG 3.47Å; E375-K379 PolarHBondContact O-N 3.39Å; E375-Q460 HydrophobicContact CB-CB 3.94Å; E375-Q460 HydrophobicContact CG-CB 3.71Å; E375-Q460 HydrophobicContact CG-CG 4.4Å
376	S	86.7	Confident	82.1	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.4	-46.1	172.1	-73.3	0	0	0	0	111.3	S373 R378 K379 V380 L412	S373-S376 WeakPolarHBondContact O-CB 3.46Å; S373-S376 PolarHBondContact O-N 3.16Å; S373-S376 VanDerWaalsContact O-N 3.16Å; S373-S376 PolarHBondContact OG-N 3.07Å; S373-S376 PolarHBondContact OG-OG 3.04Å; S376-R378 VanDerWaalsContact C-N 3.32Å; S376-R378 PolarHBondContact O-N 2.95Å; S376-K379 WeakPolarHBondContact O-CB 3.4Å; S376-K379 PolarHBondContact O-N 2.89Å; S376-K379 VanDerWaalsContact O-N 3.14Å; S376-V380 WeakPolarHBondContact O-CG2 3.46Å; S376-V380 PolarHBondContact O-N 3Å; S376-L412 WeakPolarHBondContact CB-O 3.42Å; S376-L412 PolarHBondContact OG-O 3.02Å
377	F	87.9	Confident	80	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-54.3	-47.5	173.1	178.4	-83.7	0	0	0	111.5	I323 D327 L328 L363 V364 R367 I372 S373 E375 K379 V380 C381	I323-F377 HydrophobicContact CG2-CD2 4.35Å; I323-F377 HydrophobicContact CG2-CE1 4.32Å; I323-F377 HydrophobicContact CG2-CE2 3.69Å; I323-F377 HydrophobicContact CG2-CZ 3.69Å; D327-F377 HydrophobicContact CB-CD1 3.79Å; D327-F377 HydrophobicContact CB-CE1 3.8Å; L328-F377 HydrophobicContact CB-CE1 4.31Å; L328-F377 HydrophobicContact CB-CZ 4.46Å; L363-F377 HydrophobicContact CB-CD2 3.85Å; L363-F377 HydrophobicContact CB-CE2 3.56Å; V364-F377 HydrophobicContact CG2-CE2 4.39Å; R367-F377 HydrophobicContact CB-CD2 3.98Å; R367-F377 HydrophobicContact CG-CD2 4.32Å; I372-F377 HydrophobicContact CD1-CB 3.98Å; I372-F377 HydrophobicContact CD1-CD2 4.21Å; S373-F377 PolarHBondContact O-N 2.89Å; E375-F377 VanDerWaalsContact C-N 3.34Å; E375-F377 PolarHBondContact O-N 3.45Å; F377-K379 PolarHBondContact O-N 3.14Å; F377-V380 PolarHBondContact O-N 3.38Å; F377-C381 WeakPolarHBondContact CE1-SG 3.32Å; F377-C381 WeakPolarHBondContact O-CB 3.47Å; F377-C381 PolarHBondContact O-N 2.81Å; F377-C381 PolarHBondContact O-SG 3.41Å
378	R	82.8	Confident	77.9	Confident	71 Å²	71	29 Å²	29	27%	0.268	17%	0.169	S	C	.	.	H	α-helix	trans	-62.8	-40.6	176.9	-73.3	-170.8	-67.8	-161	-9.3	112.7	A331 A374 E375 S376 S382	A331-R378 HydrophobicContact CB-CB 4.09Å; A331-R378 HydrophobicContact CB-CG 3.89Å; A374-R378 VanDerWaalsContact O-CG 3.3Å; A374-R378 WeakPolarHBondContact O-CG 3.15Å; A374-R378 PolarHBondContact O-N 3.3Å; E375-R378 PolarHBondContact O-N 3.3Å; E375-R378 IonicContact OE2-CZ 3.62Å; E375-R378 IonicContact OE2-NE 3.97Å; E375-R378 PolarHBondContact OE2-NE 3.47Å; E375-R378 IonicContact OE2-NH2 3.33Å; E375-R378 PolarHBondContact OE2-NH2 2.96Å; S376-R378 VanDerWaalsContact C-N 3.32Å; S376-R378 PolarHBondContact O-N 2.95Å; R378-S382 VanDerWaalsContact O-CB 3.22Å; R378-S382 WeakPolarHBondContact O-CB 3.48Å; R378-S382 PolarHBondContact O-N 2.82Å; R378-S382 PolarHBondContact O-OG 3.28Å
379	K	79.9	Confident	76	Confident	70 Å²	70	27.9 Å²	27.9	30%	0.304	16%	0.161	S	C	.	.	H	α-helix	trans	-62.1	-46.6	177.3	-74.8	171.7	179.6	171.1	0	110.7	E375 S376 F377 S382 A383 L412 D459	E375-K379 HydrophobicContact CG-CD 4.37Å; E375-K379 WeakPolarHBondContact O-CG 3.47Å; E375-K379 PolarHBondContact O-N 3.39Å; S376-K379 WeakPolarHBondContact O-CB 3.4Å; S376-K379 PolarHBondContact O-N 2.89Å; S376-K379 VanDerWaalsContact O-N 3.14Å; F377-K379 PolarHBondContact O-N 3.14Å; K379-S382 PolarHBondContact O-N 3.14Å; K379-A383 WeakPolarHBondContact O-CB 3.38Å; K379-A383 PolarHBondContact O-N 3.36Å; K379-L412 HydrophobicContact CB-CD1 4.09Å; K379-L412 HydrophobicContact CD-CD2 3.78Å; K379-D459 PolarHBondContact NZ-O 3.33Å
380	V	81	Confident	73.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-70.1	-46	178.9	-174.4	0	0	0	0	111.8	L363 S376 F377 S382 A383 I384 L406 I407 L412	L363-V380 HydrophobicContact CD1-CG1 4.27Å; L363-V380 HydrophobicContact CD2-CB 3.73Å; L363-V380 HydrophobicContact CD2-CG1 3.57Å; L363-V380 HydrophobicContact CD2-CG2 4.36Å; L363-V380 HydrophobicContact CG-CG1 4.47Å; S376-V380 WeakPolarHBondContact O-CG2 3.46Å; S376-V380 PolarHBondContact O-N 3Å; F377-V380 PolarHBondContact O-N 3.38Å; V380-S382 PolarHBondContact O-N 3.32Å; V380-A383 WeakPolarHBondContact O-CB 3.44Å; V380-A383 PolarHBondContact O-N 2.77Å; V380-I384 HydrophobicContact CG1-CD1 3.71Å; V380-I384 HydrophobicContact CG1-CG1 4.15Å; V380-I384 WeakPolarHBondContact O-CG1 3.38Å; V380-I384 PolarHBondContact O-N 3.29Å; V380-L406 HydrophobicContact CG1-CB 3.85Å; V380-L406 HydrophobicContact CG1-CD1 4.07Å; V380-I407 HydrophobicContact CG2-CG1 3.97Å; V380-L412 HydrophobicContact CG2-CD1 3.42Å; V380-L412 VanDerWaalsContact CG2-CD1 3.42Å
381	C	77.2	Confident	71.8	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-55.5	-40.8	173.4	-82.4	0	0	0	0	111.7	A331 L355 F377 G385	A331-C381 HydrophobicContact CB-CB 3.46Å; A331-C381 VanDerWaalsContact CB-CB 3.46Å; L355-C381 HydrophobicContact CD1-CB 4.43Å; F377-C381 WeakPolarHBondContact CE1-SG 3.32Å; F377-C381 WeakPolarHBondContact O-CB 3.47Å; F377-C381 PolarHBondContact O-N 2.81Å; F377-C381 PolarHBondContact O-SG 3.41Å; C381-G385 VanDerWaalsContact O-CA 3.32Å; C381-G385 WeakPolarHBondContact O-CA 3.42Å; C381-G385 PolarHBondContact O-N 3.13Å
382	S	71	Confident	70.1	Confident	24 Å²	24	25.6 Å²	25.6	17%	0.168	14%	0.137	C	C	.	.	H	α-helix	trans	-67.2	-40.7	174.9	-60.9	0	0	0	0	111.4	A331 R378 K379 V380 T386	A331-S382 PolarHBondContact O-OG 2.91Å; R378-S382 VanDerWaalsContact O-CB 3.22Å; R378-S382 WeakPolarHBondContact O-CB 3.48Å; R378-S382 PolarHBondContact O-N 2.82Å; R378-S382 PolarHBondContact O-OG 3.28Å; K379-S382 PolarHBondContact O-N 3.14Å; V380-S382 PolarHBondContact O-N 3.32Å; S382-T386 WeakPolarHBondContact O-CB 3.34Å; S382-T386 VanDerWaalsContact O-CG2 3.25Å; S382-T386 WeakPolarHBondContact O-CG2 3.49Å; S382-T386 PolarHBondContact O-N 2.43Å; S382-T386 PolarHBondContact O-OG1 2.9Å
383	A	69.9	Low	68.3	Low	28 Å²	28	28.5 Å²	28.5	23%	0.231	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-42.2	179.1	0	0	0	0	0	112.5	K379 V380 T386 L406	K379-A383 WeakPolarHBondContact O-CB 3.38Å; K379-A383 PolarHBondContact O-N 3.36Å; V380-A383 WeakPolarHBondContact O-CB 3.44Å; V380-A383 PolarHBondContact O-N 2.77Å; A383-T386 PolarHBondContact O-OG1 3.22Å; A383-L406 HydrophobicContact CB-CD1 4.34Å
384	I	68.7	Low	66.4	Low	4 Å²	4	33.9 Å²	33.9	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-75.9	-50.8	177.8	-61.5	169.8	0	0	0	111.4	L355 D359 L363 V380 T386 R389 A403 L406	L355-I384 HydrophobicContact CD2-CB 3.61Å; L355-I384 HydrophobicContact CD2-CD1 3.79Å; L355-I384 HydrophobicContact CD2-CG1 4.31Å; L355-I384 HydrophobicContact CD2-CG2 3.43Å; L355-I384 VanDerWaalsContact CD2-CG2 3.43Å; L355-I384 HydrophobicContact CG-CB 4.43Å; L355-I384 HydrophobicContact CG-CG2 4Å; D359-I384 HydrophobicContact CB-CD1 4.26Å; L363-I384 HydrophobicContact CD1-CD1 4.12Å; V380-I384 HydrophobicContact CG1-CD1 3.71Å; V380-I384 HydrophobicContact CG1-CG1 4.15Å; V380-I384 WeakPolarHBondContact O-CG1 3.38Å; V380-I384 PolarHBondContact O-N 3.29Å; I384-T386 VanDerWaalsContact C-N 3.3Å; I384-T386 PolarHBondContact O-N 3.46Å; I384-R389 VanDerWaalsContact CG2-NH1 3.33Å; I384-A403 HydrophobicContact CD1-CB 3.92Å; I384-L406 HydrophobicContact CD1-CD1 3.98Å; I384-L406 HydrophobicContact CG1-CD1 3.29Å
385	G	59.2	Low	64.6	Low	22 Å²	22	39 Å²	39	23%	0.227	20%	0.199	C	C	.	.	H	α-helix	trans	-77.5	-14.2	-173.1	0	0	0	0	0	113.4	C381	C381-G385 VanDerWaalsContact O-CA 3.32Å; C381-G385 WeakPolarHBondContact O-CA 3.42Å; C381-G385 PolarHBondContact O-N 3.13Å
386	T	54.6	Low	62.9	Low	10 Å²	10	42.9 Å²	42.9	6%	0.061	22%	0.221	C	C	.	.	S	Bend	trans	-73	144.1	163.8	44.2	0	0	0	0	109.5	K335 L339 S382 A383 I384 C388 R389	K335-T386 HydrophobicContact CB-CG2 4.14Å; K335-T386 HydrophobicContact CD-CG2 3.72Å; L339-T386 HydrophobicContact CD1-CG2 3.61Å; S382-T386 WeakPolarHBondContact O-CB 3.34Å; S382-T386 VanDerWaalsContact O-CG2 3.25Å; S382-T386 WeakPolarHBondContact O-CG2 3.49Å; S382-T386 PolarHBondContact O-N 2.43Å; S382-T386 PolarHBondContact O-OG1 2.9Å; A383-T386 PolarHBondContact O-OG1 3.22Å; I384-T386 VanDerWaalsContact C-N 3.3Å; I384-T386 PolarHBondContact O-N 3.46Å; T386-C388 PolarHBondContact O-N 2.84Å; T386-C388 WeakPolarHBondContact OG1-CB 3.39Å; T386-R389 PolarHBondContact O-N 2.79Å
387	S	49.3	Very low	60.9	Low	3 Å²	3	45 Å²	45	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-52.2	-2.8	158.9	-56.3	0	0	0	0	114.8	L339 Y343 R389 V390 V391	L339-S387 VanDerWaalsContact CD2-CB 3.5Å; Y343-S387 WeakPolarHBondContact CE2-OG 3.46Å; Y343-S387 WeakPolarHBondContact OH-CB 3.35Å; Y343-S387 PolarHBondContact OH-OG 2.96Å; S387-R389 PolarHBondContact O-N 2.96Å; S387-V390 CarbonylContact O-C 3.19Å; S387-V390 PolarHBondContact O-N 3.01Å; S387-V390 VanDerWaalsContact O-N 3.15Å; S387-V391 WeakPolarHBondContact O-CA 3.29Å; S387-V391 WeakPolarHBondContact O-CB 3.3Å; S387-V391 WeakPolarHBondContact O-CG2 3.44Å; S387-V391 PolarHBondContact O-N 2.79Å
388	C	49.5	Very low	58.9	Low	53 Å²	53	55.2 Å²	55.2	36%	0.358	28%	0.281	S	S	.	.	H	α-helix	trans	-56.3	-36.3	164.2	-66.2	0	0	0	0	111.3	T386 R392	T386-C388 PolarHBondContact O-N 2.84Å; T386-C388 WeakPolarHBondContact OG1-CB 3.39Å; C388-R392 WeakPolarHBondContact O-CB 3.47Å; C388-R392 WeakPolarHBondContact O-CD 3.25Å; C388-R392 WeakPolarHBondContact O-CG 2.99Å; C388-R392 PolarHBondContact O-N 3.2Å
389	R	52.5	Low	57.6	Low	39 Å²	39	52.3 Å²	52.3	15%	0.147	27%	0.271	C	S	.	.	H	α-helix	trans	-65.5	-46.1	172.1	-162.3	175.8	-177.9	179.5	0.1	111	D359 I384 T386 S387 R392 I393 D399 H400 R401	D359-R389 IonicContact OD2-CZ 2.93Å; D359-R389 IonicContact OD2-NH1 3.87Å; D359-R389 PolarHBondContact OD2-NH1 2.76Å; D359-R389 IonicContact OD2-NH2 3.36Å; I384-R389 VanDerWaalsContact CG2-NH1 3.33Å; T386-R389 PolarHBondContact O-N 2.79Å; S387-R389 PolarHBondContact O-N 2.96Å; R389-R392 PolarHBondContact O-N 2.78Å; R389-I393 HydrophobicContact CG-CD1 3.92Å; R389-I393 VanDerWaalsContact O-CB 3.3Å; R389-I393 WeakPolarHBondContact O-CB 3.42Å; R389-I393 WeakPolarHBondContact O-CD1 3.36Å; R389-I393 WeakPolarHBondContact O-CG1 3.44Å; R389-I393 PolarHBondContact O-N 2.88Å; R389-D399 WeakPolarHBondContact CG-O 3.46Å; R389-D399 PolarHBondContact NE-O 3Å; R389-H400 PolarHBondContact NH2-O 2.83Å; R389-R401 PolarHBondContact NH2-O 3Å; R389-R401 VanDerWaalsContact NH2-O 3.14Å
390	V	48.2	Very low	56.7	Low	27 Å²	27	55.5 Å²	55.5	16%	0.164	29%	0.287	C	S	.	.	H	α-helix	trans	-66.5	-42.4	178.8	-178.4	0	0	0	0	112.4	P351 S387 I393 L394	P351-V390 HydrophobicContact CB-CG1 4.21Å; P351-V390 HydrophobicContact CG-CB 4.21Å; P351-V390 HydrophobicContact CG-CG1 3.56Å; P351-V390 HydrophobicContact CG-CG2 4.27Å; S387-V390 CarbonylContact O-C 3.19Å; S387-V390 PolarHBondContact O-N 3.01Å; S387-V390 VanDerWaalsContact O-N 3.15Å; V390-I393 PolarHBondContact O-N 3.28Å; V390-L394 HydrophobicContact CG1-CD1 3.66Å; V390-L394 HydrophobicContact CG1-CG 4.11Å; V390-L394 VanDerWaalsContact O-CB 3.25Å; V390-L394 WeakPolarHBondContact O-CB 3.5Å; V390-L394 WeakPolarHBondContact O-CG 3.01Å; V390-L394 PolarHBondContact O-N 2.93Å
391	V	47.2	Very low	56	Low	22 Å²	22	58.3 Å²	58.3	13%	0.133	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-42	177.7	171.2	0	0	0	0	110.1	W342 S387 L394 Q395	W342-V391 HydrophobicContact CE3-CG2 4.41Å; W342-V391 HydrophobicContact CH2-CB 4.47Å; W342-V391 HydrophobicContact CH2-CG1 4.25Å; W342-V391 HydrophobicContact CH2-CG2 3.37Å; W342-V391 HydrophobicContact CZ2-CG1 4.31Å; W342-V391 HydrophobicContact CZ2-CG2 4.03Å; W342-V391 HydrophobicContact CZ3-CG2 3.58Å; S387-V391 WeakPolarHBondContact O-CA 3.29Å; S387-V391 WeakPolarHBondContact O-CB 3.3Å; S387-V391 WeakPolarHBondContact O-CG2 3.44Å; S387-V391 PolarHBondContact O-N 2.79Å; V391-L394 PolarHBondContact O-N 3.02Å; V391-Q395 VanDerWaalsContact CG1-CD 3.47Å; V391-Q395 HydrophobicContact CG1-CG 4.15Å; V391-Q395 VanDerWaalsContact CG1-OE1 3.22Å; V391-Q395 WeakPolarHBondContact O-CB 3.42Å; V391-Q395 WeakPolarHBondContact O-CG 3.28Å; V391-Q395 PolarHBondContact O-N 2.64Å
392	R	53.2	Low	55.9	Low	107 Å²	107	60.1 Å²	60.1	40%	0.404	31%	0.31	S	S	.	.	H	α-helix	trans	-69.1	-35.5	173.5	-72.5	172.7	-179.8	173.7	-0	113	C388 R389 D396 G397 D399 R401	C388-R392 WeakPolarHBondContact O-CB 3.47Å; C388-R392 WeakPolarHBondContact O-CD 3.25Å; C388-R392 WeakPolarHBondContact O-CG 2.99Å; C388-R392 PolarHBondContact O-N 3.2Å; R389-R392 PolarHBondContact O-N 2.78Å; R392-D396 PolarHBondContact O-N 3.41Å; R392-G397 PolarHBondContact O-N 3.19Å; R392-D399 HydrophobicContact CB-CB 3.75Å; R392-D399 VanDerWaalsContact CD-OD2 3.23Å; R392-D399 WeakPolarHBondContact CD-OD2 3.22Å; R392-D399 IonicContact CZ-OD2 3.63Å; R392-D399 IonicContact NE-OD2 2.86Å; R392-D399 IonicContact NH1-OD2 3.69Å; R392-D399 PolarHBondContact NH1-OD2 3.3Å; R392-R401 VanDerWaalsContact NH1-NH2 3.14Å
393	I	54.2	Low	56.2	Low	64 Å²	64	59 Å²	59	33%	0.328	30%	0.302	S	S	.	.	H	α-helix	trans	-64.6	-43.9	171.6	-72	165.7	0	0	0	110	R389 V390 G397	R389-I393 HydrophobicContact CG-CD1 3.92Å; R389-I393 VanDerWaalsContact O-CB 3.3Å; R389-I393 WeakPolarHBondContact O-CB 3.42Å; R389-I393 WeakPolarHBondContact O-CD1 3.36Å; R389-I393 WeakPolarHBondContact O-CG1 3.44Å; R389-I393 PolarHBondContact O-N 2.88Å; V390-I393 PolarHBondContact O-N 3.28Å; I393-G397 VanDerWaalsContact O-CA 3.24Å; I393-G397 WeakPolarHBondContact O-CA 3.26Å; I393-G397 PolarHBondContact O-N 2.86Å; I393-G397 VanDerWaalsContact O-N 3.09Å
394	L	47.5	Very low	56.8	Low	118 Å²	118	61.3 Å²	61.3	62%	0.618	31%	0.311	S	S	*	.	H	α-helix	trans	-74.9	-31.4	-178.6	-71.6	173.2	0	0	0	113.6	V390 V391	V390-L394 HydrophobicContact CG1-CD1 3.66Å; V390-L394 HydrophobicContact CG1-CG 4.11Å; V390-L394 VanDerWaalsContact O-CB 3.25Å; V390-L394 WeakPolarHBondContact O-CB 3.5Å; V390-L394 WeakPolarHBondContact O-CG 3.01Å; V390-L394 PolarHBondContact O-N 2.93Å; V391-L394 PolarHBondContact O-N 3.02Å
395	Q	50.9	Low	57.4	Low	132 Å²	132	66 Å²	66	62%	0.617	33%	0.334	S	S	*	.	H	α-helix	trans	-88.2	-45.1	-178.7	-71.9	179	-29.4	0	0	112.4	V391	V391-Q395 VanDerWaalsContact CG1-CD 3.47Å; V391-Q395 HydrophobicContact CG1-CG 4.15Å; V391-Q395 VanDerWaalsContact CG1-OE1 3.22Å; V391-Q395 WeakPolarHBondContact O-CB 3.42Å; V391-Q395 WeakPolarHBondContact O-CG 3.28Å; V391-Q395 PolarHBondContact O-N 2.64Å
396	D	49.7	Very low	58.4	Low	107 Å²	107	65.2 Å²	65.2	57%	0.572	32%	0.324	S	S	*	.	H	α-helix	trans	-120.9	-6.5	-168.1	-57	-34	0	0	0	113.3	R392 R398	R392-D396 PolarHBondContact O-N 3.41Å; D396-R398 HydrophobicContact CB-CB 4.34Å; D396-R398 WeakPolarHBondContact O-CB 3.45Å; D396-R398 WeakPolarHBondContact O-CG 3.36Å; D396-R398 PolarHBondContact O-N 2.74Å
397	G	44.6	Very low	59.7	Low	44 Å²	44	65.1 Å²	65.1	45%	0.454	32%	0.323	S	S	.	.	S	Bend	trans	65.7	15.5	-176.5	0	0	0	0	0	114.7	R392 I393	R392-G397 PolarHBondContact O-N 3.19Å; I393-G397 VanDerWaalsContact O-CA 3.24Å; I393-G397 WeakPolarHBondContact O-CA 3.26Å; I393-G397 PolarHBondContact O-N 2.86Å; I393-G397 VanDerWaalsContact O-N 3.09Å
398	R	45.9	Very low	61.3	Low	214 Å²	214	72.3 Å²	72.3	81%	0.808	35%	0.354	S	S	*	.			trans	-133.9	17.6	-155	-81.3	-177	-151.5	-156	7.7	118.5	D396	D396-R398 HydrophobicContact CB-CB 4.34Å; D396-R398 WeakPolarHBondContact O-CB 3.45Å; D396-R398 WeakPolarHBondContact O-CG 3.36Å; D396-R398 PolarHBondContact O-N 2.74Å
399	D	56.2	Low	62.8	Low	10 Å²	10	74.5 Å²	74.5	5%	0.053	36%	0.362	C	S	.	.			trans	-117.2	69.8	171.4	-147.4	-14.5	0	0	0	113.5	R389 R392 R401	R389-D399 WeakPolarHBondContact CG-O 3.46Å; R389-D399 PolarHBondContact NE-O 3Å; R392-D399 HydrophobicContact CB-CB 3.75Å; R392-D399 VanDerWaalsContact CD-OD2 3.23Å; R392-D399 WeakPolarHBondContact CD-OD2 3.22Å; R392-D399 IonicContact CZ-OD2 3.63Å; R392-D399 IonicContact NE-OD2 2.86Å; R392-D399 IonicContact NH1-OD2 3.69Å; R392-D399 PolarHBondContact NH1-OD2 3.3Å; D399-R401 VanDerWaalsContact C-N 3.29Å; D399-R401 WeakPolarHBondContact OD1-CB 3.48Å; D399-R401 WeakPolarHBondContact OD1-CG 3.25Å; D399-R401 IonicContact OD1-CZ 2.77Å; D399-R401 IonicContact OD1-NE 2.82Å; D399-R401 PolarHBondContact OD1-NE 3.15Å; D399-R401 IonicContact OD1-NH2 2.86Å; D399-R401 PolarHBondContact OD1-NH2 2.88Å; D399-R401 IonicContact OD2-CZ 3.66Å; D399-R401 IonicContact OD2-NE 3.96Å; D399-R401 IonicContact OD2-NH2 3.82Å; D399-R401 PolarHBondContact OD2-NH2 3.02Å
400	H	60.8	Low	64.1	Low	138 Å²	138	76.6 Å²	76.6	64%	0.639	38%	0.376	S	S	*	.			trans	-86.3	5.3	170.2	-65.3	-67.2	0	0	0	113.4	R389 S402	R389-H400 PolarHBondContact NH2-O 2.83Å; H400-S402 PolarHBondContact O-N 2.76Å
401	R	65.8	Low	65.8	Low	58 Å²	58	80 Å²	80	22%	0.219	39%	0.393	C	S	.	.			trans	-55	125.4	-174.2	-69.7	-177	-67	-178.1	-5	110.9	R389 R392 D399 M405 L406 D409	R389-R401 PolarHBondContact NH2-O 3Å; R389-R401 VanDerWaalsContact NH2-O 3.14Å; R392-R401 VanDerWaalsContact NH1-NH2 3.14Å; D399-R401 VanDerWaalsContact C-N 3.29Å; D399-R401 WeakPolarHBondContact OD1-CB 3.48Å; D399-R401 WeakPolarHBondContact OD1-CG 3.25Å; D399-R401 IonicContact OD1-CZ 2.77Å; D399-R401 IonicContact OD1-NE 2.82Å; D399-R401 PolarHBondContact OD1-NE 3.15Å; D399-R401 IonicContact OD1-NH2 2.86Å; D399-R401 PolarHBondContact OD1-NH2 2.88Å; D399-R401 IonicContact OD2-CZ 3.66Å; D399-R401 IonicContact OD2-NE 3.96Å; D399-R401 IonicContact OD2-NH2 3.82Å; D399-R401 PolarHBondContact OD2-NH2 3.02Å; R401-M405 HydrophobicContact CB-CB 3.8Å; R401-M405 HydrophobicContact CB-SD 4.27Å; R401-M405 HydrophobicContact CG-CB 4.04Å; R401-M405 HydrophobicContact CG-SD 4.11Å; R401-L406 HydrophobicContact CB-CD2 4.27Å; R401-L406 HydrophobicContact CB-CG 4.03Å; R401-L406 VanDerWaalsContact CZ-CD2 3.49Å; R401-D409 WeakPolarHBondContact CD-OD2 3.38Å; R401-D409 IonicContact CZ-OD2 3.99Å; R401-D409 IonicContact NE-OD2 3.48Å; R401-D409 IonicContact NH1-OD2 3.24Å; R401-D409 PolarHBondContact NH1-OD2 3.02Å
402	S	75.1	Confident	67.6	Low	38 Å²	38	79.4 Å²	79.4	27%	0.266	39%	0.389	S	S	.	.			trans	-66.6	165.5	171.3	61.6	0	0	0	0	110.1	H400 D404 M405 L406	H400-S402 PolarHBondContact O-N 2.76Å; S402-D404 PolarHBondContact O-N 3.06Å; S402-M405 PolarHBondContact O-N 3.48Å; S402-M405 VanDerWaalsContact O-N 3.11Å; S402-M405 PolarHBondContact OG-N 3Å; S402-L406 PolarHBondContact O-N 3.1Å
403	A	78.4	Confident	69.3	Low	0 Å²	0	78.3 Å²	78.3	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-47.5	-42.8	168.7	0	0	0	0	0	112.9	D359 T362 L363 I384 M405 L406 I407	D359-A403 HydrophobicContact CB-CB 4.36Å; D359-A403 PolarHBondContact OD1-N 3.17Å; T362-A403 HydrophobicContact CG2-CB 3.65Å; L363-A403 HydrophobicContact CD1-CB 4.24Å; L363-A403 HydrophobicContact CD2-CB 3.91Å; L363-A403 HydrophobicContact CG-CB 3.68Å; I384-A403 HydrophobicContact CD1-CB 3.92Å; A403-M405 PolarHBondContact O-N 2.78Å; A403-L406 PolarHBondContact O-N 3.08Å; A403-I407 VanDerWaalsContact O-CG1 3.29Å; A403-I407 WeakPolarHBondContact O-CG1 3.5Å; A403-I407 PolarHBondContact O-N 3.14Å
404	D	82.4	Confident	70.9	Confident	77 Å²	77	76 Å²	76	41%	0.412	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-43.6	178.1	-77.1	-42.5	0	0	0	113.3	T362 S402 L406 I407 K408	T362-D404 HydrophobicContact CG2-CB 4.3Å; T362-D404 WeakPolarHBondContact CG2-OD1 3.33Å; T362-D404 WeakPolarHBondContact CG2-OD2 3.41Å; S402-D404 PolarHBondContact O-N 3.06Å; D404-L406 VanDerWaalsContact C-N 3.32Å; D404-L406 PolarHBondContact O-N 3.11Å; D404-I407 PolarHBondContact O-N 3.01Å; D404-K408 WeakPolarHBondContact O-CG 3.13Å; D404-K408 PolarHBondContact O-N 3.27Å
405	M	81.1	Confident	72.9	Confident	104 Å²	104	72 Å²	72	51%	0.512	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-42.2	177.1	-72	-179.3	177.6	0	0	110.7	R401 S402 A403 I407 K408 D409	R401-M405 HydrophobicContact CB-CB 3.8Å; R401-M405 HydrophobicContact CB-SD 4.27Å; R401-M405 HydrophobicContact CG-CB 4.04Å; R401-M405 HydrophobicContact CG-SD 4.11Å; S402-M405 PolarHBondContact O-N 3.48Å; S402-M405 VanDerWaalsContact O-N 3.11Å; S402-M405 PolarHBondContact OG-N 3Å; A403-M405 PolarHBondContact O-N 2.78Å; M405-I407 PolarHBondContact O-N 3.31Å; M405-K408 PolarHBondContact O-N 2.94Å; M405-D409 WeakPolarHBondContact O-CB 3.38Å; M405-D409 VanDerWaalsContact O-CG 3.22Å; M405-D409 PolarHBondContact O-N 3.4Å
406	L	79.2	Confident	74.6	Confident	5 Å²	5	69.6 Å²	69.6	3%	0.026	36%	0.357	C	S	.	.	H	α-helix	trans	-66.8	-36.5	178.3	-72.9	170.2	0	0	0	113	V380 A383 I384 R401 S402 A403 D404 K408 L410	V380-L406 HydrophobicContact CG1-CB 3.85Å; V380-L406 HydrophobicContact CG1-CD1 4.07Å; A383-L406 HydrophobicContact CB-CD1 4.34Å; I384-L406 HydrophobicContact CD1-CD1 3.98Å; I384-L406 HydrophobicContact CG1-CD1 3.29Å; R401-L406 HydrophobicContact CB-CD2 4.27Å; R401-L406 HydrophobicContact CB-CG 4.03Å; R401-L406 VanDerWaalsContact CZ-CD2 3.49Å; S402-L406 PolarHBondContact O-N 3.1Å; A403-L406 PolarHBondContact O-N 3.08Å; D404-L406 VanDerWaalsContact C-N 3.32Å; D404-L406 PolarHBondContact O-N 3.11Å; L406-K408 VanDerWaalsContact C-N 3.29Å; L406-K408 PolarHBondContact O-N 3.27Å; L406-L410 HydrophobicContact CD2-CD1 4.37Å; L406-L410 VanDerWaalsContact O-CB 3.23Å; L406-L410 WeakPolarHBondContact O-CB 3.31Å; L406-L410 WeakPolarHBondContact O-CG 3.47Å; L406-L410 PolarHBondContact O-N 3.26Å; L406-L410 VanDerWaalsContact O-N 3.09Å
407	I	81.8	Confident	76.5	Confident	8 Å²	8	67.9 Å²	67.9	4%	0.041	35%	0.348	C	S	.	.	H	α-helix	trans	-59.7	-43.7	174.8	-69.6	165.8	0	0	0	110.3	L363 A366 I372 V380 A403 D404 M405 N411 L412 I413	L363-I407 HydrophobicContact CD2-CD1 4.2Å; A366-I407 HydrophobicContact CB-CD1 4.17Å; I372-I407 HydrophobicContact CD1-CD1 4.25Å; I372-I407 HydrophobicContact CG2-CD1 4.04Å; I372-I407 HydrophobicContact CG2-CG1 4.1Å; I372-I407 HydrophobicContact CG2-CG2 3.75Å; V380-I407 HydrophobicContact CG2-CG1 3.97Å; A403-I407 VanDerWaalsContact O-CG1 3.29Å; A403-I407 WeakPolarHBondContact O-CG1 3.5Å; A403-I407 PolarHBondContact O-N 3.14Å; D404-I407 PolarHBondContact O-N 3.01Å; M405-I407 PolarHBondContact O-N 3.31Å; I407-N411 PolarHBondContact O-N 3.47Å; I407-L412 PolarHBondContact O-N 3.42Å; I407-I413 HydrophobicContact CG2-CG1 3.98Å
408	K	84.1	Confident	78.6	Confident	153 Å²	153	69.6 Å²	69.6	67%	0.665	35%	0.345	S	S	*	.	H	α-helix	trans	-71.6	-52.9	179.8	-68	176.6	-177.4	178.5	0	112.1	D404 M405 L406 L410 N411	D404-K408 WeakPolarHBondContact O-CG 3.13Å; D404-K408 PolarHBondContact O-N 3.27Å; M405-K408 PolarHBondContact O-N 2.94Å; L406-K408 VanDerWaalsContact C-N 3.29Å; L406-K408 PolarHBondContact O-N 3.27Å; K408-L410 VanDerWaalsContact C-N 3.28Å; K408-L410 PolarHBondContact O-N 2.74Å; K408-N411 PolarHBondContact O-N 3.36Å
409	D	79.8	Confident	80.8	Confident	99 Å²	99	66.8 Å²	66.8	53%	0.529	34%	0.341	S	S	.	.	H	α-helix	trans	-60.5	-36.8	-176.2	-74.5	2.2	0	0	0	112.8	R401 M405 N411	R401-D409 WeakPolarHBondContact CD-OD2 3.38Å; R401-D409 IonicContact CZ-OD2 3.99Å; R401-D409 IonicContact NE-OD2 3.48Å; R401-D409 IonicContact NH1-OD2 3.24Å; R401-D409 PolarHBondContact NH1-OD2 3.02Å; M405-D409 WeakPolarHBondContact O-CB 3.38Å; M405-D409 VanDerWaalsContact O-CG 3.22Å; M405-D409 PolarHBondContact O-N 3.4Å; D409-N411 VanDerWaalsContact C-N 3.29Å
410	L	79.5	Confident	82.5	Confident	83 Å²	83	68.2 Å²	68.2	44%	0.435	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	4.8	-179.8	-60.3	175.2	0	0	0	112.6	L406 K408 L412	L406-L410 HydrophobicContact CD2-CD1 4.37Å; L406-L410 VanDerWaalsContact O-CB 3.23Å; L406-L410 WeakPolarHBondContact O-CB 3.31Å; L406-L410 WeakPolarHBondContact O-CG 3.47Å; L406-L410 PolarHBondContact O-N 3.26Å; L406-L410 VanDerWaalsContact O-N 3.09Å; K408-L410 VanDerWaalsContact C-N 3.28Å; K408-L410 PolarHBondContact O-N 2.74Å; L410-L412 VanDerWaalsContact C-N 3.29Å; L410-L412 HydrophobicContact CB-CD1 3.58Å; L410-L412 HydrophobicContact CB-CD2 4.33Å; L410-L412 HydrophobicContact CB-CG 3.55Å; L410-L412 HydrophobicContact CD1-CD1 3.83Å; L410-L412 HydrophobicContact CG-CD1 4.36Å; L410-L412 WeakPolarHBondContact O-CG 3.32Å; L410-L412 PolarHBondContact O-N 2.95Å
411	N	84.3	Confident	84.1	Confident	99 Å²	99	61.6 Å²	61.6	53%	0.529	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	44.9	-178.6	-164.9	14.7	0	0	0	112.9	I407 K408 D409 R461	I407-N411 PolarHBondContact O-N 3.47Å; K408-N411 PolarHBondContact O-N 3.36Å; D409-N411 VanDerWaalsContact C-N 3.29Å; N411-R461 PolarHBondContact ND2-NH1 3.33Å; N411-R461 VanDerWaalsContact ND2-NH1 3.16Å; N411-R461 WeakPolarHBondContact O-CD 3.32Å; N411-R461 PolarHBondContact O-NH1 3.36Å; N411-R461 PolarHBondContact OD1-NH1 2.78Å
412	L	85.7	Confident	85.4	Confident	9 Å²	9	61.3 Å²	61.3	5%	0.047	32%	0.32	C	S	.	.			trans	-94.3	6.1	-169	-68.8	178	0	0	0	114.8	S376 K379 V380 I407 L410	S376-L412 WeakPolarHBondContact CB-O 3.42Å; S376-L412 PolarHBondContact OG-O 3.02Å; K379-L412 HydrophobicContact CB-CD1 4.09Å; K379-L412 HydrophobicContact CD-CD2 3.78Å; V380-L412 HydrophobicContact CG2-CD1 3.42Å; V380-L412 VanDerWaalsContact CG2-CD1 3.42Å; I407-L412 PolarHBondContact O-N 3.42Å; L410-L412 VanDerWaalsContact C-N 3.29Å; L410-L412 HydrophobicContact CB-CD1 3.58Å; L410-L412 HydrophobicContact CB-CD2 4.33Å; L410-L412 HydrophobicContact CB-CG 3.55Å; L410-L412 HydrophobicContact CD1-CD1 3.83Å; L410-L412 HydrophobicContact CG-CD1 4.36Å; L410-L412 WeakPolarHBondContact O-CG 3.32Å; L410-L412 PolarHBondContact O-N 2.95Å
413	I	87.9	Confident	86.3	Confident	84 Å²	84	66.5 Å²	66.5	43%	0.431	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-60.7	139.4	176	-60.9	174.2	0	0	0	109.5	T371 I407	T371-I413 WeakPolarHBondContact O-CA 3.47Å; I407-I413 HydrophobicContact CG2-CG1 3.98Å
414	S	87.4	Confident	87	Confident	15 Å²	15	66.9 Å²	66.9	11%	0.105	34%	0.336	C	S	.	.			trans	-66.5	130.9	-179.3	-160.9	0	0	0	0	111.2	G370 T371 S416 R461	G370-S414 VanDerWaalsContact O-CB 3.22Å; G370-S414 WeakPolarHBondContact O-CB 3.43Å; T371-S414 WeakPolarHBondContact O-CB 3.37Å; T371-S414 PolarHBondContact O-N 2.91Å; S414-S416 PolarHBondContact O-N 3.18Å; S414-R461 CarbonylContact C-O 3.41Å; S414-R461 WeakPolarHBondContact CA-O 3.44Å; S414-R461 PolarHBondContact OG-O 2.99Å
415	I	89.4	Confident	87.6	Confident	35 Å²	35	63.2 Å²	63.2	18%	0.179	32%	0.317	C	S	.	.			trans	-72	106.9	168.3	-58.2	172	0	0	0	106.9	T420 I421 L458 R461	I415-T420 HydrophobicContact CG2-CG2 4.15Å; I415-I421 HydrophobicContact CG2-CG1 4.4Å; I415-L458 HydrophobicContact CD1-CB 4.14Å; I415-L458 HydrophobicContact CD1-CD2 3.99Å; I415-L458 HydrophobicContact CG2-CD2 4.49Å; I415-R461 HydrophobicContact CD1-CB 4.22Å; I415-R461 HydrophobicContact CG1-CB 4.13Å; I415-R461 PolarHBondContact N-O 3.39Å
416	S	87	Confident	88.2	Confident	81 Å²	81	64 Å²	64	57%	0.566	32%	0.317	S	S	*	.			trans	-108.3	-7.3	177.8	54.4	0	0	0	0	113.4	S414 M418	S414-S416 PolarHBondContact O-N 3.18Å; S416-M418 PolarHBondContact O-N 3.28Å
417	D	90	Very high	88.9	Confident	72 Å²	72	68.4 Å²	68.4	39%	0.385	34%	0.338	S	S	.	.			trans	-64.3	113.5	178.3	172.5	47.6	0	0	0	111.2	Q419 T420 I421	D417-Q419 VanDerWaalsContact C-N 3.27Å; D417-Q419 PolarHBondContact O-N 3.03Å; D417-Q419 PolarHBondContact OD1-N 3.03Å; D417-T420 PolarHBondContact O-N 3.47Å; D417-T420 WeakPolarHBondContact OD2-CB 3.36Å; D417-T420 PolarHBondContact OD2-N 2.74Å; D417-T420 PolarHBondContact OD2-OG1 2.91Å; D417-I421 WeakPolarHBondContact O-CG1 3.41Å; D417-I421 PolarHBondContact O-N 3.42Å; D417-I421 VanDerWaalsContact O-N 3.1Å
418	M	89.5	Confident	89.5	Confident	79 Å²	79	68.1 Å²	68.1	39%	0.389	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-32.9	-176.7	-76.1	-64.5	-65.8	0	0	112.6	S416 I421 E422 V470 R473	S416-M418 PolarHBondContact O-N 3.28Å; M418-I421 PolarHBondContact O-N 3.06Å; M418-E422 VanDerWaalsContact O-CB 3.29Å; M418-E422 WeakPolarHBondContact O-CB 3.44Å; M418-E422 WeakPolarHBondContact O-CG 3.43Å; M418-E422 PolarHBondContact O-N 2.88Å; M418-V470 HydrophobicContact CE-CG2 3.72Å; M418-V470 HydrophobicContact SD-CG2 4.26Å; M418-R473 VanDerWaalsContact CE-NH2 3.26Å
419	Q	91.7	Very high	89.9	Confident	156 Å²	156	61.8 Å²	61.8	73%	0.729	31%	0.31	S	S	*	.	H	α-helix	trans	-66	-45.8	179.4	-64.9	-175.3	-4.3	0	0	111.1	D417 R423	D417-Q419 VanDerWaalsContact C-N 3.27Å; D417-Q419 PolarHBondContact O-N 3.03Å; D417-Q419 PolarHBondContact OD1-N 3.03Å; Q419-R423 VanDerWaalsContact O-CB 3.26Å; Q419-R423 WeakPolarHBondContact O-CB 3.38Å; Q419-R423 PolarHBondContact O-N 3.14Å
420	T	92.3	Very high	90.6	Very high	39 Å²	39	60.2 Å²	60.2	24%	0.239	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-43.6	176.8	-61.1	0	0	0	0	111.7	I415 D417 T424 L458	I415-T420 HydrophobicContact CG2-CG2 4.15Å; D417-T420 PolarHBondContact O-N 3.47Å; D417-T420 WeakPolarHBondContact OD2-CB 3.36Å; D417-T420 PolarHBondContact OD2-N 2.74Å; D417-T420 PolarHBondContact OD2-OG1 2.91Å; T420-T424 WeakPolarHBondContact O-CB 3.31Å; T420-T424 PolarHBondContact O-N 2.86Å; T420-T424 VanDerWaalsContact O-N 3.09Å; T420-T424 PolarHBondContact O-OG1 3.28Å; T420-L458 HydrophobicContact CG2-CD2 4.02Å
421	I	92.6	Very high	91.2	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.8	-50.5	178	-62.6	169.2	0	0	0	110.4	I415 D417 M418 R423 T424 C425 V462 L467 V470	I415-I421 HydrophobicContact CG2-CG1 4.4Å; D417-I421 WeakPolarHBondContact O-CG1 3.41Å; D417-I421 PolarHBondContact O-N 3.42Å; D417-I421 VanDerWaalsContact O-N 3.1Å; M418-I421 PolarHBondContact O-N 3.06Å; I421-R423 PolarHBondContact O-N 3.19Å; I421-T424 PolarHBondContact O-N 2.84Å; I421-C425 PolarHBondContact O-N 2.66Å; I421-C425 PolarHBondContact O-SG 3.4Å; I421-V462 HydrophobicContact CD1-CG2 3.99Å; I421-V462 HydrophobicContact CG1-CG2 4.14Å; I421-L467 HydrophobicContact CG2-CD1 3.86Å; I421-V470 HydrophobicContact CG2-CB 4.21Å; I421-V470 HydrophobicContact CG2-CG1 4.22Å; I421-V470 HydrophobicContact CG2-CG2 4.01Å
422	E	93.6	Very high	91.6	Very high	52 Å²	52	58 Å²	58	24%	0.243	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-42.6	179.5	-78.6	-177.4	-162.5	0	0	112.8	M418 T424 C425 K426 V470 R473	M418-E422 VanDerWaalsContact O-CB 3.29Å; M418-E422 WeakPolarHBondContact O-CB 3.44Å; M418-E422 WeakPolarHBondContact O-CG 3.43Å; M418-E422 PolarHBondContact O-N 2.88Å; E422-T424 VanDerWaalsContact C-N 3.35Å; E422-C425 PolarHBondContact O-N 3.36Å; E422-K426 WeakPolarHBondContact O-CG 3.38Å; E422-K426 PolarHBondContact O-N 2.96Å; E422-V470 HydrophobicContact CG-CG1 3.79Å; E422-R473 IonicContact OE1-CZ 2.82Å; E422-R473 IonicContact OE1-NH1 3.57Å; E422-R473 PolarHBondContact OE1-NH1 2.92Å; E422-R473 IonicContact OE1-NH2 3.68Å; E422-R473 PolarHBondContact OE1-NH2 3.3Å
423	R	95	Very high	91.8	Very high	146 Å²	146	63.6 Å²	63.6	55%	0.551	33%	0.334	S	S	*	.	H	α-helix	trans	-58.1	-49.6	176.4	-178.8	179	67.2	-160.6	-3.7	110.7	Q419 I421 C425 K426 E427	Q419-R423 VanDerWaalsContact O-CB 3.26Å; Q419-R423 WeakPolarHBondContact O-CB 3.38Å; Q419-R423 PolarHBondContact O-N 3.14Å; I421-R423 PolarHBondContact O-N 3.19Å; R423-C425 VanDerWaalsContact C-N 3.34Å; R423-C425 PolarHBondContact O-N 3.01Å; R423-K426 PolarHBondContact O-N 2.95Å; R423-E427 WeakPolarHBondContact CG-OE1 3.46Å; R423-E427 WeakPolarHBondContact O-CG 3.36Å; R423-E427 PolarHBondContact O-N 2.9Å
424	T	93.7	Very high	92	Very high	8 Å²	8	67.3 Å²	67.3	5%	0.049	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-43.3	178.8	-49.8	0	0	0	0	111.2	T420 I421 E422 K426 E427 V428 A454 Q457 L458	T420-T424 WeakPolarHBondContact O-CB 3.31Å; T420-T424 PolarHBondContact O-N 2.86Å; T420-T424 VanDerWaalsContact O-N 3.09Å; T420-T424 PolarHBondContact O-OG1 3.28Å; I421-T424 PolarHBondContact O-N 2.84Å; E422-T424 VanDerWaalsContact C-N 3.35Å; T424-K426 PolarHBondContact O-N 3.46Å; T424-E427 PolarHBondContact O-N 2.65Å; T424-V428 WeakPolarHBondContact O-CG2 3.47Å; T424-V428 PolarHBondContact O-N 2.97Å; T424-A454 HydrophobicContact CG2-CB 4.4Å; T424-Q457 HydrophobicContact CG2-CB 3.84Å; T424-L458 HydrophobicContact CG2-CD1 4.38Å; T424-L458 HydrophobicContact CG2-CD2 4.35Å; T424-L458 HydrophobicContact CG2-CG 4.05Å; T424-L458 WeakPolarHBondContact OG1-CD2 3.28Å
425	C	93.3	Very high	92.2	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-42.9	176.2	-69.3	0	0	0	0	112.1	I421 E422 R423 V428 L429 L467 V470 F471 L474	I421-C425 PolarHBondContact O-N 2.66Å; I421-C425 PolarHBondContact O-SG 3.4Å; E422-C425 PolarHBondContact O-N 3.36Å; R423-C425 VanDerWaalsContact C-N 3.34Å; R423-C425 PolarHBondContact O-N 3.01Å; C425-V428 PolarHBondContact O-N 2.86Å; C425-L429 WeakPolarHBondContact O-CB 3.45Å; C425-L429 VanDerWaalsContact O-CG 3.25Å; C425-L429 WeakPolarHBondContact O-CG 3.33Å; C425-L429 PolarHBondContact O-N 3.37Å; C425-L467 VanDerWaalsContact SG-CD1 3.58Å; C425-V470 HydrophobicContact CB-CG1 4.17Å; C425-F471 HydrophobicContact CB-CD1 4.31Å; C425-F471 HydrophobicContact CB-CE1 4.07Å; C425-F471 HydrophobicContact CB-CE2 4.43Å; C425-F471 HydrophobicContact CB-CZ 4.14Å; C425-F471 VanDerWaalsContact SG-CE2 3.58Å; C425-L474 HydrophobicContact CB-CD1 3.47Å; C425-L474 VanDerWaalsContact CB-CD1 3.47Å
426	K	94	Very high	92.2	Very high	120 Å²	120	67.5 Å²	67.5	52%	0.522	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-43	176.2	-73.8	174.4	179.7	172.7	0	112	E422 R423 T424 L429 A430 L474	E422-K426 WeakPolarHBondContact O-CG 3.38Å; E422-K426 PolarHBondContact O-N 2.96Å; R423-K426 PolarHBondContact O-N 2.95Å; T424-K426 PolarHBondContact O-N 3.46Å; K426-L429 PolarHBondContact O-N 3.3Å; K426-A430 WeakPolarHBondContact O-CB 3.43Å; K426-A430 PolarHBondContact O-N 2.87Å; K426-L474 HydrophobicContact CG-CD1 4.15Å; K426-L474 HydrophobicContact CG-CD2 4.32Å
427	E	94.7	Very high	92.4	Very high	99 Å²	99	68.6 Å²	68.6	46%	0.463	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-44.6	175.7	-72.2	170	-169.5	0	0	111.7	R423 T424 A430 A431	R423-E427 WeakPolarHBondContact CG-OE1 3.46Å; R423-E427 WeakPolarHBondContact O-CG 3.36Å; R423-E427 PolarHBondContact O-N 2.9Å; T424-E427 PolarHBondContact O-N 2.65Å; E427-A430 PolarHBondContact O-N 2.82Å; E427-A431 WeakPolarHBondContact O-CB 3.22Å; E427-A431 PolarHBondContact O-N 2.9Å
428	V	93.9	Very high	92.4	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.006	34%	0.336	C	S	.	.	H	α-helix	trans	-65.1	-42.7	176.7	173.1	0	0	0	0	111.5	T424 C425 A430 A431 E432 L450 I453 A454 Q457 F471	T424-V428 WeakPolarHBondContact O-CG2 3.47Å; T424-V428 PolarHBondContact O-N 2.97Å; C425-V428 PolarHBondContact O-N 2.86Å; V428-A430 VanDerWaalsContact C-N 3.31Å; V428-A430 PolarHBondContact O-N 2.86Å; V428-A431 PolarHBondContact O-N 2.87Å; V428-E432 HydrophobicContact CG1-CG 4.45Å; V428-E432 VanDerWaalsContact O-CB 3.29Å; V428-E432 WeakPolarHBondContact O-CB 3.27Å; V428-E432 PolarHBondContact O-N 2.86Å; V428-L450 HydrophobicContact CG1-CD2 3.98Å; V428-I453 HydrophobicContact CG1-CB 4.23Å; V428-I453 HydrophobicContact CG1-CG2 4.12Å; V428-I453 HydrophobicContact CG2-CG2 3.86Å; V428-A454 HydrophobicContact CG2-CB 4Å; V428-Q457 VanDerWaalsContact CG2-OE1 3.24Å; V428-F471 HydrophobicContact CB-CE1 4.47Å; V428-F471 HydrophobicContact CB-CZ 4.18Å; V428-F471 HydrophobicContact CG1-CE1 4.29Å; V428-F471 HydrophobicContact CG1-CZ 3.99Å
429	L	93.3	Very high	92.5	Very high	20 Å²	20	65.8 Å²	65.8	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-37.1	175.9	-71.5	174.9	0	0	0	112.3	C425 K426 L436 L450 F471 L474 I475	C425-L429 WeakPolarHBondContact O-CB 3.45Å; C425-L429 VanDerWaalsContact O-CG 3.25Å; C425-L429 WeakPolarHBondContact O-CG 3.33Å; C425-L429 PolarHBondContact O-N 3.37Å; K426-L429 PolarHBondContact O-N 3.3Å; L429-L436 HydrophobicContact CD2-CB 4.44Å; L429-L436 HydrophobicContact CD2-CD1 3.9Å; L429-L436 HydrophobicContact CD2-CD2 4.19Å; L429-L436 HydrophobicContact CD2-CG 4.4Å; L429-L450 HydrophobicContact CD2-CD1 4.1Å; L429-F471 HydrophobicContact CD1-CD1 4.32Å; L429-F471 HydrophobicContact CD2-CD1 3.96Å; L429-F471 HydrophobicContact CD2-CE1 3.93Å; L429-F471 HydrophobicContact CG-CD1 4.08Å; L429-F471 HydrophobicContact CG-CE1 3.87Å; L429-L474 HydrophobicContact CD1-CB 3.96Å; L429-L474 HydrophobicContact CD1-CD1 4.38Å; L429-I475 HydrophobicContact CD1-CG1 4.3Å; L429-I475 HydrophobicContact CD2-CD1 4.2Å; L429-I475 HydrophobicContact CD2-CG1 4.06Å
430	A	92.8	Very high	92.4	Very high	66 Å²	66	64.1 Å²	64.1	55%	0.545	32%	0.318	S	S	.	.	H	α-helix	trans	-69.6	-36.9	176.6	0	0	0	0	0	112.5	K426 E427 V428 Q433	K426-A430 WeakPolarHBondContact O-CB 3.43Å; K426-A430 PolarHBondContact O-N 2.87Å; E427-A430 PolarHBondContact O-N 2.82Å; V428-A430 VanDerWaalsContact C-N 3.31Å; V428-A430 PolarHBondContact O-N 2.86Å; A430-Q433 WeakPolarHBondContact O-CG 3.43Å
431	A	93.8	Very high	92.3	Very high	79 Å²	79	69.4 Å²	69.4	65%	0.653	34%	0.337	S	S	*	.	H	α-helix	trans	-77.7	-35.3	178.6	0	0	0	0	0	113.2	E427 V428	E427-A431 WeakPolarHBondContact O-CB 3.22Å; E427-A431 PolarHBondContact O-N 2.9Å; V428-A431 PolarHBondContact O-N 2.87Å
432	E	92.6	Very high	92.1	Very high	57 Å²	57	72 Å²	72	27%	0.266	36%	0.364	S	S	.	.			trans	-107.2	45.3	-171.5	-68.9	-70.6	156.9	0	0	112.7	V428 K434 T435 L436 L450 I453	V428-E432 HydrophobicContact CG1-CG 4.45Å; V428-E432 VanDerWaalsContact O-CB 3.29Å; V428-E432 WeakPolarHBondContact O-CB 3.27Å; V428-E432 PolarHBondContact O-N 2.86Å; E432-K434 VanDerWaalsContact C-N 3.28Å; E432-K434 PolarHBondContact O-N 3.42Å; E432-T435 WeakPolarHBondContact O-CB 3.38Å; E432-T435 PolarHBondContact O-N 3.33Å; E432-T435 PolarHBondContact OE2-OG1 2.97Å; E432-L436 PolarHBondContact O-N 3.3Å; E432-L450 HydrophobicContact CB-CD2 3.69Å; E432-L450 HydrophobicContact CG-CD2 4.38Å; E432-I453 HydrophobicContact CG-CD1 3.66Å
433	Q	90.1	Very high	91.9	Very high	127 Å²	127	75.1 Å²	75.1	59%	0.593	38%	0.377	S	S	*	.	H	α-helix	trans	-54.7	-41.3	-176.2	-69.6	-177.5	-7.4	0	0	113.1	A430 T435 L436 E437	A430-Q433 WeakPolarHBondContact O-CG 3.43Å; Q433-T435 VanDerWaalsContact C-N 3.33Å; Q433-T435 PolarHBondContact O-N 2.84Å; Q433-L436 WeakPolarHBondContact O-CB 3.25Å; Q433-L436 PolarHBondContact O-N 2.93Å; Q433-E437 PolarHBondContact O-N 2.96Å
434	K	90.8	Very high	91.5	Very high	161 Å²	161	73 Å²	73	70%	0.7	38%	0.381	S	S	*	.	H	α-helix	trans	-61.5	-41.3	177.3	-174.5	178.6	179.4	179.1	0	112.3	E432 E437 D438	E432-K434 VanDerWaalsContact C-N 3.28Å; E432-K434 PolarHBondContact O-N 3.42Å; K434-E437 PolarHBondContact O-N 2.87Å; K434-D438 PolarHBondContact O-N 3.33Å
435	T	91.3	Very high	91.4	Very high	20 Å²	20	78.9 Å²	78.9	12%	0.123	41%	0.41	C	S	.	.	H	α-helix	trans	-68.7	-37.7	178.1	-55.5	0	0	0	0	110.6	E432 Q433 D438 Y439 A446 H449 L450	E432-T435 WeakPolarHBondContact O-CB 3.38Å; E432-T435 PolarHBondContact O-N 3.33Å; E432-T435 PolarHBondContact OE2-OG1 2.97Å; Q433-T435 VanDerWaalsContact C-N 3.33Å; Q433-T435 PolarHBondContact O-N 2.84Å; T435-D438 PolarHBondContact O-N 2.99Å; T435-Y439 PolarHBondContact O-N 3.37Å; T435-A446 HydrophobicContact CG2-CB 3.79Å; T435-A446 WeakPolarHBondContact O-CB 3.38Å; T435-H449 HydrophobicContact CG2-CB 4.08Å; T435-L450 HydrophobicContact CG2-CD2 3.81Å; T435-L450 HydrophobicContact CG2-CG 3.82Å
436	L	90.3	Very high	91.2	Very high	35 Å²	35	79.4 Å²	79.4	18%	0.183	41%	0.414	C	S	.	.	H	α-helix	trans	-62.1	-46	173.1	173.5	58.6	0	0	0	112	L429 E432 Q433 D438 Y439 K440 I475	L429-L436 HydrophobicContact CD2-CB 4.44Å; L429-L436 HydrophobicContact CD2-CD1 3.9Å; L429-L436 HydrophobicContact CD2-CD2 4.19Å; L429-L436 HydrophobicContact CD2-CG 4.4Å; E432-L436 PolarHBondContact O-N 3.3Å; Q433-L436 WeakPolarHBondContact O-CB 3.25Å; Q433-L436 PolarHBondContact O-N 2.93Å; L436-D438 VanDerWaalsContact C-N 3.33Å; L436-D438 PolarHBondContact O-N 3.43Å; L436-Y439 WeakPolarHBondContact O-CB 3.5Å; L436-Y439 PolarHBondContact O-N 2.95Å; L436-K440 HydrophobicContact CD1-CG 4.35Å; L436-K440 PolarHBondContact O-N 3.18Å; L436-I475 HydrophobicContact CD1-CD1 3.94Å; L436-I475 HydrophobicContact CD1-CG1 3.75Å; L436-I475 HydrophobicContact CD1-CG2 4.12Å
437	E	90.2	Very high	91.2	Very high	104 Å²	104	74 Å²	74	49%	0.486	39%	0.391	S	S	.	.	H	α-helix	trans	-61.1	-41.9	175.3	-73.5	-179.5	-165.2	0	0	112.4	Q433 K434 Y439 K440 K441	Q433-E437 PolarHBondContact O-N 2.96Å; K434-E437 PolarHBondContact O-N 2.87Å; E437-Y439 VanDerWaalsContact C-N 3.29Å; E437-Y439 PolarHBondContact O-N 3.41Å; E437-K440 PolarHBondContact O-N 2.77Å; E437-K441 WeakPolarHBondContact O-CB 3.4Å; E437-K441 VanDerWaalsContact O-CG 3.3Å; E437-K441 WeakPolarHBondContact O-CG 3.48Å; E437-K441 PolarHBondContact O-N 3.38Å; E437-K441 IonicContact OE2-NZ 3.75Å
438	D	91.7	Very high	91.1	Very high	41 Å²	41	76.7 Å²	76.7	22%	0.219	40%	0.401	C	S	.	.	H	α-helix	trans	-59.8	-40.7	175.6	-89.9	-22.1	0	0	0	111.4	K434 T435 L436 K441 K443 A446	K434-D438 PolarHBondContact O-N 3.33Å; T435-D438 PolarHBondContact O-N 2.99Å; L436-D438 VanDerWaalsContact C-N 3.33Å; L436-D438 PolarHBondContact O-N 3.43Å; D438-K441 PolarHBondContact O-N 2.8Å; D438-K443 HydrophobicContact CB-CB 4.44Å; D438-K443 HydrophobicContact CB-CD 3.97Å; D438-K443 VanDerWaalsContact O-CB 3.24Å; D438-K443 WeakPolarHBondContact O-CB 3.48Å; D438-K443 PolarHBondContact O-N 3.17Å; D438-K443 IonicContact OD1-NZ 3.67Å; D438-K443 PolarHBondContact OD1-NZ 3.32Å; D438-K443 IonicContact OD2-NZ 2.84Å; D438-A446 HydrophobicContact CB-CB 4.16Å
439	Y	90.5	Very high	91	Very high	51 Å²	51	79.9 Å²	79.9	20%	0.2	42%	0.416	C	S	.	.	H	α-helix	trans	-65.2	-46.2	173.9	-174	-108.7	0	0	0	112.1	T435 L436 E437 K441 G442 M447 I475	T435-Y439 PolarHBondContact O-N 3.37Å; L436-Y439 WeakPolarHBondContact O-CB 3.5Å; L436-Y439 PolarHBondContact O-N 2.95Å; E437-Y439 VanDerWaalsContact C-N 3.29Å; E437-Y439 PolarHBondContact O-N 3.41Å; Y439-K441 PolarHBondContact O-N 3.36Å; Y439-G442 WeakPolarHBondContact O-CA 3.43Å; Y439-G442 PolarHBondContact O-N 3.48Å; Y439-M447 HydrophobicContact CD1-CE 4.27Å; Y439-M447 HydrophobicContact CD2-CB 3.83Å; Y439-M447 HydrophobicContact CE1-CE 3.69Å; Y439-M447 HydrophobicContact CE2-CB 3.63Å; Y439-M447 HydrophobicContact CE2-CE 3.96Å; Y439-M447 HydrophobicContact CE2-CG 4.42Å; Y439-I475 HydrophobicContact CD1-CD1 3.88Å; Y439-I475 HydrophobicContact CD1-CG2 4.18Å; Y439-I475 HydrophobicContact CE1-CD1 4.05Å; Y439-I475 HydrophobicContact CE1-CG2 4.26Å
440	K	89	Confident	91.1	Very high	121 Å²	121	79 Å²	79	53%	0.526	41%	0.411	S	S	.	.	H	α-helix	trans	-61.4	-27.4	176.3	-72.9	-168.2	171.8	-164.4	0	112.4	L436 E437 G442 I475 S478	L436-K440 HydrophobicContact CD1-CG 4.35Å; L436-K440 PolarHBondContact O-N 3.18Å; E437-K440 PolarHBondContact O-N 2.77Å; K440-G442 PolarHBondContact O-N 3.02Å; K440-I475 HydrophobicContact CG-CG2 4.4Å; K440-S478 PolarHBondContact NZ-OXT 3.45Å
441	K	90.5	Very high	91.1	Very high	149 Å²	149	76.7 Å²	76.7	65%	0.648	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	3.7	171.7	-71	167.5	-176.1	160.8	0	114.2	E437 D438 Y439	E437-K441 WeakPolarHBondContact O-CB 3.4Å; E437-K441 VanDerWaalsContact O-CG 3.3Å; E437-K441 WeakPolarHBondContact O-CG 3.48Å; E437-K441 PolarHBondContact O-N 3.38Å; E437-K441 IonicContact OE2-NZ 3.75Å; D438-K441 PolarHBondContact O-N 2.8Å; Y439-K441 PolarHBondContact O-N 3.36Å
442	G	88.2	Confident	91.1	Very high	55 Å²	55	80.5 Å²	80.5	57%	0.567	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	4	176.7	0	0	0	0	0	115.4	Y439 K440 T444	Y439-G442 WeakPolarHBondContact O-CA 3.43Å; Y439-G442 PolarHBondContact O-N 3.48Å; K440-G442 PolarHBondContact O-N 3.02Å; G442-T444 PolarHBondContact O-N 2.83Å
443	K	89.8	Confident	91.1	Very high	117 Å²	117	79.4 Å²	79.4	51%	0.509	38%	0.383	S	S	.	.			trans	-78.8	88.9	175.9	-60.6	179	-175.5	163.6	0	110.6	D438 I445 A446	D438-K443 HydrophobicContact CB-CB 4.44Å; D438-K443 HydrophobicContact CB-CD 3.97Å; D438-K443 VanDerWaalsContact O-CB 3.24Å; D438-K443 WeakPolarHBondContact O-CB 3.48Å; D438-K443 PolarHBondContact O-N 3.17Å; D438-K443 IonicContact OD1-NZ 3.67Å; D438-K443 PolarHBondContact OD1-NZ 3.32Å; D438-K443 IonicContact OD2-NZ 2.84Å; K443-I445 PolarHBondContact O-N 3.23Å; K443-A446 VanDerWaalsContact O-CB 3.27Å; K443-A446 WeakPolarHBondContact O-CB 3.25Å; K443-A446 PolarHBondContact O-N 3.46Å
444	T	87.2	Confident	91.3	Very high	103 Å²	103	73.4 Å²	73.4	63%	0.632	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.6	-179.2	58.3	0	0	0	0	114.7	G442 A446 M447	G442-T444 PolarHBondContact O-N 2.83Å; T444-A446 PolarHBondContact O-N 3.26Å; T444-M447 PolarHBondContact O-N 2.94Å
445	I	90.5	Very high	91.4	Very high	130 Å²	130	66.4 Å²	66.4	67%	0.667	33%	0.326	S	S	*	.	H	α-helix	trans	-61.6	-31.2	175.6	-62.1	172.9	0	0	0	111.7	K443 M447 K448 H449	K443-I445 PolarHBondContact O-N 3.23Å; I445-M447 VanDerWaalsContact C-N 3.28Å; I445-M447 PolarHBondContact O-N 2.85Å; I445-K448 WeakPolarHBondContact O-CB 3.11Å; I445-K448 PolarHBondContact O-N 2.88Å; I445-H449 PolarHBondContact O-N 3.39Å
446	A	90.8	Very high	91.4	Very high	11 Å²	11	73 Å²	73	9%	0.091	35%	0.353	C	S	.	.	H	α-helix	trans	-60	-37	179.8	0	0	0	0	0	112.4	T435 D438 K443 T444 K448 H449 L450	T435-A446 HydrophobicContact CG2-CB 3.79Å; T435-A446 WeakPolarHBondContact O-CB 3.38Å; D438-A446 HydrophobicContact CB-CB 4.16Å; K443-A446 VanDerWaalsContact O-CB 3.27Å; K443-A446 WeakPolarHBondContact O-CB 3.25Å; K443-A446 PolarHBondContact O-N 3.46Å; T444-A446 PolarHBondContact O-N 3.26Å; A446-K448 VanDerWaalsContact C-N 3.29Å; A446-K448 PolarHBondContact O-N 3.43Å; A446-H449 WeakPolarHBondContact O-CA 3.23Å; A446-H449 VanDerWaalsContact O-CB 3.32Å; A446-H449 WeakPolarHBondContact O-CB 3.34Å; A446-H449 PolarHBondContact O-N 3.26Å; A446-L450 PolarHBondContact O-N 3.2Å
447	M	92.8	Very high	91.5	Very high	6 Å²	6	76 Å²	76	3%	0.03	37%	0.366	C	S	.	.	H	α-helix	trans	-58.2	-41.3	174.4	-179.7	58.9	74	0	0	111.8	Y439 T444 I445 H449 L450 L451 F471 E472 I475	Y439-M447 HydrophobicContact CD1-CE 4.27Å; Y439-M447 HydrophobicContact CD2-CB 3.83Å; Y439-M447 HydrophobicContact CE1-CE 3.69Å; Y439-M447 HydrophobicContact CE2-CB 3.63Å; Y439-M447 HydrophobicContact CE2-CE 3.96Å; Y439-M447 HydrophobicContact CE2-CG 4.42Å; T444-M447 PolarHBondContact O-N 2.94Å; I445-M447 VanDerWaalsContact C-N 3.28Å; I445-M447 PolarHBondContact O-N 2.85Å; M447-H449 PolarHBondContact O-N 2.8Å; M447-L450 PolarHBondContact O-N 2.79Å; M447-L451 HydrophobicContact CG-CD1 3.88Å; M447-L451 HydrophobicContact CG-CG 4.24Å; M447-L451 WeakPolarHBondContact O-CB 3.32Å; M447-L451 VanDerWaalsContact O-CG 3.22Å; M447-L451 WeakPolarHBondContact O-CG 3.5Å; M447-L451 PolarHBondContact O-N 3.33Å; M447-L451 HydrophobicContact SD-CD1 4.27Å; M447-L451 HydrophobicContact SD-CG 4.05Å; M447-F471 HydrophobicContact CE-CB 4.11Å; M447-F471 HydrophobicContact SD-CB 3.93Å; M447-F471 HydrophobicContact SD-CG 4.36Å; M447-E472 HydrophobicContact CE-CG 3.89Å; M447-I475 HydrophobicContact CE-CD1 3.86Å
448	K	92.1	Very high	91.6	Very high	156 Å²	156	71.3 Å²	71.3	68%	0.678	35%	0.345	S	S	*	.	H	α-helix	trans	-61.6	-33.7	176.7	-64.7	-177.4	178.2	176.8	0	111.8	I445 A446 R452	I445-K448 WeakPolarHBondContact O-CB 3.11Å; I445-K448 PolarHBondContact O-N 2.88Å; A446-K448 VanDerWaalsContact C-N 3.29Å; A446-K448 PolarHBondContact O-N 3.43Å; K448-R452 WeakPolarHBondContact O-CB 3.46Å; K448-R452 PolarHBondContact O-N 2.85Å; K448-R452 VanDerWaalsContact O-N 3.14Å
449	H	92.9	Very high	91.4	Very high	69 Å²	69	73.7 Å²	73.7	32%	0.319	36%	0.357	S	S	.	.	H	α-helix	trans	-69.6	-48.7	177.3	-165.2	88.2	0	0	0	111.7	T435 I445 A446 M447 L451 R452 I453	T435-H449 HydrophobicContact CG2-CB 4.08Å; I445-H449 PolarHBondContact O-N 3.39Å; A446-H449 WeakPolarHBondContact O-CA 3.23Å; A446-H449 VanDerWaalsContact O-CB 3.32Å; A446-H449 WeakPolarHBondContact O-CB 3.34Å; A446-H449 PolarHBondContact O-N 3.26Å; M447-H449 PolarHBondContact O-N 2.8Å; H449-L451 PolarHBondContact O-N 2.88Å; H449-R452 PolarHBondContact CE1-NH2 2.72Å; H449-R452 PolarHBondContact ND1-NH2 2.76Å; H449-R452 WeakPolarHBondContact O-CB 3.4Å; H449-R452 PolarHBondContact O-N 3.16Å; H449-R452 VanDerWaalsContact O-N 3.17Å; H449-I453 VanDerWaalsContact CD2-CD1 3.48Å; H449-I453 WeakPolarHBondContact CD2-CD1 3.29Å; H449-I453 WeakPolarHBondContact NE2-CD1 3.47Å; H449-I453 PolarHBondContact O-N 2.73Å; H449-I453 VanDerWaalsContact O-N 3.1Å
450	L	94.3	Very high	91.2	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58.1	-48.7	176.9	-63.8	174.5	0	0	0	111.5	V428 L429 E432 T435 A446 M447 R452 I453 A454 F471 I475	V428-L450 HydrophobicContact CG1-CD2 3.98Å; L429-L450 HydrophobicContact CD2-CD1 4.1Å; E432-L450 HydrophobicContact CB-CD2 3.69Å; E432-L450 HydrophobicContact CG-CD2 4.38Å; T435-L450 HydrophobicContact CG2-CD2 3.81Å; T435-L450 HydrophobicContact CG2-CG 3.82Å; A446-L450 PolarHBondContact O-N 3.2Å; M447-L450 PolarHBondContact O-N 2.79Å; L450-R452 VanDerWaalsContact C-N 3.27Å; L450-R452 PolarHBondContact O-N 3.44Å; L450-I453 PolarHBondContact O-N 3.39Å; L450-I453 VanDerWaalsContact O-N 3.16Å; L450-A454 PolarHBondContact O-N 2.84Å; L450-F471 HydrophobicContact CB-CE1 4.03Å; L450-F471 HydrophobicContact CB-CZ 4.03Å; L450-I475 HydrophobicContact CD1-CD1 4.48Å
451	L	94.1	Very high	91.2	Very high	18 Å²	18	70.9 Å²	70.9	9%	0.094	35%	0.346	C	S	.	.	H	α-helix	trans	-56.2	-41.4	176.2	-74.2	174.3	0	0	0	112.2	M447 H449 S455 M464 L467 R468 F471	M447-L451 HydrophobicContact CG-CD1 3.88Å; M447-L451 HydrophobicContact CG-CG 4.24Å; M447-L451 WeakPolarHBondContact O-CB 3.32Å; M447-L451 VanDerWaalsContact O-CG 3.22Å; M447-L451 WeakPolarHBondContact O-CG 3.5Å; M447-L451 PolarHBondContact O-N 3.33Å; M447-L451 HydrophobicContact SD-CD1 4.27Å; M447-L451 HydrophobicContact SD-CG 4.05Å; H449-L451 PolarHBondContact O-N 2.88Å; L451-S455 WeakPolarHBondContact O-CB 3.36Å; L451-S455 PolarHBondContact O-N 2.97Å; L451-M464 HydrophobicContact CB-CE 3.82Å; L451-M464 HydrophobicContact CD2-CE 4.41Å; L451-M464 HydrophobicContact CG-CE 4.5Å; L451-L467 HydrophobicContact CD2-CB 4.19Å; L451-L467 HydrophobicContact CD2-CD2 3.82Å; L451-L467 HydrophobicContact CD2-CG 3.77Å; L451-R468 HydrophobicContact CD1-CB 4.22Å; L451-R468 HydrophobicContact CD1-CG 4.34Å; L451-R468 HydrophobicContact CD2-CB 3.94Å; L451-F471 HydrophobicContact CD2-CD2 3.76Å; L451-F471 HydrophobicContact CD2-CE2 4.17Å
452	R	92.6	Very high	91.2	Very high	159 Å²	159	63.9 Å²	63.9	60%	0.6	32%	0.316	S	S	*	.	H	α-helix	trans	-65.7	-41.1	179.2	-175.5	-175.8	67.2	132.2	4.6	112	K448 H449 L450 K456	K448-R452 WeakPolarHBondContact O-CB 3.46Å; K448-R452 PolarHBondContact O-N 2.85Å; K448-R452 VanDerWaalsContact O-N 3.14Å; H449-R452 PolarHBondContact CE1-NH2 2.72Å; H449-R452 PolarHBondContact ND1-NH2 2.76Å; H449-R452 WeakPolarHBondContact O-CB 3.4Å; H449-R452 PolarHBondContact O-N 3.16Å; H449-R452 VanDerWaalsContact O-N 3.17Å; L450-R452 VanDerWaalsContact C-N 3.27Å; L450-R452 PolarHBondContact O-N 3.44Å; R452-K456 WeakPolarHBondContact O-CB 3.43Å; R452-K456 PolarHBondContact O-N 3.38Å; R452-K456 VanDerWaalsContact O-N 3.07Å
453	I	93.9	Very high	91.2	Very high	35 Å²	35	63 Å²	63	18%	0.179	30%	0.298	C	S	.	.	H	α-helix	trans	-67.7	-52.2	179.3	-65.6	171.3	0	0	0	110	V428 E432 H449 L450 S455 K456 Q457	V428-I453 HydrophobicContact CG1-CB 4.23Å; V428-I453 HydrophobicContact CG1-CG2 4.12Å; V428-I453 HydrophobicContact CG2-CG2 3.86Å; E432-I453 HydrophobicContact CG-CD1 3.66Å; H449-I453 VanDerWaalsContact CD2-CD1 3.48Å; H449-I453 WeakPolarHBondContact CD2-CD1 3.29Å; H449-I453 WeakPolarHBondContact NE2-CD1 3.47Å; H449-I453 PolarHBondContact O-N 2.73Å; H449-I453 VanDerWaalsContact O-N 3.1Å; L450-I453 PolarHBondContact O-N 3.39Å; L450-I453 VanDerWaalsContact O-N 3.16Å; I453-S455 VanDerWaalsContact C-N 3.33Å; I453-S455 PolarHBondContact O-N 3.13Å; I453-K456 WeakPolarHBondContact O-CA 3.44Å; I453-K456 WeakPolarHBondContact O-CB 3.36Å; I453-K456 PolarHBondContact O-N 3.14Å; I453-Q457 PolarHBondContact O-N 3.41Å
454	A	94	Very high	91.1	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-42.9	179.5	0	0	0	0	0	111.9	T424 V428 L450 K456 Q457 L458 L467 F471	T424-A454 HydrophobicContact CG2-CB 4.4Å; V428-A454 HydrophobicContact CG2-CB 4Å; L450-A454 PolarHBondContact O-N 2.84Å; A454-K456 VanDerWaalsContact C-N 3.27Å; A454-K456 PolarHBondContact O-N 3.4Å; A454-Q457 PolarHBondContact O-N 2.92Å; A454-Q457 VanDerWaalsContact O-N 3.17Å; A454-L458 WeakPolarHBondContact O-CB 3.41Å; A454-L458 WeakPolarHBondContact O-CG 3.43Å; A454-L458 PolarHBondContact O-N 3.44Å; A454-L467 HydrophobicContact CB-CD1 4.1Å; A454-L467 HydrophobicContact CB-CD2 4.08Å; A454-F471 HydrophobicContact CB-CE2 3.62Å; A454-F471 HydrophobicContact CB-CZ 3.72Å
455	S	92.3	Very high	91.2	Very high	14 Å²	14	63 Å²	63	10%	0.098	30%	0.295	C	S	.	.	H	α-helix	trans	-58.4	-40	174.1	-175.9	0	0	0	0	111.5	L451 I453 L458 D459 Q460	L451-S455 WeakPolarHBondContact O-CB 3.36Å; L451-S455 PolarHBondContact O-N 2.97Å; I453-S455 VanDerWaalsContact C-N 3.33Å; I453-S455 PolarHBondContact O-N 3.13Å; S455-L458 CarbonylContact O-C 3.43Å; S455-L458 PolarHBondContact O-N 2.74Å; S455-D459 PolarHBondContact O-N 2.77Å; S455-Q460 VanDerWaalsContact O-CA 3.23Å; S455-Q460 WeakPolarHBondContact O-CA 3.47Å; S455-Q460 PolarHBondContact O-N 3.41Å
456	K	92.3	Very high	91.1	Very high	160 Å²	160	61.6 Å²	61.6	70%	0.696	28%	0.284	S	S	*	.	H	α-helix	trans	-66.2	-40.2	176.2	-170.7	-175.8	177.2	-170.1	0	112.5	R452 I453 A454 L458 D459	R452-K456 WeakPolarHBondContact O-CB 3.43Å; R452-K456 PolarHBondContact O-N 3.38Å; R452-K456 VanDerWaalsContact O-N 3.07Å; I453-K456 WeakPolarHBondContact O-CA 3.44Å; I453-K456 WeakPolarHBondContact O-CB 3.36Å; I453-K456 PolarHBondContact O-N 3.14Å; A454-K456 VanDerWaalsContact C-N 3.27Å; A454-K456 PolarHBondContact O-N 3.4Å; K456-L458 VanDerWaalsContact C-N 3.25Å; K456-L458 PolarHBondContact O-N 3.48Å; K456-D459 PolarHBondContact O-N 3.43Å
457	Q	92.7	Very high	91.2	Very high	97 Å²	97	61 Å²	61	45%	0.453	28%	0.28	S	S	.	.	H	α-helix	trans	-66.6	-28.8	175.6	-71.2	-179.6	-9.5	0	0	112.3	T424 V428 I453 A454 D459	T424-Q457 HydrophobicContact CG2-CB 3.84Å; V428-Q457 VanDerWaalsContact CG2-OE1 3.24Å; I453-Q457 PolarHBondContact O-N 3.41Å; A454-Q457 PolarHBondContact O-N 2.92Å; A454-Q457 VanDerWaalsContact O-N 3.17Å; Q457-D459 VanDerWaalsContact C-N 3.27Å; Q457-D459 PolarHBondContact O-N 3.32Å
458	L	91.4	Very high	91.2	Very high	6 Å²	6	66.7 Å²	66.7	3%	0.031	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	24	173.7	-65.2	170.1	0	0	0	112.8	I415 T420 T424 A454 S455 K456 Q460 R461 V462 L467	I415-L458 HydrophobicContact CD1-CB 4.14Å; I415-L458 HydrophobicContact CD1-CD2 3.99Å; I415-L458 HydrophobicContact CG2-CD2 4.49Å; T420-L458 HydrophobicContact CG2-CD2 4.02Å; T424-L458 HydrophobicContact CG2-CD1 4.38Å; T424-L458 HydrophobicContact CG2-CD2 4.35Å; T424-L458 HydrophobicContact CG2-CG 4.05Å; T424-L458 WeakPolarHBondContact OG1-CD2 3.28Å; A454-L458 WeakPolarHBondContact O-CB 3.41Å; A454-L458 WeakPolarHBondContact O-CG 3.43Å; A454-L458 PolarHBondContact O-N 3.44Å; S455-L458 CarbonylContact O-C 3.43Å; S455-L458 PolarHBondContact O-N 2.74Å; K456-L458 VanDerWaalsContact C-N 3.25Å; K456-L458 PolarHBondContact O-N 3.48Å; L458-Q460 PolarHBondContact O-N 2.84Å; L458-R461 PolarHBondContact O-N 2.78Å; L458-V462 HydrophobicContact CB-CB 4.28Å; L458-V462 HydrophobicContact CB-CG1 4.15Å; L458-V462 HydrophobicContact CD1-CB 3.91Å; L458-V462 HydrophobicContact CD1-CG1 3.86Å; L458-V462 HydrophobicContact CD1-CG2 4.03Å; L458-L467 HydrophobicContact CD1-CD1 4.09Å
459	D	87.2	Confident	91.3	Very high	91 Å²	91	64.6 Å²	64.6	49%	0.487	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	20.7	-178.5	-60.4	-45.9	0	0	0	115.6	K379 S455 K456 Q457 R461	K379-D459 PolarHBondContact NZ-O 3.33Å; S455-D459 PolarHBondContact O-N 2.77Å; K456-D459 PolarHBondContact O-N 3.43Å; Q457-D459 VanDerWaalsContact C-N 3.27Å; Q457-D459 PolarHBondContact O-N 3.32Å; D459-R461 HydrophobicContact CB-CG 4.18Å; D459-R461 PolarHBondContact O-N 2.72Å; D459-R461 IonicContact OD2-CZ 2.75Å; D459-R461 IonicContact OD2-NE 3.18Å; D459-R461 IonicContact OD2-NH2 3.09Å; D459-R461 PolarHBondContact OD2-NH2 3.3Å
460	Q	86.9	Confident	91.3	Very high	72 Å²	72	61.5 Å²	61.5	34%	0.336	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	23.5	-173.2	-51.6	165.3	-34.4	0	0	113.3	S373 E375 S455 L458	S373-Q460 PolarHBondContact OG-O 2.81Å; E375-Q460 HydrophobicContact CB-CB 3.94Å; E375-Q460 HydrophobicContact CG-CB 3.71Å; E375-Q460 HydrophobicContact CG-CG 4.4Å; S455-Q460 VanDerWaalsContact O-CA 3.23Å; S455-Q460 WeakPolarHBondContact O-CA 3.47Å; S455-Q460 PolarHBondContact O-N 3.41Å; L458-Q460 PolarHBondContact O-N 2.84Å
461	R	88.6	Confident	91.3	Very high	40 Å²	40	61.5 Å²	61.5	15%	0.151	28%	0.28	C	S	.	.			trans	-98.6	31.1	178.9	-61.9	-177.1	-67.8	166.9	-4.7	111.7	N411 S414 I415 L458 D459	N411-R461 PolarHBondContact ND2-NH1 3.33Å; N411-R461 VanDerWaalsContact ND2-NH1 3.16Å; N411-R461 WeakPolarHBondContact O-CD 3.32Å; N411-R461 PolarHBondContact O-NH1 3.36Å; N411-R461 PolarHBondContact OD1-NH1 2.78Å; S414-R461 CarbonylContact C-O 3.41Å; S414-R461 WeakPolarHBondContact CA-O 3.44Å; S414-R461 PolarHBondContact OG-O 2.99Å; I415-R461 HydrophobicContact CD1-CB 4.22Å; I415-R461 HydrophobicContact CG1-CB 4.13Å; I415-R461 PolarHBondContact N-O 3.39Å; L458-R461 PolarHBondContact O-N 2.78Å; D459-R461 HydrophobicContact CB-CG 4.18Å; D459-R461 PolarHBondContact O-N 2.72Å; D459-R461 IonicContact OD2-CZ 2.75Å; D459-R461 IonicContact OD2-NE 3.18Å; D459-R461 IonicContact OD2-NH2 3.09Å; D459-R461 PolarHBondContact OD2-NH2 3.3Å
462	V	90.6	Very high	91.2	Very high	2 Å²	2	63.2 Å²	63.2	1%	0.012	29%	0.287	C	S	.	.	S	Bend	trans	-121.6	145.9	179.2	64.8	0	0	0	0	109.8	I421 L458 M464 L467	I421-V462 HydrophobicContact CD1-CG2 3.99Å; I421-V462 HydrophobicContact CG1-CG2 4.14Å; L458-V462 HydrophobicContact CB-CB 4.28Å; L458-V462 HydrophobicContact CB-CG1 4.15Å; L458-V462 HydrophobicContact CD1-CB 3.91Å; L458-V462 HydrophobicContact CD1-CG1 3.86Å; L458-V462 HydrophobicContact CD1-CG2 4.03Å; V462-M464 PolarHBondContact O-N 2.87Å; V462-L467 HydrophobicContact CG1-CB 4.45Å; V462-L467 HydrophobicContact CG1-CD2 3.91Å; V462-L467 HydrophobicContact CG2-CB 4.19Å; V462-L467 HydrophobicContact CG2-CD1 4.45Å
463	D	87.5	Confident	91.2	Very high	36 Å²	36	61.6 Å²	61.6	19%	0.193	28%	0.281	C	S	.	.			trans	-68.1	124.1	169.5	-174.4	-76	0	0	0	109.8	M465 K466 L467	D463-M465 VanDerWaalsContact C-N 3.3Å; D463-M465 PolarHBondContact O-N 3.37Å; D463-M465 WeakPolarHBondContact OD1-CA 3.34Å; D463-M465 VanDerWaalsContact OD1-CB 3.24Å; D463-M465 WeakPolarHBondContact OD1-CB 3.39Å; D463-M465 PolarHBondContact OD1-N 3.36Å; D463-K466 HydrophobicContact CB-CB 4.19Å; D463-K466 HydrophobicContact CB-CD 4.15Å; D463-K466 HydrophobicContact CB-CG 4.12Å; D463-K466 PolarHBondContact O-N 3.4Å; D463-K466 PolarHBondContact OD1-N 3.42Å; D463-L467 WeakPolarHBondContact O-CB 3.29Å; D463-L467 PolarHBondContact O-N 2.87Å
464	M	89.5	Confident	91.1	Very high	86 Å²	86	61.1 Å²	61.1	42%	0.424	28%	0.279	S	S	.	.	H	α-helix	trans	-70.5	-25.8	-173.6	-66.7	-60.8	-59.4	0	0	113.2	L451 V462 L467 R468	L451-M464 HydrophobicContact CB-CE 3.82Å; L451-M464 HydrophobicContact CD2-CE 4.41Å; L451-M464 HydrophobicContact CG-CE 4.5Å; V462-M464 PolarHBondContact O-N 2.87Å; M464-L467 HydrophobicContact CE-CD2 4.35Å; M464-L467 HydrophobicContact SD-CD2 4.28Å; M464-R468 WeakPolarHBondContact O-CB 3.49Å; M464-R468 PolarHBondContact O-N 2.92Å; M464-R468 VanDerWaalsContact O-N 3.13Å
465	M	88.3	Confident	90.9	Very high	135 Å²	135	61.6 Å²	61.6	67%	0.665	28%	0.281	S	S	*	.	H	α-helix	trans	-72.9	-49.2	176.8	-165.8	178.7	-70.9	0	0	109.4	D463 L467 R468 E469	D463-M465 VanDerWaalsContact C-N 3.3Å; D463-M465 PolarHBondContact O-N 3.37Å; D463-M465 WeakPolarHBondContact OD1-CA 3.34Å; D463-M465 VanDerWaalsContact OD1-CB 3.24Å; D463-M465 WeakPolarHBondContact OD1-CB 3.39Å; D463-M465 PolarHBondContact OD1-N 3.36Å; M465-L467 VanDerWaalsContact C-N 3.34Å; M465-L467 PolarHBondContact O-N 3.19Å; M465-R468 WeakPolarHBondContact O-CB 3.45Å; M465-R468 PolarHBondContact O-N 3.22Å; M465-R468 VanDerWaalsContact O-N 3.12Å; M465-E469 WeakPolarHBondContact O-CG 3.32Å; M465-E469 PolarHBondContact O-N 2.89Å
466	K	89.3	Confident	90.6	Very high	100 Å²	100	67.3 Å²	67.3	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-58.2	-44.9	174	-66.7	-174.8	179.9	178.9	0	112.1	D463 R468 E469 V470	D463-K466 HydrophobicContact CB-CB 4.19Å; D463-K466 HydrophobicContact CB-CD 4.15Å; D463-K466 HydrophobicContact CB-CG 4.12Å; D463-K466 PolarHBondContact O-N 3.4Å; D463-K466 PolarHBondContact OD1-N 3.42Å; K466-R468 VanDerWaalsContact C-N 3.27Å; K466-R468 PolarHBondContact O-N 3.2Å; K466-E469 PolarHBondContact O-N 3.01Å; K466-V470 WeakPolarHBondContact O-CG2 3.42Å; K466-V470 PolarHBondContact O-N 3.48Å
467	L	92.7	Very high	89.8	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.8	-41.6	177.6	-174.8	67.3	0	0	0	111.5	I421 C425 L451 A454 L458 V462 D463 M464 M465 V470 F471	I421-L467 HydrophobicContact CG2-CD1 3.86Å; C425-L467 VanDerWaalsContact SG-CD1 3.58Å; L451-L467 HydrophobicContact CD2-CB 4.19Å; L451-L467 HydrophobicContact CD2-CD2 3.82Å; L451-L467 HydrophobicContact CD2-CG 3.77Å; A454-L467 HydrophobicContact CB-CD1 4.1Å; A454-L467 HydrophobicContact CB-CD2 4.08Å; L458-L467 HydrophobicContact CD1-CD1 4.09Å; V462-L467 HydrophobicContact CG1-CB 4.45Å; V462-L467 HydrophobicContact CG1-CD2 3.91Å; V462-L467 HydrophobicContact CG2-CB 4.19Å; V462-L467 HydrophobicContact CG2-CD1 4.45Å; D463-L467 WeakPolarHBondContact O-CB 3.29Å; D463-L467 PolarHBondContact O-N 2.87Å; M464-L467 HydrophobicContact CE-CD2 4.35Å; M464-L467 HydrophobicContact SD-CD2 4.28Å; M465-L467 VanDerWaalsContact C-N 3.34Å; M465-L467 PolarHBondContact O-N 3.19Å; L467-V470 PolarHBondContact O-N 3.13Å; L467-F471 HydrophobicContact CD1-CD2 4.41Å; L467-F471 HydrophobicContact CD1-CE2 4.12Å; L467-F471 HydrophobicContact CD2-CE2 4.49Å; L467-F471 HydrophobicContact CG-CD2 4.14Å; L467-F471 HydrophobicContact CG-CE2 4.06Å; L467-F471 WeakPolarHBondContact O-CD2 3.48Å; L467-F471 PolarHBondContact O-N 3.02Å
468	R	93	Very high	88.2	Confident	125 Å²	125	64.2 Å²	64.2	47%	0.472	33%	0.331	S	S	.	.	H	α-helix	trans	-66.1	-45.7	177.6	-177.9	177.1	176.6	-174.8	-4.7	112.7	L451 M464 M465 K466 V470 F471 E472	L451-R468 HydrophobicContact CD1-CB 4.22Å; L451-R468 HydrophobicContact CD1-CG 4.34Å; L451-R468 HydrophobicContact CD2-CB 3.94Å; M464-R468 WeakPolarHBondContact O-CB 3.49Å; M464-R468 PolarHBondContact O-N 2.92Å; M464-R468 VanDerWaalsContact O-N 3.13Å; M465-R468 WeakPolarHBondContact O-CB 3.45Å; M465-R468 PolarHBondContact O-N 3.22Å; M465-R468 VanDerWaalsContact O-N 3.12Å; K466-R468 VanDerWaalsContact C-N 3.27Å; K466-R468 PolarHBondContact O-N 3.2Å; R468-V470 VanDerWaalsContact C-N 3.26Å; R468-V470 PolarHBondContact O-N 2.89Å; R468-F471 PolarHBondContact O-N 2.98Å; R468-E472 HydrophobicContact CG-CG 4.38Å; R468-E472 IonicContact CZ-OE1 3.91Å; R468-E472 IonicContact NE-OE1 3.46Å; R468-E472 PolarHBondContact NE-OE1 2.85Å; R468-E472 IonicContact NH2-OE1 3.81Å; R468-E472 PolarHBondContact NH2-OE1 2.78Å; R468-E472 WeakPolarHBondContact O-CG 3.37Å; R468-E472 PolarHBondContact O-N 2.81Å
469	E	92.9	Very high	88	Confident	112 Å²	112	67.1 Å²	67.1	52%	0.523	35%	0.346	S	S	.	.	H	α-helix	trans	-57.5	-41.4	175.6	-71.5	171.6	179.3	0	0	111.5	M465 K466 E472 R473	M465-E469 WeakPolarHBondContact O-CG 3.32Å; M465-E469 PolarHBondContact O-N 2.89Å; K466-E469 PolarHBondContact O-N 3.01Å; E469-E472 PolarHBondContact O-N 2.99Å; E469-R473 VanDerWaalsContact O-CB 3.27Å; E469-R473 WeakPolarHBondContact O-CB 3.28Å; E469-R473 PolarHBondContact O-N 3.04Å
470	V	93.3	Very high	88.1	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.024	34%	0.338	C	S	.	.	H	α-helix	trans	-64.3	-44.4	176.2	175.4	0	0	0	0	111.6	M418 I421 E422 C425 K466 L467 R468 R473 L474	M418-V470 HydrophobicContact CE-CG2 3.72Å; M418-V470 HydrophobicContact SD-CG2 4.26Å; I421-V470 HydrophobicContact CG2-CB 4.21Å; I421-V470 HydrophobicContact CG2-CG1 4.22Å; I421-V470 HydrophobicContact CG2-CG2 4.01Å; E422-V470 HydrophobicContact CG-CG1 3.79Å; C425-V470 HydrophobicContact CB-CG1 4.17Å; K466-V470 WeakPolarHBondContact O-CG2 3.42Å; K466-V470 PolarHBondContact O-N 3.48Å; L467-V470 PolarHBondContact O-N 3.13Å; R468-V470 VanDerWaalsContact C-N 3.26Å; R468-V470 PolarHBondContact O-N 2.89Å; V470-R473 PolarHBondContact O-N 3.02Å; V470-L474 HydrophobicContact CG1-CD1 3.89Å; V470-L474 HydrophobicContact CG1-CG 4.36Å; V470-L474 WeakPolarHBondContact O-CB 3.3Å; V470-L474 VanDerWaalsContact O-CG 3.28Å; V470-L474 WeakPolarHBondContact O-CG 3.22Å; V470-L474 PolarHBondContact O-N 3.36Å
471	F	93.9	Very high	88.1	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-60.6	-48.5	174.4	-90.8	-69.6	0	0	0	112.1	C425 V428 L429 M447 L450 L451 A454 L467 R468 R473 L474 I475	C425-F471 HydrophobicContact CB-CD1 4.31Å; C425-F471 HydrophobicContact CB-CE1 4.07Å; C425-F471 HydrophobicContact CB-CE2 4.43Å; C425-F471 HydrophobicContact CB-CZ 4.14Å; C425-F471 VanDerWaalsContact SG-CE2 3.58Å; V428-F471 HydrophobicContact CB-CE1 4.47Å; V428-F471 HydrophobicContact CB-CZ 4.18Å; V428-F471 HydrophobicContact CG1-CE1 4.29Å; V428-F471 HydrophobicContact CG1-CZ 3.99Å; L429-F471 HydrophobicContact CD1-CD1 4.32Å; L429-F471 HydrophobicContact CD2-CD1 3.96Å; L429-F471 HydrophobicContact CD2-CE1 3.93Å; L429-F471 HydrophobicContact CG-CD1 4.08Å; L429-F471 HydrophobicContact CG-CE1 3.87Å; M447-F471 HydrophobicContact CE-CB 4.11Å; M447-F471 HydrophobicContact SD-CB 3.93Å; M447-F471 HydrophobicContact SD-CG 4.36Å; L450-F471 HydrophobicContact CB-CE1 4.03Å; L450-F471 HydrophobicContact CB-CZ 4.03Å; L451-F471 HydrophobicContact CD2-CD2 3.76Å; L451-F471 HydrophobicContact CD2-CE2 4.17Å; A454-F471 HydrophobicContact CB-CE2 3.62Å; A454-F471 HydrophobicContact CB-CZ 3.72Å; L467-F471 HydrophobicContact CD1-CD2 4.41Å; L467-F471 HydrophobicContact CD1-CE2 4.12Å; L467-F471 HydrophobicContact CD2-CE2 4.49Å; L467-F471 HydrophobicContact CG-CD2 4.14Å; L467-F471 HydrophobicContact CG-CE2 4.06Å; L467-F471 WeakPolarHBondContact O-CD2 3.48Å; L467-F471 PolarHBondContact O-N 3.02Å; R468-F471 PolarHBondContact O-N 2.98Å; F471-R473 VanDerWaalsContact C-N 3.32Å; F471-R473 PolarHBondContact O-N 2.7Å; F471-L474 PolarHBondContact O-N 2.86Å; F471-I475 WeakPolarHBondContact O-CB 3.43Å; F471-I475 WeakPolarHBondContact O-CG1 3.48Å; F471-I475 PolarHBondContact O-N 3.49Å
472	E	92.4	Very high	88.1	Confident	54 Å²	54	67 Å²	67	25%	0.252	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-41.5	-179.5	-73.2	176.4	177.2	0	0	111.2	M447 R468 E469 I475 N476	M447-E472 HydrophobicContact CE-CG 3.89Å; R468-E472 HydrophobicContact CG-CG 4.38Å; R468-E472 IonicContact CZ-OE1 3.91Å; R468-E472 IonicContact NE-OE1 3.46Å; R468-E472 PolarHBondContact NE-OE1 2.85Å; R468-E472 IonicContact NH2-OE1 3.81Å; R468-E472 PolarHBondContact NH2-OE1 2.78Å; R468-E472 WeakPolarHBondContact O-CG 3.37Å; R468-E472 PolarHBondContact O-N 2.81Å; E469-E472 PolarHBondContact O-N 2.99Å; E472-I475 PolarHBondContact O-N 2.77Å; E472-N476 VanDerWaalsContact O-CB 3.3Å; E472-N476 WeakPolarHBondContact O-CB 3.46Å; E472-N476 PolarHBondContact O-N 2.94Å; E472-N476 PolarHBondContact O-ND2 3.1Å
473	R	93.1	Very high	87.9	Confident	125 Å²	125	71.1 Å²	71.1	47%	0.472	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-44.2	174.3	-176.9	176.8	55.1	146.1	7.1	112.6	M418 E422 E469 V470 F471 G477	M418-R473 VanDerWaalsContact CE-NH2 3.26Å; E422-R473 IonicContact OE1-CZ 2.82Å; E422-R473 IonicContact OE1-NH1 3.57Å; E422-R473 PolarHBondContact OE1-NH1 2.92Å; E422-R473 IonicContact OE1-NH2 3.68Å; E422-R473 PolarHBondContact OE1-NH2 3.3Å; E469-R473 VanDerWaalsContact O-CB 3.27Å; E469-R473 WeakPolarHBondContact O-CB 3.28Å; E469-R473 PolarHBondContact O-N 3.04Å; V470-R473 PolarHBondContact O-N 3.02Å; F471-R473 VanDerWaalsContact C-N 3.32Å; F471-R473 PolarHBondContact O-N 2.7Å; R473-G477 PolarHBondContact O-N 3.37Å
474	L	91.9	Very high	88	Confident	25 Å²	25	73.4 Å²	73.4	13%	0.131	38%	0.382	C	S	.	.	H	α-helix	trans	-66.9	-38.9	178.4	-72.8	172	0	0	0	112	C425 K426 L429 V470 F471 S478	C425-L474 HydrophobicContact CB-CD1 3.47Å; C425-L474 VanDerWaalsContact CB-CD1 3.47Å; K426-L474 HydrophobicContact CG-CD1 4.15Å; K426-L474 HydrophobicContact CG-CD2 4.32Å; L429-L474 HydrophobicContact CD1-CB 3.96Å; L429-L474 HydrophobicContact CD1-CD1 4.38Å; V470-L474 HydrophobicContact CG1-CD1 3.89Å; V470-L474 HydrophobicContact CG1-CG 4.36Å; V470-L474 WeakPolarHBondContact O-CB 3.3Å; V470-L474 VanDerWaalsContact O-CG 3.28Å; V470-L474 WeakPolarHBondContact O-CG 3.22Å; V470-L474 PolarHBondContact O-N 3.36Å; F471-L474 PolarHBondContact O-N 2.86Å; L474-S478 WeakPolarHBondContact O-CB 3.24Å; L474-S478 PolarHBondContact O-N 2.98Å; L474-S478 PolarHBondContact O-OG 2.93Å
475	I	89.8	Confident	87.9	Confident	9 Å²	9	72.5 Å²	72.5	5%	0.046	38%	0.379	C	S	.	.	H	α-helix	trans	-72.1	-36.9	-179.8	-66.5	169.3	0	0	0	111.6	L429 L436 Y439 K440 M447 L450 F471 E472 S478	L429-I475 HydrophobicContact CD1-CG1 4.3Å; L429-I475 HydrophobicContact CD2-CD1 4.2Å; L429-I475 HydrophobicContact CD2-CG1 4.06Å; L436-I475 HydrophobicContact CD1-CD1 3.94Å; L436-I475 HydrophobicContact CD1-CG1 3.75Å; L436-I475 HydrophobicContact CD1-CG2 4.12Å; Y439-I475 HydrophobicContact CD1-CD1 3.88Å; Y439-I475 HydrophobicContact CD1-CG2 4.18Å; Y439-I475 HydrophobicContact CE1-CD1 4.05Å; Y439-I475 HydrophobicContact CE1-CG2 4.26Å; K440-I475 HydrophobicContact CG-CG2 4.4Å; M447-I475 HydrophobicContact CE-CD1 3.86Å; L450-I475 HydrophobicContact CD1-CD1 4.48Å; F471-I475 WeakPolarHBondContact O-CB 3.43Å; F471-I475 WeakPolarHBondContact O-CG1 3.48Å; F471-I475 PolarHBondContact O-N 3.49Å; E472-I475 PolarHBondContact O-N 2.77Å; I475-S478 VanDerWaalsContact O-OXT 3.09Å
476	N	85.2	Confident	87.8	Confident	135 Å²	135	67.7 Å²	67.7	72%	0.722	36%	0.357	S	S	*	.	H	α-helix	trans	-81.8	-24.3	179	-66.9	-18.3	0	0	0	112.9	E472 S478	E472-N476 VanDerWaalsContact O-CB 3.3Å; E472-N476 WeakPolarHBondContact O-CB 3.46Å; E472-N476 PolarHBondContact O-N 2.94Å; E472-N476 PolarHBondContact O-ND2 3.1Å; N476-S478 VanDerWaalsContact C-N 3.3Å
477	G	76	Confident	87.7	Confident	70 Å²	70	65 Å²	65	72%	0.722	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-1.3	173	0	0	0	0	0	114.6	R473	R473-G477 PolarHBondContact O-N 3.37Å
478	S	58.2	Low	87.3	Confident	121 Å²	121	70.9 Å²	70.9	85%	0.846	38%	0.383	S	S	*	.			trans	-120.9	0	-179.1	-50.1	0	0	0	0	112.3	K440 L474 I475 N476	K440-S478 PolarHBondContact NZ-OXT 3.45Å; L474-S478 WeakPolarHBondContact O-CB 3.24Å; L474-S478 PolarHBondContact O-N 2.98Å; L474-S478 PolarHBondContact O-OG 2.93Å; I475-S478 VanDerWaalsContact O-OXT 3.09Å; N476-S478 VanDerWaalsContact C-N 3.3Å

Retrieved 478 of 478 residues in 414.7 ms (Link to these results)

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